data_2jsc_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 2jsc _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 ' 11' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.44 -6.39 55.17 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -175.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.6 mmp_? -90.47 -50.57 5.87 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.704 1.202 . . . . 0.0 108.96 167.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -44.01 -71.86 0.07 Allowed 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 127.87 2.468 . . . . 0.0 109.981 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -83.09 -8.19 85.95 Favored Glycine 0 CA--C 1.526 0.744 0 C-N-CA 119.112 -1.518 . . . . 0.0 115.259 -168.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.36 -45.66 53.68 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.482 1.641 . . . . 0.0 108.245 168.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.24 -23.4 57.52 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 118.084 -0.96 . . . . 0.0 112.804 174.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.8 tp -80.71 -34.89 34.21 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.508 1.049 . . . . 0.0 112.249 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -104.7 71.3 0.97 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 122.256 1.027 . . . . 0.0 110.463 169.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -132.59 143.17 47.6 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.93 1.292 . . . . 0.0 110.284 171.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -41.06 -68.21 0.1 Allowed 'Trans proline' 0 C--N 1.356 0.969 1 C-N-CA 127.012 5.141 . . . . 0.0 113.75 -173.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.449 ' HG1' ' CE1' ' A' ' 54' ' ' HIS . 0.7 OUTLIER -82.23 -32.86 29.53 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 116.896 -1.525 . . . . 0.0 110.801 -175.487 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.7 mtm180 -67.72 -41.48 83.46 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 116.256 -1.831 . . . . 0.0 113.893 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 38.7 t -55.52 -42.72 74.92 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 121.658 2.026 . . . . 0.0 110.545 170.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.89 -45.18 94.87 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.156 0.982 . . . . 0.0 113.184 175.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.6 mt -53.69 -56.55 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 124.395 1.078 . . . . 0.0 110.366 171.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 90.1 mt -61.66 -40.76 96.07 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.835 0.854 . . . . 0.0 111.713 -169.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.6 p -73.99 -30.3 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 175.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.21 -23.89 47.29 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.053 0.941 . . . . 0.0 113.522 174.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 tp -63.35 -44.26 95.34 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 121.09 -1.006 . . . . 0.0 110.987 173.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -47.86 -49.06 30.64 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 128.396 2.678 . . . . 0.0 112.226 177.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -93.6 14.6 18.42 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 127.444 2.298 . . . . 0.0 112.619 -179.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -134.95 -85.82 0.22 Allowed Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.568 1.556 . . . . 0.0 114.442 -175.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 27.8 m 41.38 30.28 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 126.771 2.029 . . . . 0.0 115.388 -168.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 2.3 m -80.39 -86.53 0.08 Allowed 'General case' 0 C--O 1.224 -0.266 0 O-C-N 121.822 -0.549 . . . . 0.0 110.654 -178.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -135.43 161.97 60.09 Favored Pre-proline 0 CA--C 1.538 0.5 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -169.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -54.07 124.15 15.24 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.377 2.718 . . . . 0.0 110.476 174.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.37 3.3 88.58 Favored Glycine 0 CA--C 1.528 0.882 0 CA-C-O 117.25 -1.861 . . . . 0.0 114.815 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.49 -30.58 70.7 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 121.012 2.406 . . . . 0.0 111.276 169.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.5 mt -53.7 -20.13 5.02 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 124.984 1.314 . . . . 0.0 112.674 172.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.29 -34.78 75.77 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.825 0.739 . . . . 0.0 111.319 176.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.43 -45.64 53.26 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.065 0.546 . . . . 0.0 111.159 175.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -60.17 -32.41 71.04 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 177.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 35.7 mt -103.3 -20.16 14.21 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -174.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.71 7.07 68.55 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.027 0.823 . . . . 0.0 113.905 -169.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.6 mt -108.69 150.48 27.5 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.945 1.298 . . . . 0.0 110.959 -174.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.0 p -60.87 145.74 49.03 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.315 0.578 . . . . 0.0 111.667 -169.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 40.5 ptt180 -59.54 -32.88 70.73 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 -177.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.4 m -64.6 -54.82 26.01 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.553 0.741 . . . . 0.0 111.29 169.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 55.9 t-20 -55.75 -54.1 48.58 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.794 1.238 . . . . 0.0 111.177 -178.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 97.4 t -58.38 -40.11 76.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 O-C-N 121.457 -0.777 . . . . 0.0 111.8 176.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 47.2 m -71.4 -28.65 64.16 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 114.217 1.191 . . . . 0.0 114.217 -177.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -49.27 -46.91 46.93 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.004 1.322 . . . . 0.0 111.59 173.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.449 ' CE1' ' HG1' ' A' ' 22' ' ' THR . 3.9 m80 -65.28 -27.05 68.36 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 178.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 60.3 mt -67.52 -31.03 70.86 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 118.833 0.742 . . . . 0.0 111.118 176.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 68.7 m -62.94 -8.07 6.45 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 174.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.2 t -99.16 -46.76 5.45 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 118.942 0.792 . . . . 0.0 111.514 164.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.4 tp -58.26 -36.08 72.71 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.178 2.591 . . . . 0.0 113.515 -168.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 80.2 mtm-85 -68.18 -41.71 81.04 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.626 0.771 . . . . 0.0 110.867 175.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -73.19 -36.66 55.89 Favored Glycine 0 N--CA 1.472 1.05 0 C-N-CA 124.094 0.854 . . . . 0.0 111.498 -177.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 27.4 m -67.26 -2.89 6.58 Favored 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 125.889 1.676 . . . . 0.0 113.398 168.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.22 -4.92 65.02 Favored Glycine 0 N--CA 1.47 0.929 0 C-N-CA 127.06 2.267 . . . . 0.0 114.829 174.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 73.5 mt -73.88 -20.71 60.33 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -169.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.6 m -134.21 144.99 33.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 C-N-CA 125.194 1.398 . . . . 0.0 111.941 177.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.4 t -127.23 138.43 54.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 125.161 1.384 . . . . 0.0 109.72 176.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.51 136.08 33.29 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.822 0.849 . . . . 0.0 111.003 173.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.98 179.79 5.38 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.938 2.095 . . . . 0.0 108.133 -175.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -119.26 147.83 43.82 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.945 1.698 . . . . 0.0 108.371 165.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.27 1.3 pp20? -119.66 -148.93 0.42 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.694 1.198 . . . . 0.0 111.578 176.154 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -70.38 -18.36 75.16 Favored Glycine 0 CA--C 1.535 1.341 0 CA-C-N 121.52 1.964 . . . . 0.0 115.251 -175.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.5 mmt180 -148.68 -17.82 0.32 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.538 1.681 . . . . 0.0 115.538 -177.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.55 -179.83 7.15 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 122.221 2.282 . . . . 0.0 112.335 -178.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 29.7 m -84.31 149.17 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.403 1.081 . . . . 0.0 111.253 172.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.1 ptt180 -126.67 170.93 11.6 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.782 1.233 . . . . 0.0 110.299 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -127.3 125.28 40.57 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.743 1.217 . . . . 0.0 109.611 169.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -128.73 153.81 46.99 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.547 1.539 . . . . 0.0 111.638 -177.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 82.8 mt -58.4 151.69 19.38 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 122.83 0.452 . . . . 0.0 109.858 170.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -49.03 -41.87 36.32 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.006 1.322 . . . . 0.0 114.031 -172.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -170.57 166.43 8.22 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 127.412 2.285 . . . . 0.0 109.135 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.1 m -36.24 -37.98 0.13 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 129.687 3.195 . . . . 0.0 112.297 165.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -44.19 -60.1 2.05 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 127.343 2.257 . . . . 0.0 113.394 171.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 13.4 mt -76.51 -34.98 58.58 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.255 0.934 . . . . 0.0 110.607 -177.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.17 -32.38 72.12 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 118.826 0.739 . . . . 0.0 112.733 176.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -77.47 -59.54 2.74 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.0 0.92 . . . . 0.0 110.941 176.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.85 -34.56 76.19 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tt -66.51 -46.44 76.23 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.238 -0.914 . . . . 0.0 108.858 168.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.02 -11.0 69.53 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 127.165 2.317 . . . . 0.0 117.078 -176.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -71.08 -40.03 71.81 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-N 121.728 2.764 . . . . 0.0 108.079 165.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.465 ' C ' ' H ' ' A' ' 91' ' ' GLN . 46.4 tp 90.91 112.62 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 131.628 3.971 . . . . 0.0 106.827 -167.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.5 m -39.31 -3.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 130.404 3.482 . . . . 0.0 117.925 169.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.465 ' H ' ' C ' ' A' ' 89' ' ' LEU . 1.4 mm-40 78.57 -28.79 0.15 Allowed 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 128.696 2.798 . . . . 0.0 112.814 164.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 8.0 p -59.18 35.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 C-N-CA 129.484 3.114 . . . . 0.0 115.697 173.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.411 ' H ' ' C ' ' A' ' 91' ' ' GLN . 2.0 t 73.84 5.06 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.891 0 C-N-CA 128.436 2.694 . . . . 0.0 112.025 169.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 85.1 104.52 0.05 OUTLIER 'General case' 0 C--N 1.346 0.439 0 C-N-CA 130.578 3.551 . . . . 0.0 106.226 -169.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.99 122.37 14.14 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.644 -0.66 . . . . 0.0 110.947 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.4 t -129.86 157.5 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 126.699 2.0 . . . . 0.0 106.688 168.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -54.52 123.6 13.58 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.724 0.809 . . . . 0.0 110.455 168.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -151.11 145.26 25.34 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.601 1.56 . . . . 0.0 108.728 -169.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -85.91 67.2 9.94 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.303 1.441 . . . . 0.0 110.529 -171.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -120.8 136.69 25.67 Favored Pre-proline 0 CA--C 1.551 1.012 0 O-C-N 121.195 -0.94 . . . . 0.0 111.171 176.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -85.63 -166.59 0.34 Allowed 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 124.755 3.637 . . . . 0.0 114.877 -166.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 8.6 t . . . . . 0 CA--C 1.551 1.008 0 C-N-CA 126.32 1.848 . . . . 0.0 112.307 173.3 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.0 tt . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.14 1.5 18.06 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.219 1.562 . . . . 0.0 115.219 -177.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -107.08 -54.02 2.53 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.795 2.038 . . . . 0.0 110.138 168.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -43.3 -56.67 3.39 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 127.513 2.325 . . . . 0.0 110.41 174.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.66 -35.08 62.58 Favored Glycine 0 C--N 1.339 0.706 0 C-N-CA 120.357 -0.925 . . . . 0.0 113.64 -172.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.31 -38.01 71.75 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.363 1.082 . . . . 0.0 109.912 -179.04 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.51 -32.53 58.35 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 117.192 -1.385 . . . . 0.0 113.221 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.8 mp -81.14 -37.07 29.43 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 120.886 1.676 . . . . 0.0 112.435 178.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -90.95 70.55 6.42 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.532 1.06 . . . . 0.0 111.858 173.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -146.06 141.29 16.41 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 125.702 1.601 . . . . 0.0 110.49 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -45.43 -62.56 0.43 Allowed 'Trans proline' 0 C--N 1.357 0.979 1 C-N-CA 126.574 4.849 . . . . 0.0 113.053 -173.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.487 ' HG1' ' CD2' ' B' ' 54' ' ' HIS . 1.2 p -84.01 -38.83 20.41 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-O 116.813 -1.565 . . . . 0.0 110.714 -175.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 25.1 mtm180 -67.51 -36.35 80.87 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 121.195 1.816 . . . . 0.0 114.02 -175.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 43.5 t -56.34 -47.44 78.81 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 121.073 1.761 . . . . 0.0 109.784 169.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.1 -36.31 81.34 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.054 1.341 . . . . 0.0 113.249 177.264 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 3.2 mt -60.41 -61.93 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.109 0.964 . . . . 0.0 109.565 171.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 90.8 mt -56.95 -43.58 81.69 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 124.318 1.012 . . . . 0.0 111.168 -169.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 6.3 p -69.51 -31.52 49.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.34 -16.65 48.49 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.163 0.892 . . . . 0.0 113.27 175.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 3.5 tp -71.8 -37.72 70.35 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.223 -0.923 . . . . 0.0 112.288 172.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -45.8 -47.97 15.65 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.254 2.222 . . . . 0.0 111.65 170.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -100.17 22.39 11.49 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 127.23 2.212 . . . . 0.0 112.704 176.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -128.81 -95.1 0.8 Allowed Glycine 0 N--CA 1.476 1.305 0 C-N-CA 126.0 1.762 . . . . 0.0 114.67 -173.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 32.9 m 39.16 35.39 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 128.095 2.558 . . . . 0.0 116.64 -169.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 88.9 m -82.18 -106.8 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 122.91 0.484 . . . . 0.0 111.07 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -125.54 165.57 25.88 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 -169.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -55.47 124.25 15.82 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 122.557 2.171 . . . . 0.0 110.684 177.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.15 -1.34 88.85 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 117.82 -1.545 . . . . 0.0 115.267 -175.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -26.09 64.55 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 121.054 2.427 . . . . 0.0 113.663 177.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 10.3 mt -64.94 -18.61 65.39 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 123.752 0.821 . . . . 0.0 111.735 177.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.7 -36.98 72.7 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.86 0.754 . . . . 0.0 112.188 174.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.82 -41.43 68.21 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.838 0.745 . . . . 0.0 111.234 174.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -64.26 -33.21 75.3 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 177.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 38.5 mt -104.7 -21.15 13.43 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -172.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.29 -1.48 42.16 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 124.959 1.266 . . . . 0.0 113.944 -169.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 86.8 mt -93.73 153.25 18.43 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.28 1.432 . . . . 0.0 110.552 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 29.9 p -63.75 150.65 44.07 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 121.214 -0.929 . . . . 0.0 111.924 -169.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 40.9 ptt180 -59.43 -24.77 63.78 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 175.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 4.4 m -68.51 -59.8 2.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.52 1.528 . . . . 0.0 110.463 168.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -48.51 -56.76 7.44 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.359 1.864 . . . . 0.0 111.363 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 24.5 t -67.07 -35.31 74.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 O-C-N 121.085 -1.009 . . . . 0.0 112.732 -174.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 52.8 m -68.74 -28.83 67.17 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 34.5 t-20 -51.14 -51.41 53.85 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.855 1.262 . . . . 0.0 111.222 172.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . 0.487 ' CD2' ' HG1' ' B' ' 22' ' ' THR . 1.4 m80 -68.07 -28.43 67.35 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.963 -1.086 . . . . 0.0 113.086 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 92.9 mt -65.04 -30.21 71.17 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.646 -0.659 . . . . 0.0 111.236 173.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 66.3 m -67.63 -7.13 24.04 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 53.3 t -95.71 -44.18 7.56 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.672 0.789 . . . . 0.0 110.544 164.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 7.7 tp -64.14 -37.83 88.85 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 127.621 2.368 . . . . 0.0 113.179 -168.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 75.9 mtm-85 -70.93 -22.43 62.24 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.13 0.572 . . . . 0.0 112.001 174.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -86.55 -37.95 8.5 Favored Glycine 0 N--CA 1.473 1.164 0 C-N-CA 124.86 1.219 . . . . 0.0 111.423 178.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 48.2 m -68.26 -4.21 13.44 Favored 'General case' 0 CA--C 1.56 1.348 0 C-N-CA 125.906 1.683 . . . . 0.0 112.032 168.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.23 -22.75 6.77 Favored Glycine 0 N--CA 1.47 0.955 0 C-N-CA 128.479 2.942 . . . . 0.0 114.868 177.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 89.8 mt -52.59 -22.16 4.68 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 129.285 3.034 . . . . 0.0 116.235 -168.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.95 138.42 54.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 125.02 1.328 . . . . 0.0 109.648 172.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 41.4 t -114.27 122.56 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 125.073 1.349 . . . . 0.0 108.812 178.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -88.41 119.29 28.71 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.609 1.164 . . . . 0.0 109.7 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.7 -177.17 3.66 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 127.059 2.144 . . . . 0.0 109.711 -167.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -123.08 142.59 50.71 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.699 2.0 . . . . 0.0 108.784 166.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -113.25 -149.37 0.45 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.442 1.497 . . . . 0.0 111.813 176.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -71.21 -19.92 77.71 Favored Glycine 0 CA--C 1.535 1.342 0 O-C-N 119.801 -1.812 . . . . 0.0 114.81 -173.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 36.8 mmt180 -144.81 -18.6 0.52 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.547 1.539 . . . . 0.0 115.087 -177.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.47 -179.17 7.0 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 121.704 2.047 . . . . 0.0 113.174 -175.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 18.6 m -87.25 150.94 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 124.553 1.141 . . . . 0.0 111.345 177.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 15.1 ptt180 -135.85 169.75 17.08 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.995 0.918 . . . . 0.0 110.761 -174.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 40.0 m-85 -123.64 113.89 19.27 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 168.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -109.29 156.06 20.41 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.727 1.211 . . . . 0.0 111.161 177.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 82.8 mt -59.17 150.02 26.56 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.754 0.707 . . . . 0.0 109.499 169.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -51.57 -35.55 41.64 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.393 1.077 . . . . 0.0 113.818 -171.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -173.31 168.69 4.61 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.882 2.473 . . . . 0.0 109.176 175.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -34.07 -35.6 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 129.655 3.182 . . . . 0.0 112.307 164.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -37.64 -67.41 0.19 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 127.703 2.401 . . . . 0.0 113.518 169.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 16.6 mt -77.24 -35.61 55.26 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 118.975 -0.536 . . . . 0.0 109.766 -174.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.92 -30.79 66.2 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.8 -60.05 2.3 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.362 -0.836 . . . . 0.0 111.112 175.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.91 -29.17 70.03 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -176.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.63 -32.21 47.3 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 120.78 -1.2 . . . . 0.0 111.433 169.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.27 -18.76 79.86 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 126.525 2.012 . . . . 0.0 115.367 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.58 -32.73 64.28 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 120.688 2.244 . . . . 0.0 108.99 165.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . 0.476 ' C ' ' H ' ' B' ' 91' ' ' GLN . 39.7 tp 77.28 127.09 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 130.652 3.581 . . . . 0.0 108.388 -169.11 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 12.8 m -44.03 -7.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 127.993 2.517 . . . . 0.0 116.734 169.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.476 ' H ' ' C ' ' B' ' 89' ' ' LEU . 4.5 mm-40 73.63 -21.1 0.27 Allowed 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 127.215 2.206 . . . . 0.0 114.054 165.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 5.9 p -60.48 41.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 129.881 3.272 . . . . 0.0 114.792 171.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER 67.64 -0.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 C-N-CA 128.708 2.803 . . . . 0.0 113.633 177.461 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.0 tt 89.49 105.7 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 130.394 3.478 . . . . 0.0 105.431 -168.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.688 0 C-N-CA 122.794 0.438 . . . . 0.0 111.063 -178.911 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? . . . . . 0 CA--C 1.537 0.468 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.47 -39.76 80.82 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 118.818 0.735 . . . . 0.0 111.734 167.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.2 mtp180 -60.02 -32.13 70.6 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 121.029 -1.044 . . . . 0.0 112.317 174.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.39 -43.6 98.43 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.281 1.032 . . . . 0.0 111.578 177.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -74.53 -33.98 54.98 Favored Glycine 0 N--CA 1.474 1.179 0 CA-C-N 118.59 0.632 . . . . 0.0 112.695 176.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 16.3 mtp180 -55.24 -49.66 71.44 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.304 1.042 . . . . 0.0 109.721 170.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.76 -28.39 63.61 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 mp -85.92 -20.28 29.24 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.252 0.933 . . . . 0.0 113.325 -177.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -96.88 16.92 17.97 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.28 165.17 9.27 Favored Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 125.931 1.692 . . . . 0.0 112.05 168.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -69.34 -115.57 0.0 OUTLIER 'Trans proline' 0 CA--C 1.554 1.502 1 C-N-CA 126.314 4.676 . . . . 0.0 111.519 172.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -37.5 -35.7 0.14 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 128.626 2.771 . . . . 0.0 115.245 169.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.501 HH12 ' CB ' ' A' ' 57' ' ' CYS . 6.4 ttm-85 -64.12 -38.45 91.12 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 120.008 1.277 . . . . 0.0 112.974 178.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.9 t -58.35 -43.61 88.43 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.501 1.046 . . . . 0.0 109.855 174.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -38.05 89.69 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 173.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 6.2 mm -57.95 -47.83 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 125.433 1.493 . . . . 0.0 111.337 171.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.3 mt -65.49 -43.61 89.63 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.52 -0.738 . . . . 0.0 112.075 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.4 p -71.81 -24.17 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 CA-C-N 119.076 0.853 . . . . 0.0 112.243 175.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.0 -38.03 79.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.439 0.696 . . . . 0.0 111.214 171.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 25.4 mt -71.99 -33.5 68.16 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -178.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -39.55 -50.96 2.23 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.322 2.249 . . . . 0.0 112.94 170.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -97.7 -20.36 17.65 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.575 1.15 . . . . 0.0 113.107 173.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.95 15.93 54.84 Favored Glycine 0 N--CA 1.469 0.897 0 C-N-CA 126.661 2.077 . . . . 0.0 116.552 -165.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 1.8 m -50.47 74.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 127.251 2.22 . . . . 0.0 115.575 171.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 9.0 t -144.44 -54.22 0.33 Allowed 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.474 1.657 . . . . 0.0 115.474 -174.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 12.3 p90 -158.24 157.08 28.83 Favored Pre-proline 0 N--CA 1.481 1.1 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 177.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -53.94 127.89 27.46 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.943 2.429 . . . . 0.0 108.737 168.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.93 -3.08 62.26 Favored Glycine 0 CA--C 1.53 1.021 0 CA-C-O 117.484 -1.731 . . . . 0.0 115.006 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.87 -34.38 62.92 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 120.595 2.198 . . . . 0.0 110.902 169.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.581 HD13 ' H ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -62.16 -17.79 59.0 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 127.147 2.179 . . . . 0.0 112.204 -178.441 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.07 -43.99 97.06 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.028 0.531 . . . . 0.0 111.002 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.05 -38.69 75.88 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.806 -0.559 . . . . 0.0 111.957 173.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -73.49 -15.6 61.31 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 -177.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 30.0 mt -110.53 -24.84 10.33 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.435 1.494 . . . . 0.0 113.842 174.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.56 6.89 88.85 Favored Glycine 0 CA--C 1.533 1.197 0 CA-C-N 119.554 1.07 . . . . 0.0 112.514 -168.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.8 mt -110.93 148.94 31.4 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.355 1.062 . . . . 0.0 111.693 -170.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.448 HG23 ' H ' ' A' ' 50' ' ' ASN . 3.4 t -58.31 149.71 23.8 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.795 0.838 . . . . 0.0 112.839 -172.057 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.7 mtm-85 -48.43 -37.14 16.37 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.977 1.711 . . . . 0.0 111.632 172.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.6 m -60.79 -60.01 4.48 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.281 1.032 . . . . 0.0 111.376 175.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.448 ' H ' HG23 ' A' ' 47' ' ' THR . 7.9 m-20 -67.97 -34.37 76.43 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.603 -0.685 . . . . 0.0 111.011 -175.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.9 t -57.21 -52.78 52.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 123.448 0.699 . . . . 0.0 111.191 169.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 13.1 p -72.67 -26.79 61.76 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -177.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -49.63 -48.38 49.2 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.355 1.074 . . . . 0.0 111.438 174.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -78.8 -18.21 54.46 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 177.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 56.9 mt -70.72 -21.46 62.54 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 120.995 1.725 . . . . 0.0 112.042 172.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.0 t -63.21 -53.29 55.43 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.534 1.061 . . . . 0.0 110.908 176.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.501 ' CB ' HH12 ' A' ' 23' ' ' ARG . 48.9 t -78.94 12.81 1.99 Allowed 'General case' 0 CA--C 1.561 1.367 0 C-N-CA 125.557 1.543 . . . . 0.0 112.611 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -106.96 -52.22 2.8 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 126.821 2.048 . . . . 0.0 111.216 175.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 44.7 mtm105 -81.78 -25.76 34.99 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.692 0.797 . . . . 0.0 112.422 -170.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.64 -31.11 9.01 Favored Glycine 0 N--CA 1.474 1.233 0 C-N-CA 124.034 0.826 . . . . 0.0 113.715 178.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 41.5 m -82.39 -5.92 58.94 Favored 'General case' 0 CA--C 1.567 1.618 0 C-N-CA 126.065 1.746 . . . . 0.0 113.596 173.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.75 -3.68 83.25 Favored Glycine 0 N--CA 1.478 1.456 0 C-N-CA 126.831 2.158 . . . . 0.0 116.891 170.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.7 mt -56.62 -22.31 33.19 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.997 1.719 . . . . 0.0 114.195 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.9 m -143.97 149.68 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 C-N-CA 126.689 1.996 . . . . 0.0 111.842 177.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 97.7 t -115.61 143.13 26.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 126.464 1.905 . . . . 0.0 109.276 176.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -99.2 123.25 43.34 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.975 0.91 . . . . 0.0 111.953 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -124.36 162.54 23.62 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.645 1.178 . . . . 0.0 109.348 -178.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -91.86 126.55 36.99 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 164.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.258 0.0 OUTLIER -90.85 4.03 52.87 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -179.544 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 109.25 -15.79 32.77 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 125.124 1.345 . . . . 0.0 113.32 175.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.58 -45.08 2.2 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 128.197 2.599 . . . . 0.0 111.602 172.162 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -139.69 169.11 18.33 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.312 2.245 . . . . 0.0 110.917 -168.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 7.1 p -83.24 145.16 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 O-C-N 121.328 -0.857 . . . . 0.0 109.877 167.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.1 ptt180 -134.54 172.91 12.26 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.457 1.103 . . . . 0.0 111.829 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -122.77 124.62 43.75 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.483 1.113 . . . . 0.0 110.651 173.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -123.63 143.18 50.39 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.122 1.369 . . . . 0.0 110.768 -177.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.2 tp -52.14 143.73 13.71 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.589 1.156 . . . . 0.0 111.492 177.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -45.79 -38.87 7.62 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 115.907 1.817 . . . . 0.0 115.907 -173.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -176.41 168.32 2.75 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.515 1.926 . . . . 0.0 109.803 -175.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.3 p -41.94 -31.54 0.35 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.852 2.061 . . . . 0.0 112.174 164.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -46.81 -67.04 0.32 Allowed 'General case' 0 C--N 1.345 0.37 0 C-N-CA 127.249 2.22 . . . . 0.0 113.566 169.141 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 13.8 mt -68.09 -34.71 76.91 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 119.527 1.058 . . . . 0.0 109.813 178.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.29 -32.29 73.87 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.819 0.736 . . . . 0.0 112.357 -172.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.2 -58.84 3.03 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.911 0.884 . . . . 0.0 112.31 170.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.75 -28.41 69.86 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.958 1.254 . . . . 0.0 113.59 -174.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.99 -33.13 21.17 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.906 0.882 . . . . 0.0 112.611 172.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.05 -31.86 75.83 Favored Glycine 0 CA--C 1.539 1.583 0 C-N-CA 125.064 1.316 . . . . 0.0 113.155 175.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -62.67 -23.36 67.07 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.467 1.907 . . . . 0.0 111.299 166.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 46.2 tp 81.67 128.26 0.05 OUTLIER 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 130.305 3.442 . . . . 0.0 107.047 -174.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 76.3 t -65.06 5.81 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 125.433 1.493 . . . . 0.0 114.544 -169.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.408 ' C ' ' H ' ' A' ' 93' ' ' VAL . 2.5 tp-100 88.07 -26.86 0.07 Allowed 'General case' 0 C--O 1.217 -0.619 0 O-C-N 120.12 -1.612 . . . . 0.0 111.191 132.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.3 p -63.97 35.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 130.327 3.451 . . . . 0.0 112.666 167.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.408 ' H ' ' C ' ' A' ' 91' ' ' GLN . 0.2 OUTLIER 59.18 8.36 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 C-N-CA 128.007 2.523 . . . . 0.0 114.047 176.653 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 96.63 111.24 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 131.141 3.776 . . . . 0.0 106.791 -166.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.51 96.57 0.17 Allowed 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.925 -0.485 . . . . 0.0 110.895 175.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.0 t -52.98 147.44 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 167.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.17 34.58 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 129.526 3.13 . . . . 0.0 113.665 -175.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.2 p -100.34 129.03 46.28 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 126.153 1.781 . . . . 0.0 111.421 -176.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.4 ' CG ' HH12 ' B' ' 16' ' ' ARG . 31.3 t0 -127.35 153.83 45.72 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.379 166.266 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -170.63 163.03 5.84 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 126.569 1.948 . . . . 0.0 108.904 -167.032 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -64.76 155.11 69.17 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.187 1.925 . . . . 0.0 110.15 169.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.542 0.644 0 CA-C-O 122.179 0.99 . . . . 0.0 113.43 -172.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mm? . . . . . 0 CA--C 1.534 0.36 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.24 -31.74 72.34 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 120.27 1.396 . . . . 0.0 112.511 168.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -61.43 -32.75 72.73 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.374 -0.829 . . . . 0.0 111.835 173.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -50.78 -57.84 7.4 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.85 1.26 . . . . 0.0 109.498 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.3 -34.03 88.84 Favored Glycine 0 CA--C 1.53 1.03 0 O-C-N 121.803 -0.561 . . . . 0.0 112.827 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.4 HH12 ' CG ' ' A' ' 99' ' ' ASP . 17.5 mtp180 -69.6 -11.52 60.9 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.035 1.334 . . . . 0.0 114.16 173.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.53 -8.11 14.67 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.756 1.622 . . . . 0.0 113.763 170.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -96.79 -29.98 13.44 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 119.909 1.231 . . . . 0.0 113.197 175.127 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -88.53 36.42 0.79 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.47 1.108 . . . . 0.0 112.604 173.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.434 ' CG ' ' HE ' ' B' ' 23' ' ' ARG . 0.1 OUTLIER -78.6 167.04 38.44 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 128.217 2.607 . . . . 0.0 112.46 172.882 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -69.12 -115.63 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.358 1 C-N-CA 126.686 4.924 . . . . 0.0 111.767 169.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -42.17 -33.67 0.64 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 128.314 2.645 . . . . 0.0 114.412 176.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . 0.552 HH12 ' CB ' ' B' ' 57' ' ' CYS . 6.9 ttm-85 -59.92 -32.14 70.49 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 117.957 -1.021 . . . . 0.0 112.91 178.237 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 1.6 m -53.37 -56.64 15.08 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.403 1.002 . . . . 0.0 109.716 169.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -35.57 80.78 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 117.799 -1.096 . . . . 0.0 112.189 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 5.2 mm -53.74 -50.96 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 CA-C-N 120.778 1.626 . . . . 0.0 112.279 170.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 42.6 mt -69.21 -40.84 77.74 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.555 -0.736 . . . . 0.0 112.062 -174.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 12.5 p -74.38 -25.25 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-N 118.995 0.816 . . . . 0.0 112.276 175.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.3 -27.92 68.95 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.1 -1.0 . . . . 0.0 111.996 170.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 4.9 mp -67.82 -51.08 52.75 Favored 'General case' 0 C--O 1.226 -0.16 0 CA-C-O 117.176 -1.392 . . . . 0.0 111.598 168.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 4.7 mt -44.48 -46.03 9.5 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.767 1.227 . . . . 0.0 112.022 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -81.07 3.52 23.0 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 126.932 2.093 . . . . 0.0 113.998 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -153.12 -63.31 0.01 OUTLIER Glycine 0 N--CA 1.478 1.452 0 N-CA-C 118.049 1.98 . . . . 0.0 118.049 -167.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 16.0 m 33.42 40.37 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 127.854 2.462 . . . . 0.0 115.915 -169.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 3.6 t -96.74 -60.84 1.51 Allowed 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 -169.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -158.97 159.22 29.43 Favored Pre-proline 0 N--CA 1.479 1.008 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 -174.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -60.09 124.54 15.46 Favored 'Trans proline' 0 C--N 1.356 0.93 0 C-N-CA 123.112 2.542 . . . . 0.0 110.368 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.28 -4.62 85.3 Favored Glycine 0 CA--C 1.527 0.832 0 CA-C-O 117.423 -1.765 . . . . 0.0 114.331 -175.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . 0.576 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -55.94 -36.05 67.33 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 120.002 1.901 . . . . 0.0 109.776 169.322 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.563 HD13 ' H ' ' B' ' 40' ' ' LEU . 0.3 OUTLIER -60.94 -18.92 59.7 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 125.916 1.686 . . . . 0.0 112.574 179.799 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.99 -58.29 5.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 118.397 0.544 . . . . 0.0 110.222 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.34 -33.08 74.74 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 122.669 0.387 . . . . 0.0 111.286 176.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . 0.576 ' CD2' HE22 ' B' ' 39' ' ' GLN . 0.6 OUTLIER -71.94 -13.28 61.59 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 179.77 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 33.5 mt -117.85 -23.66 7.44 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.969 1.707 . . . . 0.0 113.721 177.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.7 12.04 84.03 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 124.633 1.111 . . . . 0.0 111.808 -167.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 94.8 mt -124.82 132.48 53.33 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 118.599 1.199 . . . . 0.0 112.209 -169.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 8.7 t -48.87 145.96 3.55 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.134 1.774 . . . . 0.0 115.448 -169.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 38.8 mtm-85 -49.68 -34.96 20.01 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.726 2.01 . . . . 0.0 112.508 177.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 5.9 m -61.72 -59.33 5.33 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.588 0.755 . . . . 0.0 110.989 174.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -64.59 -37.24 86.87 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.029 0.932 . . . . 0.0 111.534 -178.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.1 t -55.76 -49.93 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 C-N-CA 123.611 0.764 . . . . 0.0 111.177 169.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 15.4 p -76.38 -25.42 54.56 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 -176.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -51.3 -49.14 61.86 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.461 1.104 . . . . 0.0 110.969 170.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 60.3 m-70 -75.79 -22.4 56.42 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 173.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 91.6 mt -67.71 -23.07 65.24 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 121.008 1.731 . . . . 0.0 112.221 171.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.8 t -62.41 -53.55 53.2 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.718 1.144 . . . . 0.0 111.336 178.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . 0.552 ' CB ' HH12 ' B' ' 23' ' ' ARG 0.265 42.2 t -82.79 15.47 2.65 Favored 'General case' 0 CA--C 1.559 1.32 0 CA-C-O 122.417 1.104 . . . . 0.0 111.705 -178.991 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . 0.452 ' CD1' ' HD3' ' B' ' 23' ' ' ARG . 1.3 tp -105.28 -51.18 3.07 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 127.638 2.375 . . . . 0.0 111.708 173.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 29.9 mtm105 -89.63 -8.33 52.76 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.597 1.159 . . . . 0.0 112.656 -170.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -106.35 -29.84 4.64 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.356 1.455 . . . . 0.0 113.291 172.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 97.8 m -87.11 8.99 21.31 Favored 'General case' 0 CA--C 1.563 1.475 0 C-N-CA 126.067 1.747 . . . . 0.0 113.293 171.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.37 -13.84 14.45 Favored Glycine 0 N--CA 1.476 1.334 0 C-N-CA 126.825 2.155 . . . . 0.0 117.017 170.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 91.5 mt -48.79 -26.14 2.22 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.479 1.912 . . . . 0.0 114.88 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 4.0 m -136.99 150.64 26.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 126.186 1.794 . . . . 0.0 111.688 173.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 90.2 t -118.76 148.59 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 126.659 1.984 . . . . 0.0 108.661 170.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.92 135.12 51.92 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.784 1.234 . . . . 0.0 112.406 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.4 p -120.35 -178.49 3.7 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.811 1.244 . . . . 0.0 110.836 176.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -97.63 135.01 40.05 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 104.866 -2.272 . . . . 0.0 104.866 160.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.57 -11.94 23.11 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 115.146 1.535 . . . . 0.0 115.146 177.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 117.55 -34.15 4.65 Favored Glycine 0 N--CA 1.474 1.176 0 C-N-CA 124.85 1.214 . . . . 0.0 112.874 176.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -96.75 -35.39 11.0 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 125.85 1.66 . . . . 0.0 111.454 169.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -155.05 -141.74 0.1 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 128.046 2.538 . . . . 0.0 110.382 -177.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 15.2 m -133.65 152.9 35.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 127.152 2.181 . . . . 0.0 108.583 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 7.2 ptt85 -135.04 173.83 11.28 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.077 0.853 . . . . 0.0 111.751 -173.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -121.71 141.96 50.64 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.531 1.132 . . . . 0.0 109.063 168.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -142.42 145.06 33.4 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.851 1.261 . . . . 0.0 109.003 -178.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 tp -51.91 147.26 7.24 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.41 1.084 . . . . 0.0 111.05 175.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -49.57 -43.01 45.86 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 115.0 1.481 . . . . 0.0 115.0 -175.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -168.36 163.44 12.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.934 1.694 . . . . 0.0 110.61 -174.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 97.3 p -40.81 -33.92 0.34 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.624 2.37 . . . . 0.0 113.468 167.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -58.98 -54.95 41.38 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.344 1.058 . . . . 0.0 113.817 175.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 20.2 mt -66.37 -31.35 72.07 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.465 1.029 . . . . 0.0 109.746 177.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.22 -32.22 73.72 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 118.512 0.596 . . . . 0.0 109.512 178.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 2.8 mmt85 -71.57 -57.09 4.71 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.709 1.204 . . . . 0.0 111.123 168.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.45 -32.56 62.87 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.942 1.246 . . . . 0.0 114.036 -177.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -87.97 -37.47 16.36 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 172.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -81.42 -42.93 8.87 Favored Glycine 0 CA--C 1.539 1.533 0 C-N-CA 124.767 1.175 . . . . 0.0 113.984 -171.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -71.06 -35.88 72.09 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.8 1.24 . . . . 0.0 108.29 166.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 21.6 tp 93.76 144.34 0.02 OUTLIER 'General case' 0 C--N 1.342 0.268 0 C-N-CA 130.736 3.614 . . . . 0.0 111.434 168.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . 0.41 ' C ' ' H ' ' B' ' 92' ' ' VAL . 1.5 m -53.2 -14.91 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 126.162 1.785 . . . . 0.0 113.897 171.115 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 65.42 -13.18 0.13 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 127.026 2.131 . . . . 0.0 114.011 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.41 ' H ' ' C ' ' B' ' 90' ' ' VAL . 1.3 p -58.02 24.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 130.635 3.574 . . . . 0.0 117.423 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.3 t 65.63 13.96 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 126.949 2.1 . . . . 0.0 111.358 171.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 78.75 116.15 0.06 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.604 2.362 . . . . 0.0 108.123 -167.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.552 1.051 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 169.737 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 mm? . . . . . 0 CA--C 1.539 0.552 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.46 -36.78 52.55 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.799 1.181 . . . . 0.0 111.722 174.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -62.89 -28.19 69.88 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.136 1.374 . . . . 0.0 112.562 177.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -47.85 -57.54 5.52 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.877 1.671 . . . . 0.0 109.337 168.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -76.85 -14.72 82.29 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-O 119.065 -0.853 . . . . 0.0 113.722 -178.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 76.6 mmt-85 -66.97 -62.59 1.36 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 166.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.13 -38.2 85.55 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.603 1.961 . . . . 0.0 114.905 -173.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.2 mp -79.66 -14.16 58.98 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 119.571 1.078 . . . . 0.0 112.538 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -118.88 24.26 10.95 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.452 1.101 . . . . 0.0 112.064 170.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -90.17 148.66 39.81 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 104.91 -2.255 . . . . 0.0 104.91 165.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -54.56 -99.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 0.979 1 C-N-CA 126.788 4.992 . . . . 0.0 113.777 -166.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.453 ' HG1' ' CD2' ' A' ' 54' ' ' HIS . 21.4 p -46.76 -36.88 7.74 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 126.155 1.782 . . . . 0.0 112.157 169.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -65.45 -36.87 85.21 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.179 0.899 . . . . 0.0 111.466 -174.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 52.4 t -67.38 -45.14 77.13 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.157 -0.964 . . . . 0.0 110.65 166.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.91 -43.08 69.41 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 121.743 -0.598 . . . . 0.0 112.535 178.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.6 mm -55.58 -50.42 66.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.617 1.567 . . . . 0.0 111.59 171.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 85.4 mt -61.47 -40.71 95.52 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.157 0.889 . . . . 0.0 112.015 -177.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 7.3 p -80.72 -32.6 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.1 -28.19 61.24 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.743 0.817 . . . . 0.0 112.522 173.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 17.7 tp -66.33 -39.49 89.27 Favored 'General case' 0 N--CA 1.437 -1.088 0 CA-C-O 116.644 -1.646 . . . . 0.0 111.601 169.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -47.33 -62.43 1.43 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.703 2.001 . . . . 0.0 110.1 175.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -83.3 26.24 0.66 Allowed 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.595 1.958 . . . . 0.0 113.04 174.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.25 -87.25 0.31 Allowed Glycine 0 C--N 1.337 0.63 0 C-N-CA 125.783 1.659 . . . . 0.0 112.738 -177.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 30.7 m 39.66 41.3 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 127.455 2.302 . . . . 0.0 114.575 -170.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -90.68 -68.16 0.8 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -177.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 24.1 p90 -159.25 157.76 27.74 Favored Pre-proline 0 N--CA 1.475 0.781 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -170.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -56.74 128.85 31.65 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.451 2.1 . . . . 0.0 109.276 171.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.74 -0.61 81.47 Favored Glycine 0 CA--C 1.534 1.226 0 CA-C-O 117.738 -1.59 . . . . 0.0 114.818 -175.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.535 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -59.1 -37.89 78.23 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 120.631 2.215 . . . . 0.0 110.898 170.865 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.5 mt -60.84 -17.8 52.0 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.564 1.145 . . . . 0.0 112.126 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.33 -31.84 73.1 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 118.698 0.681 . . . . 0.0 111.316 174.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.14 -50.43 19.45 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.429 0.692 . . . . 0.0 111.042 173.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.535 ' CD2' HE22 ' A' ' 39' ' ' GLN . 12.1 m-70 -57.78 -37.39 73.61 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 178.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.7 mt -98.29 -23.22 15.74 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.772 0.829 . . . . 0.0 113.196 -174.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.14 6.49 74.46 Favored Glycine 0 CA--C 1.534 1.273 0 CA-C-N 119.568 1.077 . . . . 0.0 113.919 -170.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.9 mp -96.93 155.44 16.78 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 118.143 0.971 . . . . 0.0 111.442 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.499 HG21 ' H ' ' A' ' 50' ' ' ASN . 1.4 t -58.21 144.7 39.86 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.971 0.508 . . . . 0.0 111.698 -179.287 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 29.9 mtt85 -55.24 -24.24 26.76 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.084 1.354 . . . . 0.0 111.947 171.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.9 m -65.33 -62.92 1.25 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.096 1.358 . . . . 0.0 111.275 170.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.499 ' H ' HG21 ' A' ' 47' ' ' THR . 3.7 m120 -66.12 -36.9 84.36 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.386 -0.821 . . . . 0.0 111.234 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.41 -31.8 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 O-C-N 120.327 -1.483 . . . . 0.0 113.045 169.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.3 m -75.47 -37.33 60.34 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.327 1.421 . . . . 0.0 113.209 171.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -54.58 -49.22 70.91 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.521 0.728 . . . . 0.0 110.154 172.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.453 ' CD2' ' HG1' ' A' ' 22' ' ' THR . 16.7 m80 -64.27 -20.91 66.38 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 176.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 65.2 mt -88.98 -18.83 26.61 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 117.033 -1.461 . . . . 0.0 114.443 174.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 55.3 m -53.47 -58.0 8.68 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 121.988 2.176 . . . . 0.0 112.114 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 40.5 t -66.01 -45.13 82.64 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 122.853 1.311 . . . . 0.0 110.344 -176.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.84 -41.33 57.69 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 127.916 2.487 . . . . 0.0 113.356 -178.32 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.7 mtm180 -84.33 -21.04 31.11 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -177.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -95.7 -45.08 3.0 Favored Glycine 0 N--CA 1.473 1.145 0 CA-C-N 119.275 0.943 . . . . 0.0 113.879 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 51.7 m -66.04 -13.91 60.77 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 124.987 1.315 . . . . 0.0 111.831 174.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 97.45 14.36 41.53 Favored Glycine 0 C--N 1.346 1.1 0 C-N-CA 127.427 2.442 . . . . 0.0 115.848 167.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.9 mt -71.11 -28.62 64.44 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.772 1.286 . . . . 0.0 113.562 179.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 3.5 m -140.81 159.11 23.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 126.007 1.723 . . . . 0.0 111.901 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 2.9 t -140.85 160.59 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 125.487 1.515 . . . . 0.0 110.137 -172.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -86.08 146.45 26.61 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.842 1.257 . . . . 0.0 112.344 169.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -140.73 174.63 10.33 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.715 1.606 . . . . 0.0 107.396 169.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -111.32 127.47 55.65 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.153 0.981 . . . . 0.0 111.948 169.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -80.66 14.75 1.97 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.858 0.863 . . . . 0.0 110.984 165.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 80.52 -56.34 4.7 Favored Glycine 0 C--N 1.343 0.937 0 C-N-CA 126.415 1.959 . . . . 0.0 112.067 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -76.05 -18.73 59.1 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.173 1.789 . . . . 0.0 112.568 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -164.08 167.3 20.45 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.8 2.04 . . . . 0.0 109.763 -173.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 34.3 m -87.04 154.98 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 O-C-N 121.725 -0.609 . . . . 0.0 110.078 167.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -132.67 169.43 16.67 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 125.321 1.448 . . . . 0.0 109.169 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -108.15 162.03 14.44 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 164.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -152.47 151.14 30.4 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.81 1.644 . . . . 0.0 110.214 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.2 tp -64.03 148.08 50.6 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.059 0.944 . . . . 0.0 109.249 169.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -76.75 -8.0 56.45 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 117.641 2.46 . . . . 0.0 117.641 -169.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -179.54 164.38 1.28 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 127.644 2.377 . . . . 0.0 111.883 172.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 26.4 t -47.65 -28.87 2.59 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.235 2.214 . . . . 0.0 112.448 166.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -49.14 -65.07 0.63 Allowed 'General case' 0 C--N 1.341 0.223 0 C-N-CA 125.51 1.524 . . . . 0.0 112.082 169.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.9 mt -68.29 -34.22 75.76 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 118.976 0.807 . . . . 0.0 110.138 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.98 -43.81 91.38 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 119.21 0.914 . . . . 0.0 111.207 -174.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.93 -31.69 40.07 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-O 117.906 -1.045 . . . . 0.0 112.574 179.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.94 -42.86 59.94 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 120.457 1.48 . . . . 0.0 112.518 176.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.18 -43.06 74.96 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.364 -0.835 . . . . 0.0 110.102 174.373 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.91 -30.47 65.72 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 125.855 1.693 . . . . 0.0 113.394 -174.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -62.79 -25.61 68.31 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 125.029 1.332 . . . . 0.0 111.499 166.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.562 ' C ' ' H ' ' A' ' 91' ' ' GLN . 27.8 tp 77.55 148.39 0.1 Allowed 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 129.139 2.975 . . . . 0.0 107.877 -167.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 4.3 m -57.1 5.09 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 120.396 -1.44 . . . . 0.0 113.969 165.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.562 ' H ' ' C ' ' A' ' 89' ' ' LEU . 28.7 mm-40 71.9 -43.28 0.56 Allowed 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 130.66 3.584 . . . . 0.0 111.026 -175.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -55.47 103.21 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 125.939 1.696 . . . . 0.0 112.937 -171.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.4 t 61.82 -31.03 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 C-N-CA 130.606 3.562 . . . . 0.0 117.651 168.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 tm? 109.38 93.03 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.509 1 C-N-CA 132.278 4.231 . . . . 0.0 101.858 -163.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.61 82.57 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 -169.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.7 t -63.11 149.58 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 126.835 2.054 . . . . 0.0 111.889 169.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -59.45 -6.82 1.15 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 128.88 2.872 . . . . 0.0 115.403 175.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 17.7 p -75.97 113.38 13.41 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.426 1.091 . . . . 0.0 112.294 -175.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -75.44 69.5 2.22 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.864 1.266 . . . . 0.0 110.353 168.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.94 145.34 72.37 Favored Pre-proline 0 CA--C 1.55 0.949 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.478 173.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -63.83 136.1 51.58 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 123.111 2.54 . . . . 0.0 113.47 -168.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.0 t . . . . . 0 CA--C 1.555 1.138 0 C-N-CA 127.347 2.259 . . . . 0.0 111.106 -178.965 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mm? . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 116.011 1.856 . . . . 0.0 116.011 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.13 -52.38 14.42 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.48 1.036 . . . . 0.0 111.568 173.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -53.85 -35.17 61.2 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.405 1.482 . . . . 0.0 113.188 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -50.28 -56.36 11.54 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 127.597 2.359 . . . . 0.0 110.347 169.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.62 -19.61 78.0 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-O 118.858 -0.968 . . . . 0.0 113.781 177.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 57.8 mmt-85 -66.75 -49.4 66.07 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.447 1.623 . . . . 0.0 108.624 168.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.96 -37.22 72.78 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.955 1.702 . . . . 0.0 113.971 -178.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 7.0 mp -72.52 -14.84 61.74 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.382 0.992 . . . . 0.0 113.156 176.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -121.84 29.45 7.11 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.107 0.963 . . . . 0.0 112.681 170.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -90.87 153.2 45.17 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 165.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -54.8 -94.36 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.781 1 C-N-CA 126.224 4.616 . . . . 0.0 113.38 -168.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 16.5 p -51.7 -31.01 24.35 Favored 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 126.492 1.917 . . . . 0.0 112.625 170.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.87 -42.18 77.37 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.553 1.069 . . . . 0.0 111.726 -176.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 39.0 t -61.93 -42.72 99.43 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 119.003 0.819 . . . . 0.0 109.988 167.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -46.52 81.82 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 118.21 -0.9 . . . . 0.0 113.116 175.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.4 mm -55.81 -51.77 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 CA-C-N 120.487 1.494 . . . . 0.0 110.091 173.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 79.6 mt -59.68 -42.67 93.44 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 118.635 -0.698 . . . . 0.0 112.408 -177.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 7.1 p -80.45 -30.23 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 118.874 0.761 . . . . 0.0 112.731 -178.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.39 -35.95 68.57 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.586 -0.696 . . . . 0.0 112.215 173.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 20.0 tp -61.76 -37.97 86.27 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 117.068 -1.444 . . . . 0.0 112.5 177.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -44.24 -53.77 6.32 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 128.365 2.666 . . . . 0.0 112.28 -177.446 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -88.26 -15.47 35.73 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.732 1.613 . . . . 0.0 112.447 179.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.39 -77.54 1.26 Allowed Glycine 0 C--N 1.338 0.682 0 C-N-CA 124.901 1.239 . . . . 0.0 112.281 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 29.4 m 37.45 41.21 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 126.582 1.953 . . . . 0.0 114.509 -169.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -87.67 -72.78 0.51 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 121.727 -0.608 . . . . 0.0 112.046 -173.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 49.4 p90 -155.82 157.49 31.43 Favored Pre-proline 0 CA--C 1.538 0.506 0 CA-C-O 118.761 -0.638 . . . . 0.0 112.571 -170.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -60.49 125.04 16.34 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.576 2.184 . . . . 0.0 109.703 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.95 -1.54 88.81 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-O 117.564 -1.687 . . . . 0.0 114.763 -174.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . 0.461 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -56.81 -36.27 69.73 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.336 2.068 . . . . 0.0 111.015 169.751 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mt -61.51 -18.49 59.34 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.218 1.007 . . . . 0.0 112.133 -177.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.35 -34.36 75.15 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 118.596 0.635 . . . . 0.0 111.026 175.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.77 -38.66 32.69 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.133 0.973 . . . . 0.0 112.741 175.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . 0.461 ' CD2' HE22 ' B' ' 39' ' ' GLN . 4.0 m-70 -62.18 -34.7 76.93 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 172.265 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 26.2 mt -103.55 -23.08 13.53 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -173.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.54 8.29 85.9 Favored Glycine 0 CA--C 1.533 1.216 0 CA-C-N 119.194 0.907 . . . . 0.0 114.015 -170.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 9.3 mp -104.64 155.73 18.6 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 118.404 1.102 . . . . 0.0 112.395 -177.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' THR . . . . . 0.444 HG21 ' H ' ' B' ' 50' ' ' ASN . 1.6 t -59.47 145.68 43.03 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.11 0.964 . . . . 0.0 112.282 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 29.5 mtm180 -57.19 -24.08 52.0 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.14 1.376 . . . . 0.0 112.469 169.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.9 m -59.76 -59.29 5.66 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.587 1.155 . . . . 0.0 109.856 169.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . 0.444 ' H ' HG21 ' B' ' 47' ' ' THR . 2.7 m120 -72.67 -42.51 64.21 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.969 0.908 . . . . 0.0 110.831 -177.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.5 t -53.79 -40.53 44.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 120.565 1.53 . . . . 0.0 111.924 171.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 50.5 m -68.66 -39.52 80.6 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 120.078 1.308 . . . . 0.0 113.441 175.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -57.99 -48.55 79.68 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.932 0.893 . . . . 0.0 111.259 172.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 19.4 m170 -60.63 -38.49 84.95 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 118.034 -0.984 . . . . 0.0 112.097 173.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 42.7 mt -70.89 -21.22 62.42 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.11 1.364 . . . . 0.0 114.115 174.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' SER . . . . . 0.461 ' HA ' HH21 ' B' ' 59' ' ' ARG . 0.2 OUTLIER -61.14 -59.35 5.48 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 121.476 1.944 . . . . 0.0 112.711 -172.282 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -73.21 -26.35 61.11 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 122.121 0.962 . . . . 0.0 111.487 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.22 -48.17 71.36 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.62 1.568 . . . . 0.0 111.216 169.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . 0.461 HH21 ' HA ' ' B' ' 56' ' ' SER . 76.5 mtm180 -82.81 -21.54 34.47 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.537 1.135 . . . . 0.0 112.48 178.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -78.29 -60.45 2.68 Favored Glycine 0 N--CA 1.469 0.891 0 CA-C-N 119.381 0.991 . . . . 0.0 113.234 177.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 20.8 m -67.89 -7.94 32.41 Favored 'General case' 0 CA--C 1.564 1.495 0 C-N-CA 125.236 1.414 . . . . 0.0 114.106 -178.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.87 7.99 54.72 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 127.008 2.242 . . . . 0.0 115.87 171.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 1.7 mt -66.5 -26.38 67.14 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.77 1.628 . . . . 0.0 112.98 -176.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 3.0 m -142.38 159.75 19.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 127.417 2.287 . . . . 0.0 110.723 174.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 4.8 t -133.91 167.04 27.22 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 C-N-CA 126.185 1.794 . . . . 0.0 109.449 176.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.33 130.43 50.6 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.652 1.581 . . . . 0.0 111.84 171.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.3 m -120.64 -178.23 3.66 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.637 1.575 . . . . 0.0 108.223 178.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -116.21 131.46 56.94 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.332 1.053 . . . . 0.0 112.005 169.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.52 10.29 18.23 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.579 0.752 . . . . 0.0 110.484 165.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.9 -56.45 4.94 Favored Glycine 0 C--N 1.344 0.984 0 C-N-CA 125.956 1.741 . . . . 0.0 112.182 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -70.49 -19.98 62.89 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.645 1.578 . . . . 0.0 112.553 174.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -165.2 168.47 17.05 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.121 2.168 . . . . 0.0 109.621 -174.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 32.9 m -88.3 156.73 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 O-C-N 121.489 -0.757 . . . . 0.0 110.226 167.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -132.92 173.13 11.72 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.503 1.121 . . . . 0.0 109.034 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -111.59 160.53 17.12 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 164.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -156.16 152.87 28.42 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.649 1.58 . . . . 0.0 110.295 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 tp -63.25 158.39 20.28 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.417 1.487 . . . . 0.0 112.594 176.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.67 -29.88 60.09 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 116.958 2.207 . . . . 0.0 116.958 -175.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 10.0 t70 168.63 166.37 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 129.425 3.09 . . . . 0.0 109.4 -169.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 45.2 t -46.11 -33.21 3.36 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.435 1.894 . . . . 0.0 112.121 166.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -45.76 -64.66 0.68 Allowed 'General case' 0 C--N 1.343 0.287 0 C-N-CA 125.208 1.403 . . . . 0.0 112.878 171.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 14.5 mt -68.07 -31.91 71.87 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.416 1.007 . . . . 0.0 110.848 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.27 -45.23 94.2 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.416 1.007 . . . . 0.0 110.286 -176.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.95 -40.24 28.49 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.569 0.748 . . . . 0.0 112.765 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.2 -33.58 71.88 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.797 1.18 . . . . 0.0 113.733 179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.13 -42.34 47.17 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.47 -0.769 . . . . 0.0 110.193 170.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.05 -39.06 54.8 Favored Glycine 0 CA--C 1.538 1.519 0 C-N-CA 125.6 1.571 . . . . 0.0 114.222 -169.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.84 -31.67 59.45 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 119.116 1.458 . . . . 0.0 109.662 166.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . 0.493 ' C ' ' H ' ' B' ' 91' ' ' GLN . 19.3 tp 82.14 160.8 0.14 Allowed 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 128.98 2.912 . . . . 0.0 111.296 169.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 15.9 m -57.07 8.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 127.21 2.204 . . . . 0.0 114.648 169.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.493 ' H ' ' C ' ' B' ' 89' ' ' LEU . 15.3 mm-40 71.56 -20.39 0.24 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.461 1.905 . . . . 0.0 114.895 171.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 2.5 p -54.56 29.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 C-N-CA 131.393 3.877 . . . . 0.0 118.301 -176.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.2 t 69.26 15.72 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 125.533 1.533 . . . . 0.0 111.379 171.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 2.1 tm? 101.63 107.3 0.01 OUTLIER 'General case' 0 C--N 1.35 0.601 0 C-N-CA 130.583 3.553 . . . . 0.0 109.055 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.873 0 O-C-N 120.94 -1.1 . . . . 0.0 110.998 168.352 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.5 mm? . . . . . 0 N--CA 1.467 0.401 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.59 -32.04 49.34 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 120.293 1.406 . . . . 0.0 112.91 172.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.0 mmt85 -66.94 -18.36 65.34 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 120.312 -1.492 . . . . 0.0 113.017 177.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -70.28 -39.22 75.02 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.6 1.16 . . . . 0.0 110.807 172.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.08 -40.83 99.7 Favored Glycine 0 C--N 1.341 0.86 0 N-CA-C 111.099 -0.8 . . . . 0.0 111.099 171.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -57.25 -46.03 83.4 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.212 1.006 . . . . 0.0 109.674 171.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.73 -19.63 65.1 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 116.916 -1.516 . . . . 0.0 113.578 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 mp -98.4 -16.35 19.31 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 171.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.86 -34.17 51.81 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.633 1.973 . . . . 0.0 114.3 169.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -50.85 136.37 26.74 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 125.098 1.359 . . . . 0.0 111.203 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.44 ' HG2' ' H ' ' A' ' 22' ' ' THR . 61.5 Cg_endo -60.01 -77.34 0.02 OUTLIER 'Trans proline' 0 CA--C 1.537 0.647 1 C-N-CA 125.47 4.113 . . . . 0.0 113.23 -169.03 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.46 ' HB ' ' CD2' ' A' ' 54' ' ' HIS . 24.6 m -53.98 -36.7 63.18 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 117.59 -1.195 . . . . 0.0 110.408 174.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.32 -43.0 82.7 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.915 1.234 . . . . 0.0 113.336 -175.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 11.8 t -54.43 -44.63 72.62 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.601 1.16 . . . . 0.0 110.276 168.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -43.68 93.98 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-O 117.857 -1.068 . . . . 0.0 112.444 175.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -54.44 -50.45 57.68 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 C-N-CA 125.948 1.699 . . . . 0.0 111.061 174.528 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 14.9 mt -52.57 -39.39 61.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 118.671 -0.68 . . . . 0.0 112.573 -176.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.08 -20.26 26.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 118.807 0.731 . . . . 0.0 112.559 -177.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.39 -6.93 59.43 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 174.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -105.91 -13.26 15.55 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 169.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.47 -48.35 64.72 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 127.394 2.277 . . . . 0.0 108.773 165.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -135.86 96.06 3.35 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.514 2.726 . . . . 0.0 107.932 175.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 159.59 -95.8 0.14 Allowed Glycine 0 N--CA 1.468 0.78 0 C-N-CA 124.824 1.202 . . . . 0.0 111.105 176.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.0 m 51.4 33.13 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 178.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 2.4 m -80.55 -65.58 0.99 Allowed 'General case' 0 C--O 1.222 -0.364 0 O-C-N 121.199 -0.938 . . . . 0.0 111.284 178.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -150.96 157.5 35.41 Favored Pre-proline 0 N--CA 1.47 0.533 0 CA-C-O 117.731 -1.128 . . . . 0.0 111.069 -172.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -59.07 -18.1 41.76 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 122.892 2.395 . . . . 0.0 114.166 169.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -86.91 -12.27 68.83 Favored Glycine 0 CA--C 1.536 1.403 0 CA-C-O 118.494 -1.17 . . . . 0.0 115.252 170.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.87 -36.67 56.6 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.884 1.842 . . . . 0.0 112.051 -170.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.586 ' H ' HD11 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -66.71 -19.4 65.75 Favored 'General case' 0 C--O 1.217 -0.616 0 C-N-CA 123.14 0.576 . . . . 0.0 110.919 -174.546 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.8 -36.75 79.82 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.387 -0.82 . . . . 0.0 112.734 -177.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -75.0 -47.76 27.53 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 122.794 0.437 . . . . 0.0 110.926 170.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -57.68 -35.72 70.97 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.766 1.226 . . . . 0.0 113.919 -176.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 65.7 mt -94.53 -15.27 24.29 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 127.598 2.359 . . . . 0.0 112.324 -178.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.33 10.96 54.88 Favored Glycine 0 CA--C 1.53 1.023 0 C-N-CA 124.291 0.948 . . . . 0.0 112.976 -170.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.4 mt -117.22 149.99 39.49 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 124.107 0.963 . . . . 0.0 111.427 -169.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 12.7 p -61.75 147.31 46.61 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.833 -0.542 . . . . 0.0 110.115 -172.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -59.15 -20.33 52.77 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 177.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.0 m -73.94 -46.53 43.64 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.138 0.975 . . . . 0.0 112.085 169.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -65.09 -44.2 89.62 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.364 1.065 . . . . 0.0 111.889 175.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 23.2 t -61.53 -40.87 87.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.725 1.21 . . . . 0.0 111.391 173.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 70.7 m -64.04 -41.35 97.44 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.921 1.237 . . . . 0.0 112.717 172.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -55.11 -48.93 72.93 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 123.491 0.716 . . . . 0.0 111.48 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.46 ' CD2' ' HB ' ' A' ' 22' ' ' THR 0.272 11.2 m-70 -80.4 -22.98 40.71 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.811 1.412 . . . . 0.0 114.811 176.45 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 31.4 mt -65.16 -30.5 71.42 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.773 1.624 . . . . 0.0 110.619 166.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.6 t -50.76 -59.81 3.71 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.568 1.076 . . . . 0.0 112.857 -173.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 9.0 t -78.29 -11.02 59.91 Favored 'General case' 0 CA--C 1.554 1.112 0 O-C-N 121.476 -0.765 . . . . 0.0 112.227 174.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.9 tp -68.15 -36.28 79.42 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 122.065 2.211 . . . . 0.0 109.882 168.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.0 mtp180 -81.34 -12.77 58.92 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.37 1.868 . . . . 0.0 111.131 173.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -88.48 -60.84 1.5 Allowed Glycine 0 C--N 1.34 0.8 0 C-N-CA 125.044 1.307 . . . . 0.0 111.006 176.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 96.1 m -59.2 8.13 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 128.361 2.664 . . . . 0.0 115.022 171.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.23 -3.55 14.67 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 126.202 1.858 . . . . 0.0 115.743 177.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 75.4 mt -59.65 -29.53 68.1 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 126.398 1.879 . . . . 0.0 114.555 -174.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.38 137.25 58.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 125.16 1.384 . . . . 0.0 111.95 173.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.6 t -118.06 139.86 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 C-N-CA 125.849 1.66 . . . . 0.0 109.298 174.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -89.01 149.58 23.19 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.556 1.142 . . . . 0.0 113.461 177.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 m -171.16 157.79 5.25 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 126.442 1.897 . . . . 0.0 108.05 -176.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -73.1 143.79 47.24 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 118.903 0.774 . . . . 0.0 112.529 171.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.499 ' CD ' ' H ' ' A' ' 70' ' ' GLY 0.289 2.2 pp20? -84.75 -124.42 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 117.034 -1.46 . . . . 0.0 107.654 165.264 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.499 ' H ' ' CD ' ' A' ' 69' ' ' GLU . . . -77.29 -28.82 57.35 Favored Glycine 0 CA--C 1.537 1.416 0 CA-C-N 121.919 2.145 . . . . 0.0 114.286 171.288 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.49 -29.02 0.07 Allowed 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 119.15 1.475 . . . . 0.0 114.818 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -81.99 168.86 17.41 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 125.711 1.605 . . . . 0.0 111.011 169.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 26.7 m -98.84 146.78 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 123.272 0.629 . . . . 0.0 110.181 169.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -129.83 168.64 16.28 Favored 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 125.432 1.493 . . . . 0.0 111.626 -171.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -121.6 129.0 52.54 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 124.97 1.308 . . . . 0.0 109.215 170.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -143.05 153.44 42.95 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 125.333 1.453 . . . . 0.0 111.398 -173.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 68.7 mt -64.42 147.24 53.09 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -177.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.35 -28.71 61.26 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -172.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -163.8 159.54 21.36 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 123.148 1.451 . . . . 0.0 112.931 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 96.0 p -43.42 -36.34 1.91 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 128.646 2.778 . . . . 0.0 113.815 167.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -50.78 -52.68 38.5 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 125.201 1.4 . . . . 0.0 112.59 172.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.9 mt -71.43 -53.4 14.12 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.31 -36.52 61.33 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.661 1.185 . . . . 0.0 113.0 -177.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -74.92 -57.42 3.92 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 117.726 -1.131 . . . . 0.0 111.974 -177.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.7 -27.33 68.84 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.466 1.03 . . . . 0.0 112.869 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 60.1 tp -69.35 -41.15 76.98 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.565 1.146 . . . . 0.0 111.469 169.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -78.47 -38.36 25.05 Favored Glycine 0 N--CA 1.469 0.88 0 C-N-CA 126.692 2.091 . . . . 0.0 115.129 -172.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -82.94 -16.6 46.74 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 118.637 1.219 . . . . 0.0 113.014 171.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.449 ' C ' ' H ' ' A' ' 91' ' ' GLN . 43.5 tp 67.95 140.94 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 128.841 2.856 . . . . 0.0 112.241 178.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 34.7 m -63.64 22.19 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.434 1.893 . . . . 0.0 114.656 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.449 ' H ' ' C ' ' A' ' 89' ' ' LEU . 27.3 mm-40 81.08 -26.91 0.14 Allowed 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 125.98 1.712 . . . . 0.0 112.949 158.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.1 p -54.44 23.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 C-N-CA 131.57 3.948 . . . . 0.0 118.135 178.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 68.56 11.69 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 O-C-N 120.379 -1.45 . . . . 0.0 112.459 167.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.1 tt 84.94 100.93 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 129.389 3.076 . . . . 0.0 109.369 -172.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.93 108.13 0.98 Allowed 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 -175.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -66.89 150.42 11.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 125.125 1.37 . . . . 0.0 113.843 169.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -87.41 146.22 25.96 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.423 1.889 . . . . 0.0 108.621 165.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -173.01 136.29 0.65 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.557 1.943 . . . . 0.0 109.164 -177.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.0 p30 -67.48 -31.12 71.05 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 129.783 3.233 . . . . 0.0 112.115 169.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.09 168.26 2.3 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 128.501 2.721 . . . . 0.0 113.378 172.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -68.49 158.73 56.42 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 123.017 2.478 . . . . 0.0 112.848 -172.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 31.4 p . . . . . 0 CA--C 1.542 0.661 0 CA-C-O 123.418 1.58 . . . . 0.0 106.793 165.827 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 CA--C 1.539 0.535 0 N-CA-C 114.487 1.291 . . . . 0.0 114.487 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.91 -39.46 62.78 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 120.975 1.716 . . . . 0.0 110.027 167.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 67.8 mtt180 -72.25 -13.35 61.5 Favored 'General case' 0 CA--C 1.55 0.976 0 O-C-N 120.334 -1.479 . . . . 0.0 113.58 178.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -69.59 -41.85 75.21 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 120.14 1.336 . . . . 0.0 109.751 169.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -60.37 -38.54 94.87 Favored Glycine 0 N--CA 1.47 0.958 0 O-C-N 120.911 -1.118 . . . . 0.0 111.91 172.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -58.09 -38.86 77.23 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.711 -0.876 . . . . 0.0 110.659 172.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.12 -12.93 61.07 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 117.86 -1.067 . . . . 0.0 113.77 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 12.4 mt -93.7 -25.71 17.33 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.205 0.911 . . . . 0.0 112.258 169.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.67 -20.54 49.98 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.641 1.976 . . . . 0.0 114.638 168.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.462 ' CG ' ' HE ' ' B' ' 23' ' ' ARG . 9.7 t70 -56.92 130.09 78.71 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 127.287 2.235 . . . . 0.0 109.371 178.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -49.03 -83.0 0.02 OUTLIER 'Trans proline' 0 C--O 1.237 0.452 1 C-N-CA 126.925 5.083 . . . . 0.0 114.003 -165.28 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.433 ' HB ' ' CG ' ' B' ' 54' ' ' HIS . 59.8 m -59.6 -32.63 70.57 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 116.652 -1.642 . . . . 0.0 110.89 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . 0.462 ' HE ' ' CG ' ' B' ' 20' ' ' ASP . 23.7 mtm180 -62.27 -42.41 99.31 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 121.136 1.789 . . . . 0.0 114.441 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 6.7 t -52.47 -47.84 66.25 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.689 0.757 . . . . 0.0 110.413 173.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.57 -42.47 82.51 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.488 1.115 . . . . 0.0 112.849 175.016 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -53.21 -52.12 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 C-N-CA 126.585 1.954 . . . . 0.0 110.263 176.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 25.4 mt -54.73 -37.34 65.77 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 123.556 0.742 . . . . 0.0 112.167 -172.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -64.03 -22.15 30.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 118.928 0.785 . . . . 0.0 112.821 178.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.14 -5.11 59.19 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.031 1.332 . . . . 0.0 114.286 173.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -106.8 -19.57 13.6 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 124.867 1.267 . . . . 0.0 113.562 170.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.24 -48.06 77.25 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 127.191 2.197 . . . . 0.0 108.953 164.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -135.12 93.56 3.01 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 128.324 2.649 . . . . 0.0 108.462 175.096 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . 161.86 -92.73 0.11 Allowed Glycine 0 N--CA 1.468 0.773 0 C-N-CA 124.552 1.073 . . . . 0.0 112.145 173.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 4.0 m 51.4 35.86 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 2.7 m -81.8 -66.88 0.83 Allowed 'General case' 0 C--O 1.223 -0.336 0 O-C-N 121.185 -0.947 . . . . 0.0 111.694 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -147.98 157.17 43.71 Favored Pre-proline 0 CA--C 1.537 0.465 0 CA-C-O 117.738 -1.125 . . . . 0.0 110.685 -174.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -59.1 -14.25 22.77 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 123.299 2.666 . . . . 0.0 114.599 171.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -93.89 -14.3 52.61 Favored Glycine 0 CA--C 1.535 1.336 0 CA-C-O 118.242 -1.31 . . . . 0.0 115.465 170.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.65 -34.13 73.57 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.262 2.031 . . . . 0.0 112.108 -170.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.566 ' H ' HD11 ' B' ' 40' ' ' LEU . 0.2 OUTLIER -66.81 -19.01 65.66 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 123.75 0.82 . . . . 0.0 110.511 -172.984 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.52 -37.32 80.78 Favored 'General case' 0 CA--C 1.547 0.833 0 O-C-N 120.891 -1.131 . . . . 0.0 112.174 -177.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.04 -46.83 27.3 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.168 0.587 . . . . 0.0 111.361 171.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -58.72 -32.31 69.08 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -176.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 69.2 mt -98.93 -20.24 16.9 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 127.128 2.171 . . . . 0.0 112.674 -177.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.4 13.52 77.22 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 124.807 1.194 . . . . 0.0 112.964 -170.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 76.3 mt -118.69 151.36 38.12 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 118.229 1.014 . . . . 0.0 111.96 -169.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.8 p -62.89 145.53 54.94 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.497 -0.752 . . . . 0.0 109.783 -173.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -61.39 -17.39 53.9 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 176.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 6.0 m -73.42 -47.94 37.8 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.212 1.005 . . . . 0.0 111.68 169.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -66.17 -45.42 80.94 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.756 0.822 . . . . 0.0 111.134 175.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 5.3 t -58.3 -40.02 76.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 117.929 -1.034 . . . . 0.0 112.218 171.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 67.8 m -67.34 -41.04 85.85 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 121.005 1.729 . . . . 0.0 112.676 174.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -57.99 -47.65 82.35 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.488 0.715 . . . . 0.0 111.218 177.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . 0.433 ' CG ' ' HB ' ' B' ' 22' ' ' THR . 79.0 m-70 -75.75 -26.11 57.13 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 121.262 -0.899 . . . . 0.0 113.329 175.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 38.3 mt -66.07 -29.43 69.77 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 121.077 1.762 . . . . 0.0 111.193 167.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.2 t -51.33 -57.93 7.56 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.593 1.088 . . . . 0.0 113.375 -172.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 34.2 t -79.69 -9.79 59.69 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 123.542 0.737 . . . . 0.0 112.672 172.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.2 tp -67.03 -37.57 84.36 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 121.965 2.166 . . . . 0.0 109.063 167.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 22.6 mtp-105 -82.2 -7.28 59.62 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.08 2.152 . . . . 0.0 111.429 174.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -91.14 -64.35 1.18 Allowed Glycine 0 C--N 1.342 0.863 0 C-N-CA 125.936 1.732 . . . . 0.0 111.358 173.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 67.8 m -61.1 13.79 0.01 OUTLIER 'General case' 0 CA--C 1.563 1.472 0 C-N-CA 128.227 2.611 . . . . 0.0 115.238 172.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.06 -2.36 6.97 Favored Glycine 0 N--CA 1.474 1.216 0 C-N-CA 126.439 1.971 . . . . 0.0 115.836 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 52.7 mt -59.27 -28.26 66.57 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.845 1.658 . . . . 0.0 113.8 -175.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -129.46 137.32 57.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 125.243 1.417 . . . . 0.0 112.636 172.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 75.1 t -116.0 136.75 51.91 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 C-N-CA 126.289 1.836 . . . . 0.0 109.566 171.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.68 145.56 28.71 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 122.192 0.996 . . . . 0.0 112.457 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 41.1 m -158.68 159.44 35.32 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 126.048 1.739 . . . . 0.0 107.206 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -83.63 144.2 29.59 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 119.481 1.037 . . . . 0.0 111.771 170.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.269 2.6 pp20? -88.39 -141.48 0.13 Allowed 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 165.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -69.82 -23.09 77.06 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 121.636 2.016 . . . . 0.0 114.572 177.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.72 -30.12 0.07 Allowed 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 -89.36 171.92 9.4 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 126.826 2.05 . . . . 0.0 112.068 174.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 19.7 m -96.13 150.21 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.315 0.646 . . . . 0.0 109.742 167.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -137.57 163.54 30.94 Favored 'General case' 0 CA--C 1.521 -0.139 0 C-N-CA 125.73 1.612 . . . . 0.0 110.935 -171.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -119.54 127.83 53.37 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 125.238 1.415 . . . . 0.0 109.187 174.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -141.15 156.06 46.0 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.348 1.459 . . . . 0.0 110.971 -175.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 61.8 mt -63.85 148.38 49.5 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.155 0.502 . . . . 0.0 111.751 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.0 -28.07 62.16 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 -173.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -167.16 160.12 13.52 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.06 1.344 . . . . 0.0 111.715 -178.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 94.6 p -41.7 -35.91 0.87 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 128.134 2.574 . . . . 0.0 113.448 167.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -48.38 -54.76 12.79 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 126.08 1.752 . . . . 0.0 112.784 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 7.5 mt -75.32 -47.07 29.49 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.629 -0.7 . . . . 0.0 109.474 -177.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.42 -36.08 53.45 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.103 0.961 . . . . 0.0 113.026 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -76.03 -56.13 4.95 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.888 1.275 . . . . 0.0 111.865 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.81 -28.96 66.49 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 176.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 61.1 tp -77.64 -37.5 49.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.426 1.89 . . . . 0.0 112.524 171.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -80.95 -42.37 9.69 Favored Glycine 0 N--CA 1.469 0.837 0 C-N-CA 126.035 1.779 . . . . 0.0 113.915 -169.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -80.69 -23.74 39.35 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 117.967 0.884 . . . . 0.0 111.372 168.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . 0.541 ' C ' ' H ' ' B' ' 91' ' ' GLN . 19.8 tp 68.76 160.71 0.19 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 129.464 3.106 . . . . 0.0 111.398 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 17.8 m -58.92 12.22 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 125.857 1.663 . . . . 0.0 114.087 167.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.541 ' H ' ' C ' ' B' ' 89' ' ' LEU . 18.7 mm-40 73.82 -17.75 0.43 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 126.146 1.778 . . . . 0.0 114.229 168.63 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 1.6 p -59.49 20.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 C-N-CA 128.187 2.595 . . . . 0.0 116.863 177.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . 0.422 ' H ' ' C ' ' B' ' 91' ' ' GLN . 1.4 t 65.87 23.45 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 C-N-CA 125.373 1.469 . . . . 0.0 113.656 165.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 tt 79.34 92.56 0.06 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 127.47 2.308 . . . . 0.0 110.203 -176.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.694 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 178.279 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.472 ' H ' HD11 ' A' ' 11' ' ' LEU . 5.4 mp . . . . . 0 N--CA 1.473 0.724 0 N-CA-C 113.199 0.815 . . . . 0.0 113.199 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.21 -34.38 76.35 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.173 -0.955 . . . . 0.0 112.356 178.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -58.27 -31.48 67.48 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 120.983 -1.073 . . . . 0.0 112.893 -176.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -49.57 -58.08 5.9 Favored 'General case' 0 C--O 1.225 -0.228 0 C-N-CA 126.119 1.768 . . . . 0.0 110.576 173.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -61.3 -35.01 90.29 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-N 118.77 0.714 . . . . 0.0 112.186 -173.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.8 -50.42 62.69 Favored 'General case' 0 C--O 1.221 -0.434 0 C-N-CA 124.043 0.937 . . . . 0.0 110.538 173.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.99 -22.93 64.98 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -177.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -88.19 -24.76 23.21 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 119.107 0.867 . . . . 0.0 112.133 170.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.45 31.74 1.48 Allowed 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.652 1.581 . . . . 0.0 112.574 167.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.56 167.29 21.28 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 125.528 1.531 . . . . 0.0 107.407 167.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.76 -105.9 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 123.975 3.117 . . . . 0.0 109.997 174.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.7 m -63.85 -14.76 55.87 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.626 1.57 . . . . 0.0 113.078 -178.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.75 -37.86 87.53 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 120.285 1.402 . . . . 0.0 111.765 169.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 19.8 t -64.93 -40.18 94.64 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 118.901 0.773 . . . . 0.0 110.593 172.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 13.5 mmp_? -59.69 -51.4 69.96 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.941 0.896 . . . . 0.0 112.77 172.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.3 mm -47.7 -57.16 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 124.279 1.032 . . . . 0.0 110.835 170.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 86.9 mt -60.8 -50.4 73.62 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.022 0.828 . . . . 0.0 112.092 -176.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.4 p -72.12 -27.07 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -174.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.3 -26.23 28.7 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.358 0.663 . . . . 0.0 112.685 173.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.8 mt -63.2 -41.76 99.21 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 117.879 -1.057 . . . . 0.0 112.154 170.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -40.13 -51.89 2.6 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.93 2.492 . . . . 0.0 114.492 -177.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -97.8 -16.08 19.99 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.613 1.565 . . . . 0.0 112.459 173.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.52 ' HA3' ' HE2' ' A' ' 43' ' ' HIS . . . -77.09 -46.9 9.75 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 125.388 1.471 . . . . 0.0 115.069 -174.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 15.9 m 3.48 58.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 131.245 3.818 . . . . 0.0 118.603 -178.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 55.6 m -118.65 -57.86 2.01 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.517 1.927 . . . . 0.0 111.669 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -149.02 148.77 28.16 Favored Pre-proline 0 N--CA 1.474 0.728 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -171.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -55.53 -45.34 40.4 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 122.7 2.266 . . . . 0.0 112.406 172.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -74.89 -6.55 78.86 Favored Glycine 0 CA--C 1.532 1.14 0 CA-C-O 118.836 -0.98 . . . . 0.0 114.541 178.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -65.42 -33.74 76.66 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.159 1.48 . . . . 0.0 111.875 -175.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mt -64.39 -6.97 8.18 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 123.443 0.697 . . . . 0.0 112.043 -175.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.84 -39.96 95.47 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 122.638 0.375 . . . . 0.0 110.462 172.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.77 -38.85 62.07 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.608 0.763 . . . . 0.0 111.59 171.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.52 ' HE2' ' HA3' ' A' ' 33' ' ' GLY . 2.4 m-70 -61.63 -23.73 66.24 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 177.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 69.0 mt -119.81 -16.3 8.75 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.076 1.35 . . . . 0.0 113.941 -173.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.78 10.31 67.4 Favored Glycine 0 CA--C 1.537 1.423 0 CA-C-N 118.99 0.814 . . . . 0.0 112.925 -168.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 79.4 mt -104.86 158.26 16.65 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.574 1.187 . . . . 0.0 112.98 -171.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.2 t -66.4 153.37 42.96 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 122.103 0.954 . . . . 0.0 111.374 176.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -54.59 -22.47 13.45 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.348 1.459 . . . . 0.0 113.424 173.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.6 t -67.39 -56.71 8.57 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.336 0.971 . . . . 0.0 111.293 169.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -62.69 -37.58 87.02 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.47 1.108 . . . . 0.0 112.151 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.8 t -58.16 -50.0 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 123.557 0.743 . . . . 0.0 111.024 169.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.4 m -63.34 -34.09 76.95 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 177.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -57.43 -52.63 64.59 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.722 1.609 . . . . 0.0 110.651 -178.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 49.1 m-70 -76.98 -19.0 57.85 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.343 1.238 . . . . 0.0 114.343 175.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 41.7 mt -76.05 -22.14 56.01 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 120.402 1.456 . . . . 0.0 112.845 169.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 88.9 p -52.2 -64.13 0.92 Allowed 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 120.648 1.567 . . . . 0.0 113.48 -175.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 51.0 t -64.69 -39.62 93.97 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.404 1.082 . . . . 0.0 110.785 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.5 tp -48.02 -40.65 23.41 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.673 1.589 . . . . 0.0 113.761 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 -88.1 -17.0 31.99 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.928 1.291 . . . . 0.0 113.3 -175.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -93.3 -45.55 3.49 Favored Glycine 0 N--CA 1.477 1.4 0 C-N-CA 125.248 1.404 . . . . 0.0 111.959 175.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 55.5 m -75.23 7.58 3.32 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 127.151 2.181 . . . . 0.0 112.866 170.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 66.1 6.28 31.42 Favored Glycine 0 N--CA 1.468 0.827 0 C-N-CA 126.019 1.771 . . . . 0.0 117.083 169.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 47.2 mt -61.37 -19.95 62.45 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.4 1.6 . . . . 0.0 113.384 178.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.1 m -132.47 147.26 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 127.333 2.253 . . . . 0.0 111.862 169.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 82.8 t -128.82 137.37 57.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 126.791 2.036 . . . . 0.0 109.616 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.19 172.82 11.08 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 123.126 1.441 . . . . 0.0 114.346 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.7 m -160.72 149.16 16.37 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.92 1.288 . . . . 0.0 108.514 177.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -98.63 114.25 26.64 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.692 1.133 . . . . 0.0 110.869 168.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -93.52 34.36 1.18 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.144 1.778 . . . . 0.0 113.428 -173.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.33 -17.35 1.08 Allowed Glycine 0 CA--C 1.536 1.363 0 O-C-N 120.209 -1.557 . . . . 0.0 115.254 174.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -145.26 -17.09 0.49 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.28 1.432 . . . . 0.0 113.773 -178.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -152.61 -178.98 7.2 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 127.944 2.498 . . . . 0.0 107.105 175.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 16.3 m -108.85 155.48 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 123.785 0.834 . . . . 0.0 109.212 168.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.2 ptt180 -122.95 175.21 6.7 Favored 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 124.76 1.224 . . . . 0.0 111.092 176.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -130.76 118.66 21.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.094 -1.412 . . . . 0.0 107.914 168.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -108.92 156.97 19.08 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 125.07 1.348 . . . . 0.0 109.396 174.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.2 tp -54.99 152.27 7.76 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.048 1.339 . . . . 0.0 111.377 172.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -45.54 -48.35 14.27 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.514 1.302 . . . . 0.0 114.514 -171.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -171.87 -179.96 2.57 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.122 0.963 . . . . 0.0 111.308 -176.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.6 p -42.78 -39.23 2.39 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.441 1.896 . . . . 0.0 112.309 167.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -54.19 -57.08 12.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.469 1.507 . . . . 0.0 113.262 177.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 18.4 mt -74.61 -34.87 62.92 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.9 1.227 . . . . 0.0 110.626 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.39 -21.92 66.73 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.457 0.571 . . . . 0.0 112.329 -178.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -81.58 -74.28 0.34 Allowed 'General case' 0 C--O 1.219 -0.515 0 CA-C-O 116.753 -1.594 . . . . 0.0 111.278 166.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.04 -21.91 66.71 Favored 'General case' 0 CA--C 1.555 1.168 0 CA-C-N 123.06 2.663 . . . . 0.0 115.974 -169.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.69 -42.62 50.57 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 120.553 1.524 . . . . 0.0 109.702 167.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -66.26 -32.32 81.74 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 127.912 2.672 . . . . 0.0 115.6 179.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.32 -27.25 62.04 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 126.85 2.06 . . . . 0.0 112.416 169.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 28.6 tp 71.29 97.95 0.07 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 128.408 2.683 . . . . 0.0 108.909 -170.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 33.6 m -51.62 11.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 129.414 3.086 . . . . 0.0 118.418 -176.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.5 mm-40 80.64 -28.58 0.13 Allowed 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 119.749 -1.844 . . . . 0.0 113.464 157.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.9 p -62.12 43.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 C-N-CA 128.755 2.822 . . . . 0.0 115.691 176.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 67.32 6.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 C-N-CA 127.609 2.364 . . . . 0.0 113.058 177.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.8 tt 71.97 93.71 0.08 Allowed 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 127.731 2.412 . . . . 0.0 107.414 -168.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.49 123.23 14.04 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.108 0.563 . . . . 0.0 112.326 -173.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 29.0 t -63.55 164.78 1.38 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 126.19 1.796 . . . . 0.0 110.149 169.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.88 19.27 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 126.098 1.759 . . . . 0.0 113.905 172.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 16.3 p -109.39 131.58 54.93 Favored 'General case' 0 CA--C 1.516 -0.352 0 O-C-N 120.124 -1.61 . . . . 0.0 114.268 -173.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -87.89 131.31 34.62 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 105.81 -1.922 . . . . 0.0 105.81 162.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -132.84 137.88 30.66 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 105.675 -1.972 . . . . 0.0 105.675 -174.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -73.6 179.37 5.65 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 124.682 3.588 . . . . 0.0 113.367 -168.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.55 0.967 0 CA-C-O 121.595 0.712 . . . . 0.0 111.178 178.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 29.3 mt . . . . . 0 N--CA 1.469 0.52 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.31 -37.69 68.89 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 122.833 0.453 . . . . 0.0 112.166 173.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.33 -30.19 62.27 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -176.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -46.4 -60.93 2.04 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 127.199 2.2 . . . . 0.0 110.015 169.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.13 -21.96 70.36 Favored Glycine 0 C--N 1.338 0.684 0 CA-C-O 118.806 -0.997 . . . . 0.0 112.842 -172.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -53.81 8.79 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.388 1.094 . . . . 0.0 110.171 169.089 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.98 -22.77 65.9 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -174.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -87.97 -19.38 27.3 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.369 0.986 . . . . 0.0 112.093 169.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -82.31 63.65 6.59 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.009 1.324 . . . . 0.0 110.097 171.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.5 166.88 20.13 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 125.033 1.333 . . . . 0.0 112.73 -168.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -71.64 -116.82 0.01 OUTLIER 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 124.671 3.581 . . . . 0.0 107.781 165.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 42.4 p -60.19 -22.18 62.64 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 -173.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 4.5 ttp180 -61.57 -36.24 80.08 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 121.635 2.016 . . . . 0.0 112.23 174.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 48.7 t -69.25 -41.74 76.54 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.027 0.83 . . . . 0.0 111.577 168.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 17.1 mmp_? -58.97 -52.44 65.73 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.372 0.669 . . . . 0.0 112.075 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 18.3 mm -42.78 -56.16 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 125.837 1.655 . . . . 0.0 109.832 172.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 94.6 mt -62.71 -45.53 92.33 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 118.983 -0.532 . . . . 0.0 112.422 -175.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 8.4 p -74.24 -28.05 22.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -178.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.8 -25.75 27.96 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 175.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 9.0 mt -62.23 -43.05 99.72 Favored 'General case' 0 CA--C 1.52 -0.178 0 O-C-N 121.28 -0.888 . . . . 0.0 111.977 172.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -41.65 -45.18 3.34 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 129.137 2.975 . . . . 0.0 115.092 -174.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -117.35 13.17 14.48 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 126.059 1.744 . . . . 0.0 112.658 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.69 -69.34 0.77 Allowed Glycine 0 N--CA 1.472 1.093 0 C-N-CA 127.321 2.391 . . . . 0.0 112.806 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 29.43 41.13 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 128.599 2.76 . . . . 0.0 117.201 -177.623 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 94.2 m -84.07 -79.31 0.21 Allowed 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 125.443 1.497 . . . . 0.0 110.208 173.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.36 158.35 51.17 Favored Pre-proline 0 N--CA 1.482 1.143 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 -168.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.08 -34.69 93.39 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 123.162 2.574 . . . . 0.0 113.519 176.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -76.92 -12.43 84.61 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-O 118.419 -1.212 . . . . 0.0 113.916 175.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.12 -31.15 72.2 Favored 'General case' 0 C--N 1.348 0.502 0 CA-C-N 120.076 1.938 . . . . 0.0 112.424 -170.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.1 mt -69.06 -7.34 34.88 Favored 'General case' 0 C--N 1.342 0.258 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -175.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.0 -39.06 80.7 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 118.422 0.555 . . . . 0.0 110.651 169.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.79 -43.93 57.41 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.62 0.768 . . . . 0.0 111.867 172.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 5.4 m-70 -59.13 -27.1 65.3 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 67.9 mt -111.83 -16.59 13.13 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.983 1.713 . . . . 0.0 113.533 -177.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.09 15.26 69.45 Favored Glycine 0 CA--C 1.536 1.367 0 CA-C-N 118.757 0.708 . . . . 0.0 112.708 -168.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 86.4 mt -108.76 171.04 7.66 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.753 1.276 . . . . 0.0 113.453 -173.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.9 t -69.98 151.09 45.99 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 122.026 0.917 . . . . 0.0 111.149 169.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -54.45 -18.92 4.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.686 1.594 . . . . 0.0 113.553 168.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 11.7 t -68.05 -58.62 4.2 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.066 0.848 . . . . 0.0 111.493 169.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -59.32 -36.73 76.16 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.452 -0.78 . . . . 0.0 112.531 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 42.1 t -57.83 -50.29 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 123.419 0.688 . . . . 0.0 111.027 170.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 41.2 m -68.7 -31.82 71.18 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -178.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 32.4 t-20 -57.43 -62.0 2.09 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.212 1.405 . . . . 0.0 109.806 178.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 -68.13 -24.53 65.02 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 121.034 -1.041 . . . . 0.0 112.876 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 73.7 mt -69.97 -19.19 63.37 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 119.711 1.141 . . . . 0.0 113.76 170.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 89.3 p -58.16 -48.17 81.11 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 121.075 1.761 . . . . 0.0 111.892 174.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 51.7 t -68.89 -46.23 68.91 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.566 0.621 . . . . 0.0 111.034 175.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 2.9 tp -57.52 -36.83 72.08 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.307 1.043 . . . . 0.0 113.357 -171.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -90.13 -16.38 29.7 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.242 1.417 . . . . 0.0 112.867 178.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -79.97 -51.71 4.95 Favored Glycine 0 N--CA 1.472 1.06 0 CA-C-N 119.38 0.991 . . . . 0.0 111.135 170.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 83.4 m -74.44 3.19 7.91 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 126.913 2.085 . . . . 0.0 113.903 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.53 3.95 50.24 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.006 1.288 . . . . 0.0 115.446 169.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 84.5 mt -57.85 -23.81 54.59 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.496 1.648 . . . . 0.0 112.619 176.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.8 m -126.73 147.6 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 126.742 2.017 . . . . 0.0 111.662 168.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 65.8 t -136.05 132.99 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 126.838 2.055 . . . . 0.0 109.589 -176.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.75 157.82 27.04 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.832 1.653 . . . . 0.0 113.488 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 15.7 m -165.29 140.73 5.22 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.547 1.539 . . . . 0.0 108.072 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -63.83 122.29 16.08 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.814 0.734 . . . . 0.0 111.479 172.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . 0.431 ' CD ' ' H ' ' B' ' 72' ' ' GLN . 5.1 pt-20 -71.99 -21.66 61.54 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -178.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 116.25 4.67 17.92 Favored Glycine 0 CA--C 1.539 1.589 0 C-N-CA 125.52 1.534 . . . . 0.0 113.834 -168.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 29.2 ttm180 -155.5 -53.46 0.09 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.187 1.395 . . . . 0.0 111.493 175.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . 0.431 ' H ' ' CD ' ' B' ' 69' ' ' GLU . 9.4 mm-40 -116.37 -125.04 0.28 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.57 1.548 . . . . 0.0 108.181 167.013 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 11.5 p -149.13 137.07 14.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 126.095 1.758 . . . . 0.0 107.182 -167.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.2 ptt85 -105.04 170.84 7.64 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.967 1.307 . . . . 0.0 109.034 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -129.27 116.14 18.68 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 168.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -108.43 169.18 8.81 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.773 1.229 . . . . 0.0 109.579 175.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 tp -59.88 162.07 5.85 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.987 0.915 . . . . 0.0 111.421 169.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -48.96 -54.42 15.62 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.981 0.912 . . . . 0.0 112.603 176.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -165.97 165.63 17.91 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.708 1.203 . . . . 0.0 110.945 -169.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 92.2 p -40.26 -37.5 0.65 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.615 2.366 . . . . 0.0 112.582 166.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -52.33 -58.45 6.63 Favored 'General case' 0 C--N 1.341 0.231 0 C-N-CA 125.165 1.386 . . . . 0.0 113.762 173.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 13.9 mt -70.36 -32.47 70.17 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.505 1.048 . . . . 0.0 110.011 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.5 -28.33 67.74 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.682 0.793 . . . . 0.0 111.769 -176.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.42 -71.11 0.46 Allowed 'General case' 0 C--O 1.22 -0.461 0 CA-C-O 116.63 -1.652 . . . . 0.0 111.407 168.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.9 -22.91 65.97 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 122.998 2.635 . . . . 0.0 115.253 -170.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.57 -46.55 25.81 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.049 -1.032 . . . . 0.0 110.356 167.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.24 -28.83 74.02 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 126.158 1.837 . . . . 0.0 115.304 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.11 -26.9 67.99 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.673 1.989 . . . . 0.0 112.257 168.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 34.7 tp 70.32 100.11 0.06 Allowed 'General case' 0 C--O 1.232 0.172 0 C-N-CA 128.481 2.712 . . . . 0.0 109.281 -172.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 34.0 m -51.5 11.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 C-N-CA 129.431 3.092 . . . . 0.0 118.247 -178.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.433 ' C ' ' H ' ' B' ' 93' ' ' VAL . 31.0 mm-40 77.84 -18.0 0.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 O-C-N 119.854 -1.779 . . . . 0.0 114.53 159.284 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 4.5 p -66.42 34.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 127.049 2.14 . . . . 0.0 113.452 168.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . 0.433 ' H ' ' C ' ' B' ' 91' ' ' GLN . 2.7 t 69.98 1.07 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.028 0 C-N-CA 127.381 2.273 . . . . 0.0 113.367 169.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 87.53 99.41 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 130.101 3.36 . . . . 0.0 107.135 -174.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.611 0 C-N-CA 124.159 0.984 . . . . 0.0 113.137 -173.765 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 pp . . . . . 0 CA--C 1.535 0.374 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.94 -56.83 9.69 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 169.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 -53.76 -36.37 62.29 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.369 1.068 . . . . 0.0 113.647 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.25 -64.92 0.75 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.492 1.517 . . . . 0.0 110.404 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.64 -19.18 76.32 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 118.927 -0.929 . . . . 0.0 113.531 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -65.55 -4.09 5.5 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.63 1.715 . . . . 0.0 113.328 174.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.4 -6.73 1.54 Allowed 'General case' 0 CA--C 1.547 0.865 0 CA-C-O 117.116 -1.421 . . . . 0.0 114.3 169.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.88 -31.61 17.25 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 121.394 1.906 . . . . 0.0 110.171 165.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -94.73 76.04 3.69 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.435 1.094 . . . . 0.0 111.913 -177.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.511 ' CG ' ' HE ' ' A' ' 23' ' ' ARG . 1.4 t70 -164.27 140.34 5.0 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 126.62 1.968 . . . . 0.0 111.239 -173.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -51.84 -60.59 0.72 Allowed 'Trans proline' 0 C--N 1.353 0.81 1 C-N-CA 125.463 4.109 . . . . 0.0 112.97 -171.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.415 ' HG1' ' CE1' ' A' ' 54' ' ' HIS . 2.9 m -79.15 -31.36 44.02 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 119.425 -0.321 . . . . 0.0 110.566 -173.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.511 ' HE ' ' CG ' ' A' ' 20' ' ' ASP . 67.1 mtm180 -69.23 -33.56 73.48 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 116.241 -1.838 . . . . 0.0 113.633 -173.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 44.5 t -57.67 -55.21 37.79 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 121.185 1.812 . . . . 0.0 110.29 168.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 44.3 mtt180 -45.2 -45.33 11.63 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.221 1.408 . . . . 0.0 112.998 169.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.5 mt -62.4 -58.41 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 CA-C-N 120.181 1.355 . . . . 0.0 111.156 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.13 -44.86 79.57 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.967 0.907 . . . . 0.0 110.883 -175.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.4 p -79.2 -29.39 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 124.496 1.118 . . . . 0.0 112.374 -174.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.73 -35.11 30.08 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 122.893 0.477 . . . . 0.0 112.022 175.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.2 tp -67.29 -32.14 72.93 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 116.733 -1.603 . . . . 0.0 112.37 172.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -41.67 -45.31 3.39 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.431 1.892 . . . . 0.0 112.579 -178.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -99.9 -26.22 14.08 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.524 1.93 . . . . 0.0 112.724 169.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -83.01 -3.7 90.33 Favored Glycine 0 C--N 1.339 0.74 0 CA-C-O 116.591 -2.227 . . . . 0.0 117.101 -168.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.7 m -29.91 45.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.663 1 C-N-CA 132.087 4.155 . . . . 0.0 120.564 171.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 2.4 t -107.78 -51.88 2.84 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 119.369 -2.082 . . . . 0.0 113.203 -175.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.3 p90 -158.24 157.78 29.34 Favored Pre-proline 0 N--CA 1.477 0.882 0 N-CA-C 115.347 1.61 . . . . 0.0 115.347 -178.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -55.83 128.77 31.67 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.223 1.949 . . . . 0.0 108.214 169.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.69 -3.61 68.36 Favored Glycine 0 CA--C 1.531 1.086 0 CA-C-O 116.639 -2.201 . . . . 0.0 115.413 -176.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.502 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -53.94 -37.3 63.72 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 121.475 2.638 . . . . 0.0 110.841 170.702 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 20.5 mt -53.14 -28.99 28.71 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 127.144 2.178 . . . . 0.0 112.488 176.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.79 -32.62 70.78 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 118.427 0.558 . . . . 0.0 110.89 -179.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.82 -45.62 27.96 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.687 0.795 . . . . 0.0 112.092 174.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.502 ' CD2' HE22 ' A' ' 39' ' ' GLN . 4.8 m-70 -58.8 -32.66 69.54 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 175.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 16.0 mt -102.37 -26.86 13.13 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -173.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.41 1.79 66.1 Favored Glycine 0 CA--C 1.533 1.215 0 CA-C-N 119.503 1.047 . . . . 0.0 113.975 -170.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.9 mp -99.52 147.44 25.31 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.104 0.952 . . . . 0.0 109.663 177.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 70.4 p -59.23 151.95 21.87 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.305 1.442 . . . . 0.0 111.184 -169.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.14 -20.34 57.94 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.308 171.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.3 m -73.62 -55.29 6.48 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.232 -0.918 . . . . 0.0 110.805 169.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -53.08 -56.45 16.11 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.402 1.081 . . . . 0.0 110.898 178.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 69.3 t -65.96 -24.5 34.11 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 O-C-N 120.904 -1.122 . . . . 0.0 112.428 -177.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.7 m -71.05 -36.69 72.42 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 120.54 1.518 . . . . 0.0 113.657 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -52.99 -50.48 64.1 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.675 0.79 . . . . 0.0 110.4 169.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.415 ' CE1' ' HG1' ' A' ' 22' ' ' THR . 38.1 m80 -63.84 -36.06 82.68 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.381 1.073 . . . . 0.0 113.688 178.129 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 21.3 mt -72.51 -31.56 65.44 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 117.841 -1.076 . . . . 0.0 113.533 174.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.89 -46.7 43.08 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.821 1.191 . . . . 0.0 112.876 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 4.0 t -78.9 -35.63 43.28 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-O 121.601 0.715 . . . . 0.0 112.093 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.6 tp -59.61 -38.44 81.29 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.738 1.215 . . . . 0.0 112.332 178.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 45.2 mtm105 -77.47 -30.0 52.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.372 1.069 . . . . 0.0 112.467 177.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.33 -40.39 5.76 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 124.59 1.091 . . . . 0.0 114.769 -173.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 69.9 m -71.6 -9.75 58.71 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 124.116 0.966 . . . . 0.0 111.828 171.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 91.17 20.76 37.67 Favored Glycine 0 C--N 1.344 0.976 0 C-N-CA 125.472 1.511 . . . . 0.0 115.851 168.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.3 mt -86.6 -23.09 25.87 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.622 1.711 . . . . 0.0 114.799 178.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.5 m -127.97 148.49 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 124.728 1.211 . . . . 0.0 111.214 169.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 25.6 t -137.45 148.96 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.383 1.473 . . . . 0.0 109.8 -178.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.97 160.88 30.06 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.262 1.425 . . . . 0.0 113.814 173.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.2 m -163.24 167.8 21.48 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.392 1.877 . . . . 0.0 108.426 173.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -101.68 121.19 41.58 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 165.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.27 -13.25 59.36 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -178.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 133.37 -26.01 3.57 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 125.762 1.648 . . . . 0.0 113.958 173.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 48.5 ttt-85 -132.62 -10.75 3.14 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.395 1.878 . . . . 0.0 112.737 172.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -148.79 160.05 43.57 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.892 2.077 . . . . 0.0 111.304 -177.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 23.4 m -82.91 145.0 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 O-C-N 121.44 -0.787 . . . . 0.0 109.757 168.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.1 ptt180 -131.2 165.62 22.93 Favored 'General case' 0 CA--C 1.518 -0.275 0 C-N-CA 124.769 1.228 . . . . 0.0 110.408 -172.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -107.65 148.64 29.1 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 163.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -147.67 156.97 43.32 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 123.397 0.679 . . . . 0.0 110.146 174.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tp -53.96 144.79 18.06 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 123.542 0.526 . . . . 0.0 110.172 170.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.97 -20.12 64.17 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 116.083 1.883 . . . . 0.0 116.083 -170.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -168.97 164.03 11.47 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.711 1.604 . . . . 0.0 112.367 173.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 50.7 m -51.49 -30.14 18.99 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.845 2.058 . . . . 0.0 112.574 168.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -52.82 -58.24 7.57 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 126.643 1.977 . . . . 0.0 112.334 171.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 19.1 mt -64.21 -44.19 92.7 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 177.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -56.94 -34.3 67.87 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 125.068 1.347 . . . . 0.0 111.444 -175.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.1 ttm-85 -74.22 -57.7 3.78 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 116.685 -1.626 . . . . 0.0 112.092 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.26 -22.91 64.73 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 122.103 2.229 . . . . 0.0 113.33 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 54.5 tp -71.64 -45.52 61.81 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.425 1.89 . . . . 0.0 110.69 168.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.53 -36.24 12.52 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 126.147 1.832 . . . . 0.0 115.088 -171.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -77.91 -5.51 51.32 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.34 1.456 . . . . 0.0 112.777 176.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 25.9 tp 60.79 89.46 0.07 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.657 2.383 . . . . 0.0 113.484 168.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.3 m -41.37 150.42 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 125.194 1.398 . . . . 0.0 112.4 176.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -72.0 2.9 4.94 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 -159.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.7 p -66.45 35.39 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 126.289 1.836 . . . . 0.0 114.221 174.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 61.08 20.01 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 126.396 1.879 . . . . 0.0 113.544 169.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 tt 94.93 106.96 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 129.337 3.055 . . . . 0.0 106.513 -167.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.79 89.5 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.97 0.908 . . . . 0.0 111.667 170.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.0 t -63.43 135.57 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 125.201 1.4 . . . . 0.0 110.266 171.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -62.57 6.26 0.1 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 127.547 2.339 . . . . 0.0 115.065 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.6 138.09 58.09 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 122.307 1.051 . . . . 0.0 110.612 176.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -92.92 153.6 18.69 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 113.438 -1.71 . . . . 0.0 107.595 164.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -161.16 136.17 5.55 Favored Pre-proline 0 N--CA 1.447 -0.575 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 174.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -60.59 165.34 11.64 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 121.331 1.354 . . . . 0.0 109.886 169.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 46.3 t . . . . . 0 CA--C 1.555 1.143 0 CA-C-O 122.647 1.213 . . . . 0.0 110.189 170.699 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 pp . . . . . 0 N--CA 1.468 0.466 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.93 -55.27 27.4 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.95 0.9 . . . . 0.0 109.982 169.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 24.5 ttm180 -60.07 -40.13 88.44 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 177.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -53.54 -59.27 4.81 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.451 1.1 . . . . 0.0 110.416 176.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -73.26 -21.1 79.99 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-O 118.739 -1.034 . . . . 0.0 113.689 -177.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.83 -18.11 53.73 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 126.465 1.906 . . . . 0.0 114.179 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -123.83 -7.58 7.87 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 177.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 3.1 mt -87.56 -37.08 17.17 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 119.429 1.013 . . . . 0.0 110.911 167.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.6 77.45 5.67 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.647 1.179 . . . . 0.0 111.676 -177.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -163.78 139.16 4.97 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 125.219 1.408 . . . . 0.0 111.598 -171.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -51.46 -50.26 14.5 Favored 'Trans proline' 0 C--N 1.353 0.8 1 C-N-CA 125.677 4.251 . . . . 0.0 114.117 -172.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 45.7 m -91.83 -32.96 15.14 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 119.394 -0.336 . . . . 0.0 110.52 -172.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 74.1 mtm180 -68.74 -34.21 75.22 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 116.571 -1.68 . . . . 0.0 112.691 -177.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 45.9 t -55.13 -55.51 30.32 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 120.755 1.616 . . . . 0.0 110.637 168.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -48.07 -52.27 20.96 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.126 1.37 . . . . 0.0 112.47 172.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.5 mt -51.12 -58.83 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 CA-C-N 119.424 1.011 . . . . 0.0 111.234 174.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 93.4 mt -63.37 -41.84 98.82 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.222 1.009 . . . . 0.0 111.176 -169.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.7 p -75.98 -26.72 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.226 0.611 . . . . 0.0 112.399 178.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.61 -39.09 67.56 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 118.793 -0.622 . . . . 0.0 111.039 169.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 2.1 tp -65.32 -26.62 68.13 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 -176.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 7.8 mt -45.95 -26.51 0.72 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 125.959 1.704 . . . . 0.0 112.205 168.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -113.64 -31.65 6.42 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 127.658 2.383 . . . . 0.0 111.522 167.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . 0.423 ' C ' ' H ' ' B' ' 35' ' ' CYS . . . -82.51 15.57 29.26 Favored Glycine 0 C--N 1.335 0.477 0 C-N-CA 129.775 3.559 . . . . 0.0 115.204 -166.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 26.1 m -60.15 28.75 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.038 0 C-N-CA 126.111 1.765 . . . . 0.0 115.565 167.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . 0.423 ' H ' ' C ' ' B' ' 33' ' ' GLY . 0.0 OUTLIER -85.6 -73.11 0.46 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.434 1.494 . . . . 0.0 111.528 179.944 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -159.07 157.35 27.86 Favored Pre-proline 0 N--CA 1.474 0.726 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -169.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -57.29 121.27 9.76 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.628 2.218 . . . . 0.0 109.046 173.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.91 -5.66 83.2 Favored Glycine 0 CA--C 1.531 1.071 0 CA-C-O 117.572 -1.682 . . . . 0.0 115.024 -175.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . 0.556 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -57.67 -35.11 70.13 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 120.942 2.371 . . . . 0.0 111.402 172.114 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 23.0 mt -56.96 -25.33 57.69 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 125.216 1.406 . . . . 0.0 111.928 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.85 -32.75 73.12 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 121.883 -0.51 . . . . 0.0 111.461 -174.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.11 -49.12 18.26 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.486 0.714 . . . . 0.0 111.543 172.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . 0.556 ' CD2' HE22 ' B' ' 39' ' ' GLN . 2.8 m-70 -56.18 -32.92 64.78 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.217 1.191 . . . . 0.0 114.217 178.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 14.1 mt -104.02 -23.87 13.28 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.624 1.17 . . . . 0.0 113.118 -173.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.18 -6.67 49.24 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.533 1.063 . . . . 0.0 114.1 -171.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 10.6 mp -93.19 156.39 16.87 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.44 1.096 . . . . 0.0 109.539 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 71.2 p -71.91 154.7 41.05 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 122.448 1.118 . . . . 0.0 111.745 -170.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 -56.68 -25.34 53.68 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.099 169.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 15.3 m -71.82 -58.28 3.6 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.657 1.183 . . . . 0.0 110.633 169.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -53.27 -58.12 8.17 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.831 1.252 . . . . 0.0 111.676 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 88.7 t -63.33 -22.09 29.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 121.363 -0.836 . . . . 0.0 111.575 -175.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 50.1 m -68.69 -36.32 78.33 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 119.87 1.213 . . . . 0.0 113.93 178.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -56.72 -47.14 80.63 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.98 0.809 . . . . 0.0 111.61 169.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -63.69 -32.24 73.66 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.092 0.957 . . . . 0.0 112.621 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 43.4 mt -75.87 -32.92 59.93 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.084 1.354 . . . . 0.0 113.628 172.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 19.4 m -54.61 -39.02 67.47 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 120.292 1.405 . . . . 0.0 113.323 177.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 42.1 t -69.18 -47.86 63.76 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.524 1.056 . . . . 0.0 112.132 171.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.3 tp -58.25 -37.82 75.67 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.359 1.464 . . . . 0.0 112.0 -171.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 34.3 mtm105 -83.12 -7.03 59.69 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.842 1.657 . . . . 0.0 113.774 178.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -106.6 -37.95 2.32 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 125.558 1.551 . . . . 0.0 114.414 177.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 22.5 m -73.75 -13.54 60.97 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 124.928 1.291 . . . . 0.0 112.288 172.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.33 20.14 42.89 Favored Glycine 0 C--N 1.341 0.837 0 CA-C-O 118.355 -1.247 . . . . 0.0 114.572 172.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.05 -24.09 30.6 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 119.626 1.713 . . . . 0.0 113.825 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 3.5 m -127.72 147.28 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 124.336 1.054 . . . . 0.0 113.003 171.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 24.2 t -130.0 143.05 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.373 1.869 . . . . 0.0 110.808 -176.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.02 152.34 27.98 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.787 1.635 . . . . 0.0 112.936 174.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.9 m -161.02 172.26 17.2 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.393 1.477 . . . . 0.0 109.075 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -100.99 126.05 47.63 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 165.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.34 -14.38 59.02 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 177.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 136.12 -26.77 3.08 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 126.201 1.858 . . . . 0.0 114.0 175.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 51.5 ttt-85 -136.42 -6.9 1.99 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.809 2.044 . . . . 0.0 112.977 174.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -150.36 160.23 43.88 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.17 2.188 . . . . 0.0 110.749 -178.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 33.6 m -82.4 148.02 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 O-C-N 121.509 -0.745 . . . . 0.0 110.565 169.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 3.0 ptt180 -132.52 167.99 19.02 Favored 'General case' 0 C--O 1.231 0.116 0 C-N-CA 125.43 1.492 . . . . 0.0 110.745 -171.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -112.16 160.58 17.44 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 164.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -160.28 150.61 18.37 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 120.742 -1.224 . . . . 0.0 111.257 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -49.94 129.65 20.71 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 169.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.23 0.41 2.8 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 -168.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -179.61 161.74 1.05 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 128.123 2.569 . . . . 0.0 110.644 169.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 43.4 m -48.35 -29.99 4.49 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.573 1.549 . . . . 0.0 111.797 168.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -49.08 -53.78 18.96 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 126.226 1.811 . . . . 0.0 113.526 171.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 13.3 mt -79.45 -41.41 27.62 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.919 -0.562 . . . . 0.0 109.818 -175.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.9 -36.11 59.03 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.033 0.533 . . . . 0.0 111.952 170.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 34.5 ttm-85 -75.93 -61.04 2.06 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-O 116.719 -1.61 . . . . 0.0 112.836 174.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.04 -20.74 66.28 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 122.5 2.409 . . . . 0.0 113.384 -176.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.15 -53.54 8.14 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.672 -0.643 . . . . 0.0 109.28 166.657 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.98 -28.36 70.65 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.374 1.464 . . . . 0.0 115.574 -171.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -78.38 -6.76 56.12 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.681 1.24 . . . . 0.0 112.051 169.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 30.6 tp 60.67 86.36 0.1 Allowed 'General case' 0 C--N 1.345 0.394 0 C-N-CA 127.623 2.369 . . . . 0.0 113.565 167.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.2 m -43.36 147.59 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 CA-C-O 122.667 1.222 . . . . 0.0 112.986 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.474 ' C ' ' H ' ' B' ' 93' ' ' VAL . 20.1 mm-40 -68.54 6.62 0.78 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 117.021 2.23 . . . . 0.0 117.021 -163.054 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 6.1 p -66.28 32.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 126.476 1.911 . . . . 0.0 113.243 169.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . 0.474 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.4 OUTLIER 63.16 11.63 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 128.6 2.76 . . . . 0.0 114.359 171.499 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.6 tt 102.05 107.62 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 130.519 3.528 . . . . 0.0 105.35 -167.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.573 0 C-N-CA 124.617 1.167 . . . . 0.0 111.812 174.465 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.569 HD22 ' H ' ' A' ' 12' ' ' ALA . 1.1 pt? . . . . . 0 N--CA 1.475 0.797 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.569 ' H ' HD22 ' A' ' 11' ' ' LEU . . . -67.25 -18.72 65.34 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.661 1.584 . . . . 0.0 113.468 177.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.459 HH11 ' HG2' ' A' ' 13' ' ' ARG . 0.2 OUTLIER -86.11 -42.81 13.58 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.052 0.842 . . . . 0.0 109.421 167.738 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.55 -46.41 82.94 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.623 1.569 . . . . 0.0 112.25 -171.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.96 -18.39 68.7 Favored Glycine 0 CA--C 1.535 1.333 0 O-C-N 121.182 -0.949 . . . . 0.0 113.073 172.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 81.6 mtp180 -99.16 29.84 3.72 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 127.546 2.339 . . . . 0.0 111.314 170.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.93 -35.47 0.57 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.463 1.905 . . . . 0.0 111.898 169.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mt -95.78 -39.38 9.88 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 178.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -96.26 54.35 1.41 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.656 1.116 . . . . 0.0 109.54 170.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -132.42 138.28 31.82 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 126.933 2.093 . . . . 0.0 108.202 -168.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -52.61 -98.35 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.809 1 C-N-CA 126.66 4.907 . . . . 0.0 115.789 -164.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.95 -27.82 63.76 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 125.571 1.548 . . . . 0.0 111.799 175.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.39 -36.04 63.5 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -174.169 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 14.1 t -65.85 -38.0 87.7 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.519 -1.363 . . . . 0.0 109.921 167.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -57.52 -38.55 74.84 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.056 0.942 . . . . 0.0 112.964 169.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.9 mm -62.11 -49.52 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 O-C-N 120.717 -1.24 . . . . 0.0 110.997 170.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.4 mt -58.61 -48.46 80.9 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.246 0.475 . . . . 0.0 112.157 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.2 p -68.51 -20.39 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 118.986 0.812 . . . . 0.0 112.782 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.51 -16.84 60.24 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.351 1.061 . . . . 0.0 113.069 171.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.39 -13.55 27.91 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 170.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.92 -20.92 64.3 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.211 163.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -116.99 -60.39 1.85 Allowed 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 127.456 2.302 . . . . 0.0 115.205 -177.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.37 -83.05 0.43 Allowed Glycine 0 C--N 1.343 0.948 0 C-N-CA 124.989 1.281 . . . . 0.0 114.313 -165.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.8 m 49.58 30.96 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 125.288 1.435 . . . . 0.0 113.768 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.6 m -77.81 -66.52 0.83 Allowed 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 178.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -140.88 156.63 68.57 Favored Pre-proline 0 C--O 1.238 0.465 0 CA-C-O 118.665 -0.683 . . . . 0.0 112.124 -169.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -59.13 115.37 2.52 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 122.509 2.139 . . . . 0.0 109.128 169.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 95.93 -0.88 62.84 Favored Glycine 0 CA--C 1.531 1.084 0 CA-C-O 117.552 -1.693 . . . . 0.0 115.93 -178.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.23 -30.47 71.53 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.949 2.374 . . . . 0.0 112.317 172.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.584 HD12 ' H ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -56.5 -22.65 34.11 Favored 'General case' 0 C--O 1.222 -0.346 0 C-N-CA 124.431 1.093 . . . . 0.0 111.61 177.833 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.25 -36.99 79.03 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.482 0.713 . . . . 0.0 112.322 176.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.45 -38.06 74.43 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.372 0.533 . . . . 0.0 111.436 175.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -64.57 -38.12 89.92 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 175.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 32.9 mt -99.69 -14.67 18.82 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -172.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 64.8 25.36 70.49 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-O 118.717 -1.046 . . . . 0.0 112.281 -169.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 67.4 mt -126.95 134.53 50.38 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.266 1.027 . . . . 0.0 112.223 -176.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.3 p -50.18 156.81 0.75 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.101 1.36 . . . . 0.0 114.311 -168.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.6 ttm180 -53.24 -26.16 16.96 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.07 -1.423 . . . . 0.0 112.049 169.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.6 m -80.04 -47.23 15.2 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.063 -1.023 . . . . 0.0 111.778 175.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -60.07 -52.61 64.62 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.481 1.112 . . . . 0.0 110.266 176.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.4 t -58.84 -38.92 75.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 121.018 -1.051 . . . . 0.0 111.955 176.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 74.9 m -64.69 -39.72 94.15 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.916 1.234 . . . . 0.0 113.31 174.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -56.51 -52.55 64.32 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.676 0.79 . . . . 0.0 110.771 174.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 20.0 m80 -61.22 -39.77 91.53 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 48.7 mt -68.09 -25.85 65.53 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.171 -0.919 . . . . 0.0 112.968 175.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.4 t -59.42 -56.82 17.23 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 120.705 1.593 . . . . 0.0 113.637 -168.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 30.8 t -67.95 -28.78 67.76 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 122.209 -0.307 . . . . 0.0 111.764 172.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.4 tp -60.78 -35.42 76.4 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.915 0.886 . . . . 0.0 111.647 177.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 87.0 mtm-85 -74.83 -28.98 60.91 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.188 0.995 . . . . 0.0 112.026 172.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.39 -50.31 6.76 Favored Glycine 0 N--CA 1.472 1.072 0 CA-C-N 119.357 0.981 . . . . 0.0 113.129 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 18.2 m -67.53 -2.01 5.89 Favored 'General case' 0 CA--C 1.562 1.423 0 C-N-CA 126.826 2.05 . . . . 0.0 111.444 168.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.32 -0.62 16.23 Favored Glycine 0 C--N 1.343 0.959 0 C-N-CA 126.884 2.183 . . . . 0.0 115.191 173.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 77.5 mt -53.27 -25.67 15.39 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.13 1.772 . . . . 0.0 112.667 179.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 3.3 m -123.91 153.31 29.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 126.718 2.007 . . . . 0.0 109.641 164.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -142.32 155.28 18.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 C-N-CA 126.77 2.028 . . . . 0.0 109.891 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.6 151.93 28.8 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 122.706 1.241 . . . . 0.0 111.009 171.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.0 m -158.11 -170.85 3.28 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 127.008 2.123 . . . . 0.0 105.959 173.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -120.91 157.99 28.66 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 119.773 1.17 . . . . 0.0 113.418 174.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -110.49 -151.45 0.48 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 126.641 1.976 . . . . 0.0 109.414 167.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.48 -12.49 56.22 Favored Glycine 0 CA--C 1.539 1.562 0 O-C-N 120.027 -1.671 . . . . 0.0 116.332 -172.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -164.54 -28.71 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.644 1.577 . . . . 0.0 113.307 173.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -99.48 170.64 8.47 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.801 1.64 . . . . 0.0 110.405 -177.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 26.0 m -80.81 160.87 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 O-C-N 121.92 -0.488 . . . . 0.0 111.54 168.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -126.61 171.78 10.83 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.394 1.877 . . . . 0.0 110.455 175.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -123.87 121.96 36.72 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.214 1.406 . . . . 0.0 107.963 167.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.13 167.53 17.44 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.866 1.266 . . . . 0.0 111.552 177.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 69.7 mt -60.61 156.7 15.98 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.573 0.749 . . . . 0.0 111.765 172.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.22 -51.36 68.35 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 125.948 1.699 . . . . 0.0 113.846 179.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -164.27 173.55 12.18 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 123.683 1.706 . . . . 0.0 114.258 -167.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 43.2 t -47.18 -42.42 19.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 113.168 -1.833 . . . . 0.0 113.308 170.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 55.9 m-70 -63.97 -42.47 97.25 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 116.938 -1.506 . . . . 0.0 113.478 -178.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 10.2 mt -71.9 -45.14 62.3 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 121.188 1.813 . . . . 0.0 109.846 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.99 -35.65 59.44 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.814 0.846 . . . . 0.0 111.782 175.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.418 ' HE ' ' CD ' ' A' ' 88' ' ' GLU . 0.4 OUTLIER -70.86 -67.27 0.52 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 128.398 2.679 . . . . 0.0 112.661 175.532 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.74 -30.25 70.43 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -173.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.04 -39.57 60.92 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.723 -0.611 . . . . 0.0 109.642 169.394 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -57.61 -45.06 93.64 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 125.897 1.713 . . . . 0.0 114.347 -178.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.418 ' CD ' ' HE ' ' A' ' 84' ' ' ARG . 2.0 pt-20 -87.84 3.76 47.09 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 174.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 39.0 tp 73.5 143.2 0.07 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 129.3 3.04 . . . . 0.0 111.64 177.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 31.2 m -38.25 -20.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 128.992 2.917 . . . . 0.0 116.367 176.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 86.82 -35.83 0.03 OUTLIER 'General case' 0 C--O 1.218 -0.594 0 C-N-CA 126.232 1.813 . . . . 0.0 108.963 161.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 8.7 p -62.62 36.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 128.915 2.886 . . . . 0.0 114.677 168.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.5 t 79.07 -25.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 128.7 2.8 . . . . 0.0 113.027 170.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 tt 110.59 99.05 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.636 1 C-N-CA 132.57 4.348 . . . . 0.0 104.582 -169.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.99 133.84 56.48 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 119.309 -0.377 . . . . 0.0 110.968 -178.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.1 t -74.76 137.14 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -166.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -60.68 -23.04 64.53 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.26 1.424 . . . . 0.0 114.72 173.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 59.0 p -64.82 117.08 7.01 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.382 1.073 . . . . 0.0 109.098 176.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -69.46 12.77 0.16 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.083 2.153 . . . . 0.0 114.447 -175.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 -74.16 159.29 84.21 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 125.674 1.59 . . . . 0.0 113.424 -167.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.85 135.92 43.23 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.376 2.718 . . . . 0.0 110.965 169.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 20.5 p . . . . . 0 CA--C 1.544 0.74 0 C-N-CA 123.833 0.853 . . . . 0.0 110.816 168.424 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . 0.524 HD22 ' H ' ' B' ' 12' ' ' ALA . 1.2 pt? . . . . . 0 N--CA 1.468 0.468 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . 0.524 ' H ' HD22 ' B' ' 11' ' ' LEU . . . -63.29 -21.9 66.54 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.541 1.536 . . . . 0.0 114.202 176.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . 0.456 HH11 ' HG2' ' B' ' 13' ' ' ARG . 1.3 mmt-85 -84.03 -41.11 17.58 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 119.607 1.094 . . . . 0.0 111.723 170.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -57.98 -52.73 64.31 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.709 1.604 . . . . 0.0 111.114 177.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.39 -22.48 69.45 Favored Glycine 0 CA--C 1.533 1.177 0 O-C-N 121.884 -0.51 . . . . 0.0 112.715 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 72.3 mtp180 -87.47 14.05 8.89 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 126.212 1.805 . . . . 0.0 112.508 173.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -125.19 -37.58 2.39 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.845 1.258 . . . . 0.0 112.354 168.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 24.5 mt -88.88 -25.75 21.97 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.541 -1.218 . . . . 0.0 113.078 178.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -115.9 55.16 0.8 Allowed 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 120.977 1.717 . . . . 0.0 110.705 168.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -133.43 143.9 49.99 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 127.587 2.355 . . . . 0.0 106.678 -174.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -57.54 -98.98 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.945 1 C-N-CA 125.698 4.266 . . . . 0.0 115.7 -163.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.401 ' HG1' ' CD2' ' B' ' 54' ' ' HIS . 1.3 p -53.08 -32.92 49.69 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.515 1.926 . . . . 0.0 112.42 172.062 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.84 -43.85 62.12 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.687 0.795 . . . . 0.0 112.906 -170.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 46.8 t -63.38 -39.26 94.04 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.193 0.906 . . . . 0.0 109.455 168.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -55.92 -33.24 64.5 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 120.582 -1.324 . . . . 0.0 113.973 171.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.6 mm -62.06 -48.76 86.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 CA-C-N 120.23 1.377 . . . . 0.0 110.061 169.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 89.6 mt -58.56 -45.01 89.86 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.957 0.799 . . . . 0.0 112.066 176.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 51.8 t -61.38 -47.25 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 126.424 1.889 . . . . 0.0 110.847 179.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.52 -36.21 63.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.89 0.876 . . . . 0.0 112.298 -177.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 16.6 tp -66.17 -35.35 80.24 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 117.486 -1.245 . . . . 0.0 112.103 -178.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -37.14 -45.71 0.64 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 129.492 3.117 . . . . 0.0 113.91 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -105.34 -16.96 14.6 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.065 1.746 . . . . 0.0 113.165 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.28 -71.42 1.23 Allowed Glycine 0 C--N 1.341 0.85 0 C-N-CA 124.658 1.123 . . . . 0.0 112.329 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 34.6 m 33.45 36.43 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 -170.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.93 -76.27 0.3 Allowed 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.357 -0.84 . . . . 0.0 111.553 -177.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -145.74 158.15 50.11 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-O 118.648 -0.692 . . . . 0.0 112.82 -168.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -58.62 123.14 12.91 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.919 2.413 . . . . 0.0 110.162 172.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 88.19 -3.83 85.52 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 117.575 -1.68 . . . . 0.0 115.449 -174.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -32.82 71.08 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 120.493 2.146 . . . . 0.0 111.87 174.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 2.1 mt -59.52 -15.74 20.05 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 123.716 0.806 . . . . 0.0 112.246 179.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.9 -41.76 87.98 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.57 0.623 . . . . 0.0 111.159 175.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -75.57 -30.35 59.63 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.512 0.725 . . . . 0.0 112.418 176.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -69.01 -33.97 74.5 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 171.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 23.9 mt -106.59 -14.57 15.01 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -170.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.33 16.95 69.85 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-N 119.136 0.88 . . . . 0.0 113.008 -169.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 36.7 mt -117.65 139.63 50.74 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 118.506 1.153 . . . . 0.0 111.6 -175.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.2 p -59.67 161.68 5.92 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.388 0.675 . . . . 0.0 111.933 -172.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 20.7 ttm180 -58.61 -29.08 66.2 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 122.056 -0.403 . . . . 0.0 111.938 175.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 20.3 m -69.81 -46.07 66.5 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.386 0.994 . . . . 0.0 111.622 175.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -61.94 -55.19 32.02 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 122.821 0.449 . . . . 0.0 110.128 173.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . 0.402 ' HA ' ' HD1' ' B' ' 54' ' ' HIS . 2.8 t -56.26 -40.73 67.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 121.002 -1.061 . . . . 0.0 112.976 179.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 49.7 m -66.17 -37.93 86.83 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.663 1.12 . . . . 0.0 112.865 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -55.54 -49.97 71.25 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.93 0.786 . . . . 0.0 110.89 172.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . 0.402 ' HD1' ' HA ' ' B' ' 51' ' ' VAL . 20.6 m80 -64.17 -37.44 87.45 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 26.1 mt -73.27 -27.33 61.5 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 117.599 -1.191 . . . . 0.0 113.441 175.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.1 t -50.65 -63.71 1.04 Allowed 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.293 0.951 . . . . 0.0 112.608 -169.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.7 t -66.76 -33.79 76.41 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.541 0.736 . . . . 0.0 111.66 174.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 3.6 tp -53.34 -33.92 55.46 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.29 1.036 . . . . 0.0 112.47 178.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 79.9 mtm-85 -83.16 -21.54 33.51 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 173.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -80.73 -47.43 6.71 Favored Glycine 0 N--CA 1.475 1.273 0 CA-C-N 120.228 1.376 . . . . 0.0 111.825 176.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 3.3 m -62.93 -11.29 17.6 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.961 2.104 . . . . 0.0 112.388 168.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 59.65 28.09 64.83 Favored Glycine 0 C--N 1.345 1.083 0 C-N-CA 125.818 1.675 . . . . 0.0 113.477 -178.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 93.0 mt -73.15 -24.73 60.62 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 117.918 0.859 . . . . 0.0 111.167 168.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 4.5 m -130.28 159.68 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 C-N-CA 126.108 1.763 . . . . 0.0 110.284 168.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -145.5 155.44 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 126.016 1.726 . . . . 0.0 110.266 -172.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.28 150.77 24.55 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.073 1.349 . . . . 0.0 111.53 172.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 10.6 m -158.99 168.83 25.74 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 176.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -102.67 142.62 33.51 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.349 0.977 . . . . 0.0 111.197 168.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.261 1.6 pp20? -99.52 -155.74 0.52 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.35 1.06 . . . . 0.0 109.435 166.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -67.09 -14.95 64.49 Favored Glycine 0 CA--C 1.535 1.341 0 O-C-N 120.176 -1.577 . . . . 0.0 115.46 -171.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -159.19 -20.85 0.07 Allowed 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.95 1.375 . . . . 0.0 114.433 174.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -111.93 162.36 15.41 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.975 2.11 . . . . 0.0 110.994 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 17.6 m -82.1 152.4 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 O-C-N 121.468 -0.77 . . . . 0.0 109.377 167.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -129.15 168.67 15.8 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 122.594 1.188 . . . . 0.0 109.643 -178.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -113.16 148.2 35.86 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 164.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -149.55 157.8 43.6 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.307 1.043 . . . . 0.0 110.285 176.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -53.14 151.83 4.73 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.988 0.915 . . . . 0.0 110.651 168.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -49.66 -52.35 31.47 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.535 1.134 . . . . 0.0 113.775 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.35 179.81 3.76 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 122.818 1.294 . . . . 0.0 113.896 -167.115 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 24.5 t -49.3 -43.96 43.76 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.054 -1.43 . . . . 0.0 113.25 170.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -62.06 -48.42 80.31 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 117.664 -1.16 . . . . 0.0 112.926 -178.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 15.8 mt -68.72 -38.89 80.54 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 120.615 1.552 . . . . 0.0 109.954 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.35 -32.24 73.61 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.535 0.607 . . . . 0.0 110.994 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -69.56 -70.13 0.3 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 128.462 2.705 . . . . 0.0 110.936 171.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.72 -33.44 61.08 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 120.803 1.638 . . . . 0.0 114.555 -178.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 tt -77.65 -39.93 43.41 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 121.322 -0.861 . . . . 0.0 111.123 173.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.12 -46.77 90.23 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.634 1.588 . . . . 0.0 114.41 -173.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 12.8 pm0 -84.08 -0.49 52.05 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 119.255 1.528 . . . . 0.0 113.499 168.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . 0.404 ' C ' ' H ' ' B' ' 91' ' ' GLN . 33.8 tp 72.85 135.35 0.05 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 129.563 3.145 . . . . 0.0 111.504 177.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 97.5 t -62.79 8.62 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 129.225 3.01 . . . . 0.0 113.716 -176.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.404 ' H ' ' C ' ' B' ' 89' ' ' LEU . 4.7 tp-100 93.4 -35.85 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.611 -1.306 . . . . 0.0 110.82 129.688 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 7.7 p -56.48 35.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.043 1 C-N-CA 132.628 4.371 . . . . 0.0 115.626 171.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER 67.15 6.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.876 0 C-N-CA 126.698 1.999 . . . . 0.0 112.836 176.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 tt 78.54 105.4 0.07 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.762 2.425 . . . . 0.0 107.631 -168.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.007 0 O-C-N 121.563 -0.711 . . . . 0.0 110.336 174.779 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.9 mt . . . . . 0 N--CA 1.472 0.65 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.45 -41.62 98.63 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -177.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -53.91 -51.05 64.98 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.668 1.187 . . . . 0.0 110.633 172.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.73 -47.18 73.11 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.759 1.223 . . . . 0.0 113.001 -178.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.61 -40.95 94.23 Favored Glycine 0 N--CA 1.473 1.133 0 CA-C-N 120.301 1.41 . . . . 0.0 111.303 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -40.4 92.18 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.15 1.38 . . . . 0.0 110.763 172.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.6 -3.18 4.21 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.725 1.379 . . . . 0.0 114.725 175.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.9 mp -115.29 -35.63 4.59 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.836 1.254 . . . . 0.0 111.836 166.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.91 98.93 11.89 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 128.113 2.565 . . . . 0.0 111.929 -176.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.66 172.13 5.99 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 127.421 2.288 . . . . 0.0 108.971 -169.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -74.27 -119.71 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 124.927 3.751 . . . . 0.0 110.482 172.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 68.4 m -50.15 -28.96 8.19 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.732 2.013 . . . . 0.0 113.227 176.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.94 -24.93 64.33 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 120.093 1.315 . . . . 0.0 113.479 174.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 30.0 t -74.23 -45.0 50.87 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.185 -0.947 . . . . 0.0 109.251 166.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.44 -44.75 76.61 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.498 -0.751 . . . . 0.0 112.726 173.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.2 mm -50.06 -51.24 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 119.984 1.265 . . . . 0.0 110.714 169.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 25.5 mt -59.67 -45.34 92.36 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 117.249 -1.358 . . . . 0.0 112.87 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.5 m -66.55 -28.05 42.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 CA-C-N 121.267 1.849 . . . . 0.0 111.862 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.23 -20.0 45.62 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.057 1.343 . . . . 0.0 112.932 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 77.2 mt -63.02 -49.45 74.6 Favored 'General case' 0 N--CA 1.469 0.489 0 O-C-N 121.075 -1.015 . . . . 0.0 111.017 170.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -46.41 -53.48 10.97 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 129.304 3.042 . . . . 0.0 112.56 -169.476 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -105.72 22.79 14.95 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 127.444 2.298 . . . . 0.0 111.272 177.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.68 -84.7 0.96 Allowed Glycine 0 C--N 1.34 0.758 0 C-N-CA 126.456 1.979 . . . . 0.0 112.633 -178.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 23.7 m 30.71 39.2 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 127.245 2.218 . . . . 0.0 116.557 -171.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 34.6 m -89.52 -76.72 0.41 Allowed 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.236 -0.915 . . . . 0.0 112.718 -177.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -137.51 164.24 42.94 Favored Pre-proline 0 CA--C 1.546 0.813 0 CA-C-O 118.454 -0.784 . . . . 0.0 111.515 -174.28 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -66.3 -20.23 55.54 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.583 2.188 . . . . 0.0 114.379 -167.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.55 8.24 43.57 Favored Glycine 0 CA--C 1.535 1.302 0 CA-C-O 118.388 -1.229 . . . . 0.0 115.028 171.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -28.97 67.25 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 120.189 1.995 . . . . 0.0 113.899 -170.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.74 -18.38 59.52 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.359 0.664 . . . . 0.0 111.723 -177.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.52 -32.96 71.96 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.133 0.973 . . . . 0.0 112.249 174.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.5 -41.49 46.8 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.209 0.604 . . . . 0.0 111.478 176.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -63.63 -40.13 96.1 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 175.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 28.6 mt -92.62 -22.83 19.25 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -174.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.81 8.72 82.54 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 123.961 0.791 . . . . 0.0 112.644 -169.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 86.3 mt -103.73 152.01 22.34 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.305 1.442 . . . . 0.0 110.919 -171.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.5 p -63.94 154.53 33.66 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.543 0.737 . . . . 0.0 111.442 -171.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -56.88 -31.36 64.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 176.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.9 m -69.42 -49.69 52.8 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 123.883 0.873 . . . . 0.0 111.473 172.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -63.32 -37.11 86.0 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 119.133 0.879 . . . . 0.0 113.099 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.3 t -63.64 -50.78 76.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 C-N-CA 123.907 0.883 . . . . 0.0 111.381 169.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.3 m -63.48 -35.65 81.14 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 119.225 0.921 . . . . 0.0 113.212 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 43.8 m-20 -49.21 -37.15 21.93 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 125.726 1.611 . . . . 0.0 111.998 170.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 53.1 m-70 -100.58 2.99 42.32 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 115.505 1.668 . . . . 0.0 115.505 176.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 87.4 mt -92.07 -31.65 15.46 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.807 1.185 . . . . 0.0 111.754 165.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.8 t -45.98 -59.27 2.94 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -170.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 10.6 t -76.45 -21.08 56.37 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.6 tp -61.18 -36.36 79.65 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.613 1.165 . . . . 0.0 110.931 177.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 55.6 mtm180 -79.94 -20.29 46.0 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.147 1.379 . . . . 0.0 112.41 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.8 -41.39 4.7 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.984 1.278 . . . . 0.0 114.227 -177.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 58.5 m -74.8 -3.48 31.99 Favored 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 124.615 1.166 . . . . 0.0 112.305 170.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 92.04 -4.03 77.6 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 126.008 1.766 . . . . 0.0 116.312 169.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 78.4 mt -64.25 -28.99 70.11 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 120.582 2.191 . . . . 0.0 114.77 -173.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -122.12 132.45 70.97 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.406 0 C-N-CA 124.629 1.172 . . . . 0.0 110.455 175.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.8 t -120.66 133.23 68.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 C-N-CA 125.828 1.651 . . . . 0.0 107.971 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.98 144.5 50.47 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 122.953 1.359 . . . . 0.0 112.16 172.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 m -156.98 157.7 35.23 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 126.47 1.908 . . . . 0.0 106.405 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -91.83 135.33 34.0 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.929 1.241 . . . . 0.0 112.458 176.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.69 -11.95 59.83 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.156 0.582 . . . . 0.0 110.773 164.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 126.68 -44.45 1.24 Allowed Glycine 0 C--N 1.346 1.09 0 C-N-CA 126.831 2.158 . . . . 0.0 112.859 169.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.0 mtp-105 -92.6 -22.11 19.67 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.85 2.86 . . . . 0.0 111.502 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -156.66 168.48 27.29 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 127.525 2.33 . . . . 0.0 109.087 -169.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 33.3 m -85.15 158.08 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 123.436 0.694 . . . . 0.0 110.828 168.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -129.57 162.39 28.33 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 128.518 2.727 . . . . 0.0 109.0 172.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -108.06 110.95 22.77 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 168.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -109.88 145.98 35.9 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.901 0.88 . . . . 0.0 110.399 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.6 mt -56.11 145.34 26.21 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 123.17 0.294 . . . . 0.0 110.208 169.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.2 -32.77 73.22 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -167.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -155.82 159.81 39.71 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.639 1.976 . . . . 0.0 111.033 168.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.2 p -45.27 -30.47 1.25 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 128.534 2.733 . . . . 0.0 114.176 168.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -54.41 -45.97 73.07 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 125.01 1.324 . . . . 0.0 112.652 172.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 11.2 mt -74.08 -45.36 49.81 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 118.527 -0.749 . . . . 0.0 109.645 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.97 -31.53 60.81 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.157 0.983 . . . . 0.0 112.459 175.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.5 mtt-85 -72.44 -64.03 1.03 Allowed 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 125.194 1.398 . . . . 0.0 113.379 174.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.56 -12.23 59.9 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 120.429 1.468 . . . . 0.0 112.592 -176.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 60.2 tp -75.78 -53.27 8.76 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.245 1.818 . . . . 0.0 110.155 164.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.22 -41.15 8.13 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 128.183 2.802 . . . . 0.0 117.947 -168.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.47 -22.39 66.86 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.105 1.453 . . . . 0.0 111.274 169.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 35.6 tp 68.94 128.48 0.03 OUTLIER 'General case' 0 C--N 1.344 0.363 0 C-N-CA 129.657 3.183 . . . . 0.0 114.223 165.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 3.6 m -53.19 140.86 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-O 122.566 1.174 . . . . 0.0 109.849 174.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.445 ' C ' ' H ' ' A' ' 93' ' ' VAL . 21.2 mm-40 -74.78 -4.95 40.69 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -162.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 2.4 p -62.31 23.89 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 C-N-CA 127.585 2.354 . . . . 0.0 115.722 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.445 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.7 t 73.85 8.51 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 C-N-CA 126.7 2.0 . . . . 0.0 112.23 167.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 tt 82.56 93.52 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 128.676 2.79 . . . . 0.0 108.609 -170.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.77 160.29 32.87 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.595 0.758 . . . . 0.0 112.616 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 58.4 t -65.29 144.94 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 124.648 1.179 . . . . 0.0 111.914 173.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -66.28 49.53 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 127.22 2.208 . . . . 0.0 114.773 169.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.8 p -122.49 165.39 16.45 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.853 1.661 . . . . 0.0 112.422 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -118.59 138.38 52.61 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 112.906 -1.952 . . . . 0.0 106.366 163.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 70.0 mm-40 -155.53 150.64 20.89 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 127.581 2.352 . . . . 0.0 107.476 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.47 149.33 84.57 Favored 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 122.481 2.12 . . . . 0.0 116.025 -167.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 34.5 t . . . . . 0 CA--C 1.553 1.077 0 C-N-CA 127.29 2.236 . . . . 0.0 108.475 175.015 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 12.1 mt . . . . . 0 N--CA 1.472 0.629 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.02 -48.35 76.66 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.98 0.912 . . . . 0.0 111.901 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 -51.35 -50.06 60.23 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.022 1.329 . . . . 0.0 110.996 177.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -65.34 -52.59 52.82 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.395 1.078 . . . . 0.0 111.955 -175.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.81 -29.73 73.94 Favored Glycine 0 CA--C 1.527 0.823 0 CA-C-O 119.098 -0.834 . . . . 0.0 112.806 -178.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.73 -37.65 73.49 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 118.495 1.148 . . . . 0.0 110.758 174.182 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.31 -29.36 70.7 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 118.174 -0.917 . . . . 0.0 112.749 176.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 mp -93.0 -34.69 13.63 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 175.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -90.77 92.02 8.62 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.723 1.209 . . . . 0.0 110.606 -178.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -169.11 141.12 2.07 Favored Pre-proline 0 N--CA 1.47 0.575 0 C-N-CA 127.487 2.315 . . . . 0.0 107.361 -169.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . 0.432 ' HG2' ' H ' ' B' ' 22' ' ' THR . 58.8 Cg_endo -45.74 -82.07 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.848 1 C-N-CA 125.475 4.117 . . . . 0.0 113.272 -167.647 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.432 ' H ' ' HG2' ' B' ' 21' ' ' PRO . 29.5 m -85.32 -22.39 28.53 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.777 1.231 . . . . 0.0 111.179 -173.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . 0.476 ' HB2' ' HD1' ' B' ' 54' ' ' HIS . 24.5 ttp-105 -68.38 -37.35 80.32 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 120.779 1.627 . . . . 0.0 112.274 176.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 40.2 t -57.52 -46.84 83.34 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 167.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . 0.401 HH12 HD23 ' B' ' 94' ' ' LEU . 0.0 OUTLIER -61.29 -41.06 96.32 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 117.895 -1.05 . . . . 0.0 113.47 178.924 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 5.4 mm -57.47 -45.7 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 CA-C-N 120.903 1.683 . . . . 0.0 110.767 171.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 85.6 mt -60.78 -49.83 75.91 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 118.008 -0.996 . . . . 0.0 111.378 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 m -65.36 -31.04 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 CA-C-N 119.481 1.037 . . . . 0.0 111.951 -177.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.07 -26.67 48.3 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.412 1.085 . . . . 0.0 111.611 178.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 tp -66.49 -40.67 89.4 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 117.647 -1.168 . . . . 0.0 112.712 168.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.49 -53.42 11.26 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.357 2.263 . . . . 0.0 112.168 -179.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -102.76 25.69 8.92 Favored 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 127.903 2.481 . . . . 0.0 111.334 177.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -126.01 -91.43 0.82 Allowed Glycine 0 N--CA 1.465 0.596 0 C-N-CA 127.52 2.486 . . . . 0.0 111.676 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 23.6 m 39.25 30.27 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 126.272 1.829 . . . . 0.0 114.12 -165.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 80.6 m -82.46 -150.83 0.09 Allowed 'General case' 0 N--CA 1.438 -1.059 0 CA-C-O 123.872 1.796 . . . . 0.0 107.617 168.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.64 162.2 75.4 Favored Pre-proline 0 C--N 1.311 -1.068 0 O-C-N 120.801 -1.187 . . . . 0.0 113.846 -166.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -61.1 -15.78 41.67 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.261 2.641 . . . . 0.0 114.9 -177.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.66 0.97 45.59 Favored Glycine 0 CA--C 1.536 1.396 0 CA-C-O 118.663 -1.076 . . . . 0.0 115.356 170.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . 0.568 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -63.5 -31.51 72.7 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.353 1.577 . . . . 0.0 113.783 -169.337 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mt -64.48 -16.98 63.41 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.803 0.841 . . . . 0.0 111.692 -176.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.89 -28.17 69.66 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.279 0.49 . . . . 0.0 112.22 173.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.04 -52.1 9.92 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.352 0.661 . . . . 0.0 111.069 171.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . 0.568 ' CD2' HE22 ' B' ' 39' ' ' GLN . 8.0 m-70 -58.77 -36.33 74.22 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 22.3 mt -98.11 -15.88 19.78 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -175.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.34 6.06 31.83 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-N 119.252 0.933 . . . . 0.0 113.345 -170.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 79.9 mt -102.2 156.6 17.46 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.81 1.244 . . . . 0.0 111.163 -172.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 31.0 p -65.48 154.69 37.82 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.034 0.534 . . . . 0.0 110.939 -170.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -55.34 -27.8 49.53 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.206 0.602 . . . . 0.0 112.181 171.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 4.1 m -70.42 -53.63 15.68 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.056 0.943 . . . . 0.0 111.032 171.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -58.2 -43.65 87.71 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 124.227 1.011 . . . . 0.0 112.232 177.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 7.7 t -60.68 -44.27 96.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 124.847 1.259 . . . . 0.0 111.947 170.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 65.0 m -64.19 -38.44 91.05 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 120.49 1.495 . . . . 0.0 112.968 175.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -57.01 -57.99 10.12 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.32 1.448 . . . . 0.0 110.611 176.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . 0.476 ' HD1' ' HB2' ' B' ' 23' ' ' ARG . 63.4 m-70 -74.39 -18.81 60.61 Favored 'General case' 0 CA--C 1.553 1.068 0 CA-C-O 118.219 -0.896 . . . . 0.0 113.099 -179.4 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 28.7 mt -71.53 -37.92 71.12 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 121.059 1.754 . . . . 0.0 113.009 167.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 18.9 m -53.32 -52.66 58.44 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 120.652 1.569 . . . . 0.0 114.708 -171.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 3.3 t -68.56 -24.44 64.62 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 119.635 1.107 . . . . 0.0 112.924 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.4 tp -70.08 -43.06 71.91 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 127.057 2.143 . . . . 0.0 110.845 177.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 70.4 mtm180 -81.83 -9.67 59.54 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.934 1.694 . . . . 0.0 112.255 176.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.61 -52.68 2.42 Favored Glycine 0 C--N 1.34 0.776 0 C-N-CA 124.583 1.087 . . . . 0.0 111.314 174.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 91.0 m -76.53 0.45 19.92 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 125.635 1.574 . . . . 0.0 115.124 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.22 29.6 49.56 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.414 1.007 . . . . 0.0 114.666 174.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 86.9 mt -89.06 -24.52 22.28 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.251 -1.146 . . . . 0.0 113.007 172.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 5.8 m -136.71 150.39 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.221 1.409 . . . . 0.0 111.618 176.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 60.0 t -141.43 140.81 31.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.182 1.393 . . . . 0.0 110.381 -169.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -77.75 141.42 39.3 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.136 0.969 . . . . 0.0 112.146 175.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.8 m -162.33 167.3 24.03 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.689 1.996 . . . . 0.0 107.262 -173.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -90.91 149.04 22.06 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.885 1.675 . . . . 0.0 113.143 172.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -99.55 11.27 39.61 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 125.687 1.595 . . . . 0.0 110.078 165.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.76 -56.05 4.91 Favored Glycine 0 C--N 1.343 0.926 0 C-N-CA 126.061 1.791 . . . . 0.0 111.196 -176.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 22.5 mtp-105 -69.51 -21.14 63.69 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.845 1.658 . . . . 0.0 113.523 178.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -174.43 173.33 2.98 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.243 2.617 . . . . 0.0 108.788 -167.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 3.4 m -79.13 162.04 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 C-N-CA 123.616 0.766 . . . . 0.0 109.736 166.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 22.1 ptt180 -147.35 164.7 32.45 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.88 1.272 . . . . 0.0 111.694 -178.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -106.11 120.89 42.98 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 165.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.1 153.17 29.95 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.008 1.323 . . . . 0.0 110.947 177.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 77.9 mt -59.06 148.81 29.64 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.477 0.58 . . . . 0.0 110.02 169.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.52 -9.57 58.71 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 115.91 1.819 . . . . 0.0 115.91 -169.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -177.32 157.91 1.39 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.897 2.879 . . . . 0.0 110.865 168.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 98.0 p -44.78 -32.51 1.57 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 128.517 2.727 . . . . 0.0 114.065 166.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -54.96 -47.05 75.04 Favored 'General case' 0 C--N 1.343 0.288 0 C-N-CA 124.361 1.064 . . . . 0.0 112.202 171.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 16.4 mt -70.83 -44.3 66.78 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 118.402 -0.809 . . . . 0.0 109.135 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.9 -35.24 57.84 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.557 0.743 . . . . 0.0 112.501 177.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 3.5 mtt-85 -71.74 -63.26 1.16 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.25 1.02 . . . . 0.0 113.624 174.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.63 -19.07 65.48 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.474 1.488 . . . . 0.0 112.852 -175.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 56.0 tp -72.86 -49.37 30.5 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.177 1.791 . . . . 0.0 111.005 167.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -82.24 -40.74 9.88 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 128.221 2.82 . . . . 0.0 116.758 -168.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -64.51 -23.48 67.29 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.429 1.614 . . . . 0.0 111.48 169.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 37.2 tp 70.56 132.03 0.03 OUTLIER 'General case' 0 C--N 1.344 0.354 0 C-N-CA 129.719 3.208 . . . . 0.0 113.675 167.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 3.2 m -53.38 138.12 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-O 122.61 1.195 . . . . 0.0 110.173 176.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.426 ' C ' ' H ' ' B' ' 93' ' ' VAL . 12.2 mm-40 -69.72 -10.46 58.39 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 -163.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 2.6 p -62.79 24.35 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 127.244 2.218 . . . . 0.0 115.632 -177.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . 0.426 ' H ' ' C ' ' B' ' 91' ' ' GLN . 1.7 t 71.23 11.47 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 C-N-CA 125.073 1.349 . . . . 0.0 111.622 168.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . 0.401 HD23 HH12 ' B' ' 25' ' ' ARG . 1.8 tt 77.99 99.89 0.07 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 128.859 2.863 . . . . 0.0 109.342 -170.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.804 0 C-N-CA 123.785 0.834 . . . . 0.0 112.732 179.493 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 88.7 mt . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -45.89 -30.38 1.71 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.229 1.812 . . . . 0.0 114.824 174.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.5 mmt85 -68.09 -36.11 79.25 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 116.253 -1.832 . . . . 0.0 113.428 174.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -62.27 -48.29 80.59 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 121.807 2.094 . . . . 0.0 111.043 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.27 -40.03 98.55 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 111.728 -0.549 . . . . 0.0 111.728 176.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.2 ttt180 -62.55 -33.93 75.91 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.737 0.815 . . . . 0.0 111.413 170.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.05 -19.31 64.87 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.29 1.405 . . . . 0.0 112.302 175.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 mp -92.21 -28.07 17.27 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.417 1.008 . . . . 0.0 112.964 169.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -100.53 -12.57 19.18 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 -172.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -56.77 140.55 75.59 Favored Pre-proline 0 CA--C 1.549 0.93 0 CA-C-N 119.922 1.237 . . . . 0.0 107.989 168.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -52.83 -77.2 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.432 1 C-N-CA 126.36 4.707 . . . . 0.0 112.076 -167.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.419 ' HB ' ' CD2' ' A' ' 54' ' ' HIS . 21.9 m -58.84 -26.35 64.1 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-O 117.513 -1.232 . . . . 0.0 111.775 177.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.6 mtt85 -65.96 -44.34 85.25 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.693 1.588 . . . . 0.0 112.604 177.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.7 t -54.1 -51.16 65.05 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.173 1.351 . . . . 0.0 110.347 171.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.4 ttt85 -62.67 -40.7 97.9 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.921 -178.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.0 mm -53.14 -56.88 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 125.413 1.485 . . . . 0.0 109.22 168.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.33 -45.38 93.46 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.886 -0.578 . . . . 0.0 111.965 -172.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.1 p -69.85 -24.65 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 CA-C-N 119.333 0.97 . . . . 0.0 113.41 176.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.48 -8.56 59.74 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 121.153 -0.967 . . . . 0.0 113.441 170.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.4 mt -94.66 -9.53 34.64 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 172.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.37 -13.14 61.4 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 128.724 2.81 . . . . 0.0 111.902 165.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -141.08 -46.8 0.39 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.773 2.029 . . . . 0.0 113.963 -169.064 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.98 -66.17 2.31 Favored Glycine 0 C--N 1.339 0.746 0 C-N-CA 125.254 1.407 . . . . 0.0 112.955 -167.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 34.9 m 41.15 20.8 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 128.353 2.661 . . . . 0.0 117.418 171.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 67.0 m -85.28 -63.4 1.33 Allowed 'General case' 0 C--O 1.223 -0.31 0 O-C-N 120.486 -1.384 . . . . 0.0 111.899 -178.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -151.49 159.88 32.68 Favored Pre-proline 0 N--CA 1.473 0.723 0 N-CA-C 115.031 1.493 . . . . 0.0 115.031 -172.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -57.82 119.99 7.6 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.091 1.861 . . . . 0.0 107.56 168.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.57 0.17 84.48 Favored Glycine 0 CA--C 1.533 1.167 0 CA-C-O 117.297 -1.835 . . . . 0.0 115.483 -173.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -37.77 85.91 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 121.209 2.505 . . . . 0.0 109.971 168.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.9 mt -55.42 -27.29 46.91 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 125.962 1.705 . . . . 0.0 110.648 176.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.87 -30.3 68.9 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.301 -0.874 . . . . 0.0 113.071 -174.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.55 -53.68 7.73 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.661 0.784 . . . . 0.0 111.172 170.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -50.6 -35.39 30.03 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.2 mt -101.08 -13.87 18.02 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.86 1.264 . . . . 0.0 113.389 -173.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.15 13.05 66.61 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.337 0.97 . . . . 0.0 113.724 -173.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 53.9 mt -123.9 141.28 52.17 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.577 1.151 . . . . 0.0 110.114 -168.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.8 p -59.2 157.57 10.37 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -168.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -52.95 -28.63 24.51 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.909 0.884 . . . . 0.0 112.279 171.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.5 t -79.12 -36.68 40.23 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.06 -1.025 . . . . 0.0 112.832 175.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -68.33 -38.67 81.75 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.335 0.971 . . . . 0.0 111.888 171.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.8 t -57.12 -44.84 83.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.518 174.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.79 -39.17 93.16 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-N 120.483 1.492 . . . . 0.0 114.081 173.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -56.18 -32.96 64.84 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.214 1.005 . . . . 0.0 112.612 176.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.419 ' CD2' ' HB ' ' A' ' 22' ' ' THR . 19.2 m-70 -94.56 -19.64 20.32 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 115.146 1.535 . . . . 0.0 115.146 172.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 47.1 mt -70.47 -28.67 65.18 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 121.159 1.8 . . . . 0.0 113.948 169.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 p -52.0 -59.42 4.37 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 -169.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 2.9 t -64.95 -39.39 93.42 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 118.557 0.617 . . . . 0.0 110.901 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.2 tp -51.76 -32.44 30.83 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.499 1.92 . . . . 0.0 112.266 -178.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.2 mtm105 -72.63 -45.67 57.85 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 118.824 0.738 . . . . 0.0 112.915 174.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.34 -28.08 62.51 Favored Glycine 0 N--CA 1.474 1.203 0 C-N-CA 125.348 1.452 . . . . 0.0 112.433 -176.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.1 m -66.93 -5.57 13.14 Favored 'General case' 0 CA--C 1.566 1.568 0 C-N-CA 127.414 2.285 . . . . 0.0 111.115 165.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.02 -24.92 1.91 Allowed Glycine 0 C--N 1.343 0.924 0 C-N-CA 128.711 3.053 . . . . 0.0 113.809 -172.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 69.9 mt -43.27 -39.55 3.08 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 128.519 2.728 . . . . 0.0 115.549 -170.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -115.4 133.68 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 124.922 1.289 . . . . 0.0 113.231 173.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 71.7 t -124.59 136.99 58.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 126.369 1.868 . . . . 0.0 109.549 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.33 141.4 30.94 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.797 1.239 . . . . 0.0 111.095 169.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.0 m -164.0 163.56 23.36 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.947 1.699 . . . . 0.0 107.244 -169.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -84.34 148.43 26.65 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.222 1.374 . . . . 0.0 114.177 174.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -91.76 -18.54 23.75 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.453 0.701 . . . . 0.0 110.24 163.609 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 128.8 -37.81 2.16 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 127.188 2.328 . . . . 0.0 113.252 173.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 23.1 ttm180 -93.97 -34.49 13.04 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 128.646 2.778 . . . . 0.0 111.841 170.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -144.43 164.07 31.93 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.745 2.018 . . . . 0.0 110.166 -170.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 32.9 m -84.56 150.3 4.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 CA-C-O 121.585 0.707 . . . . 0.0 111.298 168.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -135.63 162.27 33.18 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 126.872 2.069 . . . . 0.0 109.304 -171.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -97.57 153.74 17.98 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 164.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -158.83 161.52 36.91 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.164 1.386 . . . . 0.0 109.366 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 57.3 mt -72.35 152.76 41.87 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.363 0.665 . . . . 0.0 111.479 175.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.09 -40.21 95.07 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 115.13 1.53 . . . . 0.0 115.13 -173.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -162.57 161.19 26.7 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 125.411 1.484 . . . . 0.0 110.553 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.58 -37.69 0.14 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 129.515 3.126 . . . . 0.0 112.766 165.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -56.23 -52.11 65.63 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 125.563 1.545 . . . . 0.0 113.398 178.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.9 mt -70.5 -45.7 65.12 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.182 0.901 . . . . 0.0 109.23 -178.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -51.79 -42.11 62.18 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.453 1.101 . . . . 0.0 111.059 177.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 -65.59 -59.74 3.64 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.689 1.196 . . . . 0.0 113.321 171.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.28 -24.46 55.04 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 119.551 1.069 . . . . 0.0 113.329 -178.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.22 -41.5 16.88 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.077 -1.014 . . . . 0.0 112.937 169.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.01 -55.46 4.83 Favored Glycine 0 N--CA 1.471 1.014 0 C-N-CA 126.485 1.993 . . . . 0.0 114.259 -173.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -72.1 -10.34 59.65 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 119.196 1.498 . . . . 0.0 110.895 167.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.457 ' C ' ' H ' ' A' ' 91' ' ' GLN . 64.5 tp 74.88 138.9 0.06 Allowed 'General case' 0 C--N 1.345 0.409 0 C-N-CA 129.568 3.147 . . . . 0.0 110.554 169.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 32.6 m -66.74 21.05 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 124.923 1.289 . . . . 0.0 113.584 176.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.457 ' H ' ' C ' ' A' ' 89' ' ' LEU . 48.0 mm-40 78.14 -12.3 1.09 Allowed 'General case' 0 N--CA 1.443 -0.782 0 O-C-N 120.238 -1.539 . . . . 0.0 112.058 161.144 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.6 p -65.84 34.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 128.881 2.872 . . . . 0.0 115.24 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . 0.271 34.8 m 51.27 15.49 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 130.028 3.331 . . . . 0.0 115.832 175.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 38.7 tp 107.25 101.88 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.659 1 C-N-CA 131.759 4.024 . . . . 0.0 110.501 178.116 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.36 76.49 0.26 Allowed 'General case' 0 CA--C 1.553 1.074 0 O-C-N 121.262 -0.899 . . . . 0.0 111.89 168.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.92 162.02 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 C-N-CA 126.818 2.047 . . . . 0.0 113.178 175.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -63.6 -1.37 1.23 Allowed 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 126.914 2.086 . . . . 0.0 115.008 173.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.2 p -62.61 111.44 2.07 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 126.178 1.791 . . . . 0.0 111.323 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -66.21 140.75 58.19 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 171.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -157.47 127.06 3.2 Favored Pre-proline 0 N--CA 1.443 -0.811 0 N-CA-C 106.125 -1.805 . . . . 0.0 106.125 174.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . 0.27 59.5 Cg_endo -73.42 117.13 4.95 Favored 'Trans proline' 0 C--N 1.352 0.713 0 CA-C-N 121.399 1.535 . . . . 0.0 114.149 -166.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 50.5 t . . . . . 0 CA--C 1.538 0.495 0 C-N-CA 130.221 3.408 . . . . 0.0 106.946 -160.567 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 72.2 mt . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -39.22 -33.86 0.16 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.302 2.241 . . . . 0.0 114.485 172.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 1.8 mmm-85 -63.09 -31.21 72.29 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.795 2.038 . . . . 0.0 114.482 178.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -60.93 -51.88 67.38 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 120.41 1.459 . . . . 0.0 111.033 173.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.61 -35.52 74.61 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.106 -0.798 . . . . 0.0 111.106 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 52.7 ttt180 -64.55 -31.84 73.23 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 123.76 0.824 . . . . 0.0 111.057 171.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.28 -27.51 65.48 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 120.714 1.597 . . . . 0.0 111.99 174.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 mp -87.95 -7.57 56.93 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 172.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -125.2 -14.55 6.49 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 117.235 2.309 . . . . 0.0 117.235 -175.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -54.93 143.8 50.48 Favored Pre-proline 0 CA--C 1.546 0.821 0 CA-C-N 120.671 1.578 . . . . 0.0 108.582 170.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -43.64 -80.69 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 1 C-N-CA 127.453 5.436 . . . . 0.0 113.992 -166.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.513 ' HB ' ' CD2' ' B' ' 54' ' ' HIS . 7.3 m -67.74 -14.23 62.78 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.664 -0.647 . . . . 0.0 111.553 176.102 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.68 -47.06 42.56 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.768 1.167 . . . . 0.0 112.712 -171.536 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 54.1 t -51.83 -47.33 64.41 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 167.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 13.9 ttt85 -61.22 -42.56 98.83 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 118.059 -0.972 . . . . 0.0 112.862 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -56.62 -47.78 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 CA-C-N 121.176 1.807 . . . . 0.0 111.176 171.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 40.7 mt -66.94 -50.68 61.59 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 118.919 -0.562 . . . . 0.0 111.397 -178.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 p -70.14 -25.38 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 CA-C-N 119.163 0.892 . . . . 0.0 111.265 -177.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.33 -43.87 63.47 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-O 117.566 -1.207 . . . . 0.0 110.414 167.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 9.7 mt -60.08 -27.09 66.71 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.539 1.518 . . . . 0.0 115.042 -178.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -44.71 -28.84 0.67 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 126.717 2.007 . . . . 0.0 111.925 168.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -120.08 -31.27 4.47 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 129.556 3.142 . . . . 0.0 113.784 169.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.79 16.43 4.23 Favored Glycine 0 N--CA 1.468 0.793 0 C-N-CA 130.019 3.676 . . . . 0.0 115.999 -163.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 20.0 m -58.49 30.39 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 127.609 2.364 . . . . 0.0 117.361 170.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 71.1 m -87.64 -69.06 0.71 Allowed 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.793 -1.192 . . . . 0.0 113.442 178.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -159.54 158.3 27.51 Favored Pre-proline 0 N--CA 1.475 0.781 0 CA-C-N 120.266 1.394 . . . . 0.0 114.341 -172.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -57.07 115.31 2.41 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 122.451 2.101 . . . . 0.0 109.28 170.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 93.66 1.45 65.92 Favored Glycine 0 CA--C 1.532 1.143 0 CA-C-O 117.348 -1.807 . . . . 0.0 115.313 -174.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . 0.494 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -63.56 -39.5 94.57 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 120.566 2.183 . . . . 0.0 110.007 168.91 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 9.9 mt -56.52 -24.29 45.51 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 124.69 1.196 . . . . 0.0 110.986 -177.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.8 -31.62 62.8 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.289 -0.882 . . . . 0.0 112.219 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.45 -55.97 5.05 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.96 0.904 . . . . 0.0 111.198 171.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . 0.494 ' CD2' HE22 ' B' ' 39' ' ' GLN . 3.2 m-70 -54.51 -29.27 49.95 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 19.5 mt -105.34 -14.58 15.29 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.197 1.399 . . . . 0.0 112.887 -175.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 65.51 14.17 59.68 Favored Glycine 0 CA--C 1.53 0.978 0 C-N-CA 124.323 0.963 . . . . 0.0 113.2 -173.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 39.9 mt -120.3 158.66 26.59 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.184 0.992 . . . . 0.0 112.214 -168.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 20.4 p -66.03 154.65 38.93 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.468 0.651 . . . . 0.0 111.151 -169.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -60.99 -19.76 61.62 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.701 -0.624 . . . . 0.0 111.806 173.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 13.6 m -72.27 -53.55 12.15 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.841 1.256 . . . . 0.0 110.931 168.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -59.22 -37.23 77.0 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.616 1.166 . . . . 0.0 112.024 176.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 10.5 t -63.79 -43.3 97.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 124.293 1.037 . . . . 0.0 112.348 169.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 18.1 m -61.02 -45.12 96.1 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 120.462 1.483 . . . . 0.0 112.069 173.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 -57.41 -28.11 62.97 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 127.31 2.244 . . . . 0.0 113.089 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . 0.513 ' CD2' ' HB ' ' B' ' 22' ' ' THR . 35.3 m-70 -99.29 -20.12 16.72 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 173.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 50.0 mt -77.71 -22.52 50.3 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 117.039 -1.458 . . . . 0.0 114.875 170.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -44.97 -69.89 0.12 Allowed 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 121.987 2.176 . . . . 0.0 113.888 175.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.5 t -63.9 -42.97 97.3 Favored 'General case' 0 C--O 1.215 -0.76 0 C-N-CA 124.384 1.074 . . . . 0.0 109.916 -178.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.04 -39.63 28.08 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.994 1.318 . . . . 0.0 113.531 176.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 49.1 mtm180 -87.36 -19.91 27.47 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.57 -31.46 10.32 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 125.323 1.439 . . . . 0.0 114.902 175.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 85.1 m -67.27 -10.77 54.04 Favored 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 128.365 2.666 . . . . 0.0 112.501 169.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.31 19.16 78.6 Favored Glycine 0 CA--C 1.529 0.952 0 C-N-CA 124.685 1.136 . . . . 0.0 113.54 -174.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 83.0 mt -78.3 -30.71 48.49 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.401 1.1 . . . . 0.0 112.704 175.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 19.6 t -133.5 137.0 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 125.485 1.514 . . . . 0.0 111.259 -170.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 42.4 t -133.97 144.84 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.034 1.334 . . . . 0.0 110.825 -169.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -86.81 137.85 32.07 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.124 1.37 . . . . 0.0 111.38 173.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 18.2 m -161.45 170.04 20.75 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.891 1.676 . . . . 0.0 107.652 -171.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -91.3 145.49 24.61 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 120.419 1.463 . . . . 0.0 113.434 171.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.262 0.0 OUTLIER -88.16 -16.81 32.38 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.492 0.717 . . . . 0.0 110.928 164.667 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 128.28 -35.55 2.68 Favored Glycine 0 CA--C 1.535 1.308 0 C-N-CA 127.407 2.432 . . . . 0.0 113.201 172.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 13.1 ttm180 -96.36 -35.75 11.09 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 129.07 2.948 . . . . 0.0 111.62 170.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -143.62 163.23 33.81 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 127.171 2.188 . . . . 0.0 109.827 -169.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 33.7 m -82.81 153.2 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-O 121.309 0.576 . . . . 0.0 111.652 169.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -136.35 159.02 43.03 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 127.071 2.148 . . . . 0.0 109.845 -171.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -99.54 147.37 25.4 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 162.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -147.42 156.12 42.58 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 123.679 0.792 . . . . 0.0 109.133 178.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 40.5 mt -60.58 154.13 21.87 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 168.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.59 -26.81 68.01 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -171.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -174.79 164.43 3.53 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.108 2.163 . . . . 0.0 110.673 169.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.2 m -35.59 -34.78 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 129.749 3.22 . . . . 0.0 113.213 165.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -61.88 -43.32 99.08 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.03 1.332 . . . . 0.0 111.767 -179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 11.6 mt -74.31 -44.3 53.16 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.985 1.266 . . . . 0.0 110.045 172.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.08 -28.11 16.35 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.661 1.184 . . . . 0.0 112.313 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 39.5 mtt180 -72.23 -63.32 1.17 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.013 1.725 . . . . 0.0 114.682 170.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.33 -13.93 9.89 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 120.129 -1.607 . . . . 0.0 113.303 175.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 5.3 tp -86.09 -44.34 12.34 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 127.5 2.32 . . . . 0.0 112.824 168.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -83.83 -58.26 2.28 Favored Glycine 0 N--CA 1.476 1.305 0 C-N-CA 127.428 2.442 . . . . 0.0 114.428 -174.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 9.4 pm0 -67.89 -14.73 63.19 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 119.882 1.841 . . . . 0.0 110.232 165.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . 0.556 ' C ' ' H ' ' B' ' 91' ' ' GLN . 43.3 tp 76.55 160.0 0.22 Allowed 'General case' 0 C--N 1.346 0.437 0 C-N-CA 129.63 3.172 . . . . 0.0 110.558 169.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 28.9 m -66.79 18.8 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 120.856 -1.152 . . . . 0.0 112.401 168.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.556 ' H ' ' C ' ' B' ' 89' ' ' LEU . 33.3 mm-40 72.48 -0.91 3.13 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.815 1.246 . . . . 0.0 113.268 166.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.9 p -60.57 34.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 130.107 3.363 . . . . 0.0 115.455 173.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.263 30.0 m 52.03 14.6 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 130.266 3.426 . . . . 0.0 116.201 175.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 41.9 tp 109.93 101.92 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 130.45 3.5 . . . . 0.0 109.697 -174.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.932 0 C-N-CA 124.675 1.19 . . . . 0.0 111.592 168.796 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.0 mp . . . . . 0 CA--C 1.542 0.672 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.74 -50.07 33.47 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.421 -0.799 . . . . 0.0 111.139 169.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.4 mmt85 -60.13 -35.55 75.52 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.236 -1.54 . . . . 0.0 112.566 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -56.27 -56.92 15.03 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 126.55 1.94 . . . . 0.0 110.72 178.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -75.02 -30.76 58.7 Favored Glycine 0 CA--C 1.531 1.084 0 CA-C-N 119.28 0.946 . . . . 0.0 112.54 -178.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -61.62 -28.84 69.65 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 118.501 1.151 . . . . 0.0 112.027 169.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.465 ' CB ' HH21 ' A' ' 23' ' ' ARG . . . -85.77 -21.48 28.17 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.285 2.234 . . . . 0.0 114.356 173.182 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.9 tp -78.45 -28.84 46.68 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.101 1.76 . . . . 0.0 110.005 177.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -108.04 62.81 0.61 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.599 1.16 . . . . 0.0 112.197 168.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -125.46 141.58 39.34 Favored Pre-proline 0 CA--C 1.557 1.232 0 C-N-CA 127.686 2.394 . . . . 0.0 107.047 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -45.84 -90.46 0.0 OUTLIER 'Trans proline' 0 C--N 1.356 0.944 1 C-N-CA 127.634 5.556 . . . . 0.0 117.073 -163.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.507 ' HG1' ' CD2' ' A' ' 54' ' ' HIS . 6.2 m -46.96 -27.43 1.27 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.437 1.895 . . . . 0.0 111.987 169.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.503 ' HD3' ' HD1' ' A' ' 54' ' ' HIS . 1.8 ttp180 -73.3 -45.89 52.82 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 126.012 1.725 . . . . 0.0 113.644 -168.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.9 t -54.35 -48.82 71.01 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 120.229 1.377 . . . . 0.0 110.324 168.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 -52.45 -52.38 54.42 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-O 117.945 -1.026 . . . . 0.0 112.127 173.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.3 mt -50.52 -50.17 22.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 CA-C-N 121.03 1.741 . . . . 0.0 111.767 172.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 93.6 mt -69.55 -37.58 77.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 118.28 -0.866 . . . . 0.0 112.608 -170.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.3 p -74.74 -21.34 17.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 CA-C-N 119.19 0.904 . . . . 0.0 111.985 174.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.9 -44.29 27.53 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 118.077 -0.963 . . . . 0.0 110.764 168.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.4 mt -62.18 -18.96 62.52 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -176.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.6 mt -53.29 -22.11 6.57 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 124.528 1.131 . . . . 0.0 111.665 166.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -129.17 -29.11 2.29 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 128.815 2.846 . . . . 0.0 113.564 169.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.25 11.21 2.98 Favored Glycine 0 N--CA 1.473 1.156 0 C-N-CA 128.941 3.162 . . . . 0.0 116.057 -165.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 27.7 m -66.46 39.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 C-N-CA 128.21 2.604 . . . . 0.0 115.721 172.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 5.1 t -100.81 -60.42 1.53 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.416 1.086 . . . . 0.0 113.033 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 53.6 p90 -158.21 154.97 25.09 Favored Pre-proline 0 N--CA 1.478 0.927 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -178.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -61.01 116.88 3.65 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.525 2.15 . . . . 0.0 109.538 175.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.41 -12.19 59.94 Favored Glycine 0 C--O 1.22 -0.772 0 CA-C-O 115.986 -2.563 . . . . 0.0 114.75 -175.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -29.26 68.96 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-N 120.629 2.214 . . . . 0.0 111.838 175.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 17.9 mt -63.13 -18.97 64.02 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.311 0.644 . . . . 0.0 110.775 177.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.52 -42.37 96.31 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 119.444 1.02 . . . . 0.0 110.472 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.45 -51.16 66.86 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.517 1.053 . . . . 0.0 112.348 173.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -57.27 -36.69 71.32 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.6 mt -101.82 -14.49 17.26 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -170.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.08 10.97 36.24 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 114.676 0.63 . . . . 0.0 114.676 -172.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.0 mp -101.16 141.52 33.92 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 173.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.3 t -59.1 147.8 33.63 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 121.909 -0.495 . . . . 0.0 111.277 -176.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -57.09 -27.99 62.23 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.253 1.021 . . . . 0.0 113.439 -171.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.8 p -69.41 -55.44 10.32 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.261 -0.9 . . . . 0.0 112.767 170.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -54.57 -49.06 71.26 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.08 0.952 . . . . 0.0 112.12 177.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 84.9 t -59.56 -40.69 82.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 O-C-N 121.803 -0.561 . . . . 0.0 111.065 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 46.5 m -69.99 -27.24 64.54 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 178.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 32.0 t-20 -58.93 -45.36 90.57 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.019 0.827 . . . . 0.0 110.94 170.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.507 ' CD2' ' HG1' ' A' ' 22' ' ' THR . 40.0 m-70 -71.65 -22.65 61.66 Favored 'General case' 0 CA--C 1.551 1.019 0 O-C-N 120.146 -1.596 . . . . 0.0 114.268 170.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 73.6 mt -70.55 -25.35 63.05 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 120.62 1.555 . . . . 0.0 111.697 168.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.14 -42.1 63.07 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.121 0.873 . . . . 0.0 111.736 170.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 2.4 t -83.68 -39.45 20.18 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 119.483 1.038 . . . . 0.0 111.886 -178.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 tp -52.31 -42.33 63.71 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.609 1.564 . . . . 0.0 113.408 175.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.8 mtm180 -85.19 -1.07 56.49 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.493 1.117 . . . . 0.0 112.025 -179.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -109.17 -41.84 1.35 Allowed Glycine 0 N--CA 1.477 1.413 0 C-N-CA 126.159 1.838 . . . . 0.0 113.201 175.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.7 m -59.49 -16.62 25.45 Favored 'General case' 0 CA--C 1.561 1.394 0 C-N-CA 127.515 2.326 . . . . 0.0 112.785 169.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.98 20.0 74.02 Favored Glycine 0 C--N 1.343 0.953 0 C-N-CA 125.714 1.626 . . . . 0.0 113.987 -176.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.6 mt -71.12 -23.98 62.19 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.303 1.441 . . . . 0.0 113.13 171.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 13.7 t -142.6 144.97 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -166.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 9.6 t -133.42 141.63 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 C-N-CA 125.276 1.43 . . . . 0.0 109.479 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -96.67 148.52 22.78 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.377 1.071 . . . . 0.0 112.526 175.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.9 p -133.91 144.85 49.11 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.634 0.774 . . . . 0.0 109.674 172.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -94.96 107.97 20.02 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 125.376 1.47 . . . . 0.0 108.978 169.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.78 14.24 0.22 Allowed 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -176.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.2 -17.48 26.61 Favored Glycine 0 CA--C 1.529 0.933 0 C-N-CA 126.008 1.766 . . . . 0.0 113.189 -177.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 20.3 ttp-105 -158.17 -48.15 0.06 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.658 1.183 . . . . 0.0 112.103 -169.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -93.75 173.76 7.52 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.096 1.758 . . . . 0.0 110.317 171.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 20.6 m -122.77 149.28 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 125.014 1.325 . . . . 0.0 108.664 167.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.5 ptt85 -138.14 177.12 8.12 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.877 1.671 . . . . 0.0 109.372 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -117.03 174.69 5.96 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.035 0.934 . . . . 0.0 110.893 168.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -168.87 145.97 3.7 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 126.385 1.874 . . . . 0.0 109.859 177.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 91.0 mt -56.23 148.76 17.61 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 123.505 0.503 . . . . 0.0 110.589 169.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.15 -28.5 60.16 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.875 1.806 . . . . 0.0 115.875 -168.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -156.16 160.12 39.6 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 124.195 1.95 . . . . 0.0 112.988 170.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -40.32 -28.85 0.07 Allowed 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 130.49 3.516 . . . . 0.0 113.831 165.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -60.15 -62.16 2.07 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 126.484 1.914 . . . . 0.0 110.653 171.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.8 mt -62.31 -47.65 83.34 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -176.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.69 -48.06 66.82 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.7 ptp180 -75.55 -37.2 60.17 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -175.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -76.7 -39.41 52.07 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.455 1.025 . . . . 0.0 110.69 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.99 -32.32 70.74 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.216 -0.928 . . . . 0.0 110.163 169.177 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.86 -18.56 76.21 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 125.712 1.625 . . . . 0.0 115.401 171.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.38 -20.36 63.83 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 120.04 1.92 . . . . 0.0 110.259 166.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 13.5 tp 66.91 61.86 0.5 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 128.101 2.56 . . . . 0.0 109.877 -169.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 61.9 t -25.88 128.17 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 128.035 2.534 . . . . 0.0 114.557 -172.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.444 ' C ' ' H ' ' A' ' 93' ' ' VAL . 0.8 OUTLIER -94.3 6.86 47.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 112.758 -2.019 . . . . 0.0 111.269 -109.688 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.8 p -63.71 34.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 130.239 3.416 . . . . 0.0 113.382 169.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.444 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.5 t 69.63 18.18 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.983 0 C-N-CA 125.534 1.534 . . . . 0.0 112.004 168.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 5.4 tt 103.0 102.93 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 131.342 3.857 . . . . 0.0 108.749 -173.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.46 76.22 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 115.34 1.608 . . . . 0.0 115.34 176.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 99.2 t -58.73 153.51 3.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 127.419 2.288 . . . . 0.0 111.241 169.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -59.48 -0.24 0.15 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 127.752 2.421 . . . . 0.0 116.813 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 31.3 p -49.01 101.53 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.214 1.406 . . . . 0.0 113.394 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -99.21 141.08 32.44 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 164.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -138.34 141.8 32.86 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 -169.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -54.85 -29.44 63.22 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 123.325 2.684 . . . . 0.0 114.779 -171.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 10.4 t . . . . . 0 CA--C 1.536 0.404 0 C-N-CA 126.829 2.052 . . . . 0.0 112.189 169.173 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 5.0 mp . . . . . 0 CA--C 1.545 0.751 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -81.67 -43.96 17.8 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.945 0.793 . . . . 0.0 110.736 166.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 12.0 mmt85 -62.32 -32.06 72.77 Favored 'General case' 0 N--CA 1.473 0.7 0 O-C-N 120.394 -1.441 . . . . 0.0 112.394 178.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -46.04 -63.9 0.87 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 127.896 2.478 . . . . 0.0 110.725 170.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.76 -31.33 62.6 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 119.758 -1.211 . . . . 0.0 112.491 -174.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -66.79 -27.72 67.81 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.448 1.099 . . . . 0.0 112.285 174.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -86.43 -21.58 27.02 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 127.556 2.342 . . . . 0.0 113.727 175.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.0 mp -84.37 -45.19 13.0 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.045 0.838 . . . . 0.0 109.901 173.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.91 49.16 1.32 Allowed 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.204 -0.935 . . . . 0.0 112.162 169.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -117.75 134.57 23.22 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 128.587 2.755 . . . . 0.0 106.567 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -46.3 -90.13 0.0 OUTLIER 'Trans proline' 0 CA--C 1.537 0.672 1 C-N-CA 126.545 4.83 . . . . 0.0 115.682 -164.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.409 ' HB ' ' CD2' ' B' ' 54' ' ' HIS . 91.3 m -54.63 -26.79 35.1 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.764 1.226 . . . . 0.0 111.251 174.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . 0.549 ' HD3' ' HD1' ' B' ' 54' ' ' HIS . 6.6 mtp180 -74.13 -36.7 64.2 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 117.062 -1.447 . . . . 0.0 114.355 -171.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 41.4 t -58.04 -51.15 70.85 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.521 1.509 . . . . 0.0 109.364 168.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 38.8 mtp180 -51.89 -45.37 64.15 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 124.854 1.261 . . . . 0.0 111.825 173.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 7.0 mt -52.8 -67.05 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 CA-C-N 120.167 1.349 . . . . 0.0 110.099 169.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 87.4 mt -53.68 -37.99 63.75 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -168.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 7.2 p -72.29 -24.28 22.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-N 119.484 1.038 . . . . 0.0 113.75 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -95.35 -18.58 20.64 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.017 1.327 . . . . 0.0 113.461 173.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.04 -50.3 71.19 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.901 1.681 . . . . 0.0 109.102 175.046 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -39.11 -53.12 1.86 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 130.514 3.526 . . . . 0.0 113.639 -174.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -101.55 -15.48 17.09 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.556 1.942 . . . . 0.0 112.619 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.62 -65.31 2.17 Favored Glycine 0 C--N 1.341 0.808 0 C-N-CA 125.501 1.524 . . . . 0.0 112.005 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 29.6 m 27.21 40.14 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 N-CA-C 116.664 2.098 . . . . 0.0 116.664 -173.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -92.11 -73.71 0.54 Allowed 'General case' 0 N--CA 1.465 0.302 0 O-C-N 121.394 -0.816 . . . . 0.0 112.365 -167.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . 0.405 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 34.7 p90 -151.18 163.53 23.33 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 124.168 0.987 . . . . 0.0 113.441 -178.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -51.76 117.2 3.3 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 122.507 2.138 . . . . 0.0 110.953 170.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.06 -4.57 84.72 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-O 118.383 -1.232 . . . . 0.0 115.16 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . 0.405 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 0.0 OUTLIER -56.29 -18.53 10.91 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 120.371 2.085 . . . . 0.0 114.848 175.966 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.8 mt -75.46 -15.97 60.37 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 124.325 1.05 . . . . 0.0 110.894 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.76 -39.16 87.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 119.398 0.999 . . . . 0.0 112.698 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.77 -42.06 77.96 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.803 170.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -62.19 -36.79 82.98 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 176.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 27.0 mt -101.69 -17.37 16.32 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 -169.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.1 13.15 47.4 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-O 121.961 0.756 . . . . 0.0 113.844 -169.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mp -99.44 131.14 45.65 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 169.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 11.8 t -56.38 148.83 18.01 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -176.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -55.19 -23.87 24.08 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.482 1.513 . . . . 0.0 114.382 -175.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 60.7 p -72.98 -53.17 11.87 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.292 1.405 . . . . 0.0 112.339 169.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 63.7 t-20 -57.52 -47.19 82.64 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.357 1.063 . . . . 0.0 111.916 -178.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 27.4 t -63.11 -36.59 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 O-C-N 121.203 -0.935 . . . . 0.0 111.54 177.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 55.3 m -71.87 -29.72 64.67 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -55.48 -45.85 76.92 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 122.089 0.947 . . . . 0.0 110.54 170.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . 0.549 ' HD1' ' HD3' ' B' ' 23' ' ' ARG . 18.6 m-70 -71.73 -23.16 61.57 Favored 'General case' 0 CA--C 1.556 1.199 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 171.069 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 65.9 mt -74.85 -18.71 60.4 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-N 121.192 1.814 . . . . 0.0 112.175 168.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.36 -50.17 70.38 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.21 0.914 . . . . 0.0 110.581 172.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 6.1 t -76.01 -39.45 55.73 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 118.554 0.615 . . . . 0.0 112.236 -177.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 4.8 tp -56.05 -40.87 74.15 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.845 1.658 . . . . 0.0 112.361 -175.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 -81.32 -9.75 59.69 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.717 1.207 . . . . 0.0 112.33 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -93.17 -39.42 5.13 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 125.076 1.322 . . . . 0.0 111.827 169.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 43.5 m -58.07 -18.18 22.96 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 127.528 2.331 . . . . 0.0 113.216 169.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 81.51 -9.52 54.8 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 125.709 1.624 . . . . 0.0 113.838 -176.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 92.5 mt -51.41 -31.63 23.4 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 128.079 2.551 . . . . 0.0 114.315 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -129.91 138.87 52.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 C-N-CA 126.376 1.87 . . . . 0.0 109.44 177.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 51.2 t -122.02 135.9 60.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 C-N-CA 127.153 2.181 . . . . 0.0 108.713 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -87.54 136.05 33.1 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.589 0.756 . . . . 0.0 112.42 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 14.1 p -136.74 148.08 47.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.492 0.717 . . . . 0.0 110.566 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -100.09 107.25 19.1 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.964 1.306 . . . . 0.0 110.198 175.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.83 9.46 0.38 Allowed 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 116.2 1.926 . . . . 0.0 116.2 -177.405 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 116.24 -17.93 14.24 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.921 1.724 . . . . 0.0 113.083 -177.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 20.0 ttp-105 -157.88 -42.99 0.06 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.447 1.499 . . . . 0.0 111.957 -169.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -102.27 171.64 7.35 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.259 1.824 . . . . 0.0 111.136 175.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 23.8 m -120.01 143.06 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.017 1.327 . . . . 0.0 110.377 168.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.2 ptt180 -131.98 175.1 9.51 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.041 1.336 . . . . 0.0 110.808 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -122.65 125.65 46.03 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.556 1.142 . . . . 0.0 108.588 167.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -123.61 150.42 44.15 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.451 1.1 . . . . 0.0 110.365 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 tp -53.02 145.26 13.34 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.585 1.154 . . . . 0.0 110.326 172.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.27 -37.9 84.83 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 -173.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -169.11 161.41 10.37 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 123.698 1.713 . . . . 0.0 112.592 -174.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -34.96 -39.45 0.1 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 130.662 3.585 . . . . 0.0 113.162 165.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -50.79 -67.39 0.26 Allowed 'General case' 0 C--N 1.345 0.386 0 C-N-CA 127.033 2.133 . . . . 0.0 111.877 173.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 16.8 mt -62.35 -37.46 85.75 Favored 'General case' 0 C--O 1.223 -0.336 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.6 -41.89 98.3 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 118.471 -0.776 . . . . 0.0 112.276 -174.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -71.45 -52.06 20.49 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-O 117.878 -1.058 . . . . 0.0 111.772 174.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.79 -38.01 89.5 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 120.109 1.322 . . . . 0.0 112.311 -173.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.85 -29.16 64.09 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.39 -0.819 . . . . 0.0 112.109 173.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -87.09 -29.75 21.97 Favored Glycine 0 CA--C 1.543 1.796 0 C-N-CA 124.847 1.213 . . . . 0.0 116.022 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -89.04 -8.68 53.5 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.971 1.709 . . . . 0.0 112.82 171.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 13.7 tp 85.69 84.94 0.02 OUTLIER 'General case' 0 C--O 1.239 0.521 0 C-N-CA 128.801 2.84 . . . . 0.0 114.18 166.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 55.4 t -46.89 131.3 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-O 124.624 2.155 . . . . 0.0 110.172 169.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . 0.288 2.0 tp-100 -100.19 10.76 40.76 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 111.902 -2.408 . . . . 0.0 112.501 -120.021 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 6.7 p -67.32 42.39 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.71 1 C-N-CA 132.674 4.389 . . . . 0.0 110.853 166.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 56.73 9.24 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 C-N-CA 129.326 3.05 . . . . 0.0 116.247 177.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 7.3 tt 97.41 106.06 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 129.902 3.281 . . . . 0.0 104.415 -165.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.736 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 -177.098 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.467 0.388 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.97 -60.3 3.5 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 118.249 -0.881 . . . . 0.0 112.43 -177.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.5 ptp85 -61.33 -35.41 77.31 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.658 1.117 . . . . 0.0 112.69 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -59.55 -63.11 1.42 Allowed 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.805 0.842 . . . . 0.0 110.793 174.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.83 -31.34 62.42 Favored Glycine 0 C--N 1.337 0.588 0 CA-C-O 118.222 -1.321 . . . . 0.0 112.388 -169.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.77 -8.1 32.86 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.032 1.916 . . . . 0.0 114.269 173.102 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.47 -6.23 14.47 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.153 1.381 . . . . 0.0 112.753 169.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.7 tp -96.07 -37.71 10.5 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.227 1.411 . . . . 0.0 110.381 176.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.61 34.69 0.33 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 128.149 2.58 . . . . 0.0 115.469 -172.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -103.0 165.76 13.06 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 129.785 3.234 . . . . 0.0 113.209 -168.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -69.57 -104.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.549 1.258 1 C-N-CA 126.206 4.604 . . . . 0.0 110.832 168.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -46.9 -37.99 9.77 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 127.346 2.259 . . . . 0.0 112.877 176.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -32.7 73.95 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 117.964 -1.017 . . . . 0.0 113.505 -176.523 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.462 ' HG ' ' HB1' ' A' ' 95' ' ' ALA . 40.6 t -60.74 -52.14 66.36 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 119.041 0.837 . . . . 0.0 109.826 169.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 78.7 mtt-85 -52.61 -45.43 66.57 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.175 1.39 . . . . 0.0 113.239 175.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.8 mt -45.27 -63.94 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 C-N-CA 124.028 0.931 . . . . 0.0 110.887 169.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.9 mt -60.9 -42.23 97.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.774 -1.103 . . . . 0.0 112.462 -170.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -63.02 -25.61 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 CA-C-N 119.016 0.826 . . . . 0.0 112.354 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -89.2 -26.4 21.26 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.505 0.722 . . . . 0.0 112.867 175.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.31 -39.46 94.62 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.278 1.431 . . . . 0.0 112.639 -175.632 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 mt -41.13 -44.36 2.49 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 128.119 2.568 . . . . 0.0 111.809 173.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -112.59 11.63 19.68 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 126.966 2.106 . . . . 0.0 112.251 173.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.29 -4.91 19.94 Favored Glycine 0 N--CA 1.47 0.949 0 C-N-CA 127.61 2.528 . . . . 0.0 114.357 -170.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.6 m -40.95 67.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 C-N-CA 127.85 2.46 . . . . 0.0 117.344 166.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 52.0 m -133.25 -61.16 0.83 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.844 1.257 . . . . 0.0 114.168 -178.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -161.69 163.02 20.2 Favored Pre-proline 0 N--CA 1.479 0.993 0 CA-C-N 120.647 1.567 . . . . 0.0 115.143 -177.159 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -57.65 131.33 43.59 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.633 2.222 . . . . 0.0 108.159 168.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.87 1.72 59.69 Favored Glycine 0 CA--C 1.528 0.896 0 CA-C-O 116.993 -2.004 . . . . 0.0 114.928 -176.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -35.96 73.33 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 121.143 2.471 . . . . 0.0 110.766 170.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 mt -59.32 -20.9 58.3 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 125.838 1.655 . . . . 0.0 112.071 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.5 -35.09 76.7 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.931 -0.481 . . . . 0.0 111.833 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.71 -45.62 61.26 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.586 0.754 . . . . 0.0 111.18 171.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.4 m-70 -59.21 -37.39 77.34 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 177.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 21.0 mt -99.33 -16.47 18.44 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.441 1.096 . . . . 0.0 113.676 -173.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.68 8.02 71.05 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-N 119.105 0.866 . . . . 0.0 113.803 -170.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.7 mt -110.91 147.75 33.95 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.695 1.198 . . . . 0.0 111.276 -173.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.8 t -58.37 136.77 57.49 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.568 0.699 . . . . 0.0 112.089 -173.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 38.6 ptt180 -57.73 -33.66 68.68 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.428 1.091 . . . . 0.0 112.912 -176.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.8 m -61.88 -43.08 99.58 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.606 0.762 . . . . 0.0 111.509 174.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -80.08 -39.42 29.7 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 59.9 t -60.33 -38.63 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-N 119.521 1.055 . . . . 0.0 110.773 173.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 14.9 m -70.02 -21.11 63.23 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 177.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -57.01 -45.22 83.2 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-O 123.301 1.524 . . . . 0.0 110.806 174.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -69.94 -14.16 62.58 Favored 'General case' 0 CA--C 1.561 1.388 0 C-N-CA 125.857 1.663 . . . . 0.0 114.63 170.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 95.5 mt -81.11 -26.98 35.77 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 120.662 -1.274 . . . . 0.0 112.353 172.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.8 t -47.23 -50.89 20.19 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.204 0.911 . . . . 0.0 111.94 -178.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 41.5 t -86.8 -23.29 25.43 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 178.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.6 tp -58.49 -39.33 79.7 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 121.031 1.741 . . . . 0.0 111.199 171.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -77.88 -24.93 48.33 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.526 1.53 . . . . 0.0 112.021 176.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.55 -52.22 4.27 Favored Glycine 0 CA--C 1.534 1.264 0 C-N-CA 124.951 1.263 . . . . 0.0 113.462 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 17.5 m -64.75 -2.05 2.28 Favored 'General case' 0 CA--C 1.562 1.415 0 C-N-CA 125.903 1.681 . . . . 0.0 113.278 171.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.26 6.67 87.81 Favored Glycine 0 C--N 1.344 1.011 0 C-N-CA 124.987 1.279 . . . . 0.0 114.375 170.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.6 mt -66.68 -36.89 83.6 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 118.175 0.988 . . . . 0.0 111.818 -177.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.5 m -113.22 135.8 51.59 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.101 0 C-N-CA 125.881 1.672 . . . . 0.0 110.818 170.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 46.9 t -116.71 141.84 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 125.614 1.566 . . . . 0.0 108.784 176.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.11 142.32 49.16 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.753 0.821 . . . . 0.0 113.063 174.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.0 m -134.21 144.81 48.66 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 169.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -83.54 103.84 13.2 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 118.697 0.68 . . . . 0.0 109.536 168.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.269 1.3 pp20? -70.79 -161.11 0.05 OUTLIER 'General case' 0 CA--C 1.558 1.267 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 168.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -60.59 -28.32 67.54 Favored Glycine 0 CA--C 1.535 1.31 0 O-C-N 119.695 -1.878 . . . . 0.0 115.801 -169.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.0 tpt85 -158.03 14.5 0.21 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 174.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.29 174.0 11.28 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.618 1.567 . . . . 0.0 110.075 -177.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 9.1 p -87.49 139.16 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 167.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.25 165.41 16.24 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 125.334 1.453 . . . . 0.0 109.002 173.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -114.35 152.91 30.71 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 123.116 0.566 . . . . 0.0 109.735 170.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -144.38 143.32 30.88 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 125.777 1.631 . . . . 0.0 109.552 -177.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.01 143.28 22.36 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 168.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.12 -60.94 2.69 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.589 0.631 . . . . 0.0 112.479 -175.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -146.87 165.66 29.06 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.971 1.367 . . . . 0.0 112.02 -175.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -31.91 -36.29 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 130.736 3.614 . . . . 0.0 113.139 166.33 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -48.59 -66.26 0.43 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 127.208 2.203 . . . . 0.0 113.608 172.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 10.7 mt -70.24 -31.9 69.52 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 119.434 1.015 . . . . 0.0 110.179 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.49 -40.64 97.62 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.894 0.77 . . . . 0.0 111.123 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -68.99 -55.46 10.81 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 117.664 -1.16 . . . . 0.0 111.585 169.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.93 -31.6 72.72 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 120.64 1.564 . . . . 0.0 113.36 -172.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.5 tt -71.8 -54.76 9.17 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.765 0.826 . . . . 0.0 109.307 168.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.39 -24.48 75.01 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 124.708 1.147 . . . . 0.0 115.475 -167.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 -74.33 -25.17 59.38 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 126.713 2.005 . . . . 0.0 111.908 168.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.3 tp 76.73 108.71 0.08 Allowed 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 129.336 3.054 . . . . 0.0 110.553 -178.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.8 m -54.17 2.79 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 129.016 2.926 . . . . 0.0 117.099 -176.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 74.73 -5.3 2.16 Favored 'General case' 0 C--O 1.218 -0.577 0 O-C-N 120.21 -1.556 . . . . 0.0 113.217 162.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 p -64.88 43.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 127.951 2.501 . . . . 0.0 113.424 168.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER 59.55 10.34 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.887 0 C-N-CA 128.332 2.653 . . . . 0.0 113.882 174.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 18.9 tp 77.47 107.0 0.08 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 127.254 2.222 . . . . 0.0 107.639 -165.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.462 ' HB1' ' HG ' ' A' ' 24' ' ' CYS . . . -51.4 141.87 14.65 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.834 0.854 . . . . 0.0 112.872 172.534 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.4 m -149.92 165.01 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 127.693 2.397 . . . . 0.0 108.79 -176.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -75.2 26.97 0.09 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.707 2.403 . . . . 0.0 114.593 -172.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 18.2 p -114.46 44.54 1.7 Allowed 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.581 1.953 . . . . 0.0 109.967 168.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 16.4 p30 -68.59 38.93 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 129.232 3.013 . . . . 0.0 113.668 176.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.22 135.81 68.57 Favored Pre-proline 0 CA--C 1.556 1.198 0 C-N-CA 125.778 1.631 . . . . 0.0 110.788 172.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -75.58 -156.11 0.05 OUTLIER 'Trans proline' 0 CA--C 1.544 0.984 1 C-N-CA 126.155 4.57 . . . . 0.0 115.587 -164.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 16.5 t . . . . . 0 CA--C 1.556 1.18 0 C-N-CA 127.825 2.45 . . . . 0.0 114.341 -177.789 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.465 0.279 0 CA-C-O 118.148 -0.93 . . . . 0.0 113.496 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.77 -61.08 2.53 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.923 -178.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 7.4 ptp85 -61.31 -33.3 73.35 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.613 1.097 . . . . 0.0 112.889 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.54 -65.87 0.62 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.605 0.762 . . . . 0.0 110.233 174.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.57 -28.37 69.53 Favored Glycine 0 C--O 1.22 -0.736 0 CA-C-O 117.288 -1.84 . . . . 0.0 112.395 -169.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.56 -13.03 61.7 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 120.926 2.363 . . . . 0.0 114.343 173.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -108.58 -8.29 15.52 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.438 1.495 . . . . 0.0 112.746 170.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 4.7 tp -93.39 -37.13 12.15 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.848 1.259 . . . . 0.0 110.456 176.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.16 37.42 0.44 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 128.335 2.654 . . . . 0.0 115.324 -176.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.411 ' CG ' ' HE ' ' B' ' 23' ' ' ARG . 0.2 OUTLIER -104.72 165.48 13.2 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 129.141 2.976 . . . . 0.0 112.045 -169.865 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.58 -105.8 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.355 1 C-N-CA 125.975 4.45 . . . . 0.0 111.011 169.377 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -45.89 -36.64 5.52 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 127.194 2.197 . . . . 0.0 113.516 175.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . 0.411 ' HE ' ' CG ' ' B' ' 20' ' ' ASP . 0.0 OUTLIER -66.94 -33.56 75.85 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 -178.377 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 43.8 t -62.2 -49.34 76.17 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.1 0.864 . . . . 0.0 110.109 169.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 80.2 mtt-85 -53.26 -46.91 69.41 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.495 1.118 . . . . 0.0 113.119 174.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 3.5 mt -44.57 -63.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 123.975 0.91 . . . . 0.0 110.504 169.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.44 -39.46 93.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 117.917 -1.039 . . . . 0.0 113.128 -169.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -64.56 -25.23 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.294 0.952 . . . . 0.0 112.418 176.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -89.59 -27.17 20.4 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 174.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.3 -39.6 91.08 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.892 1.277 . . . . 0.0 112.872 -175.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -43.79 -45.51 7.32 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 128.709 2.804 . . . . 0.0 112.116 176.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -108.76 9.56 26.9 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 127.614 2.365 . . . . 0.0 111.569 175.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.19 -33.53 3.67 Favored Glycine 0 C--O 1.222 -0.626 0 CA-C-O 117.015 -1.992 . . . . 0.0 114.395 -169.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 34.3 m -10.88 51.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 N-CA-C 121.787 3.995 . . . . 0.0 121.787 170.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 35.8 m -119.94 -60.51 1.7 Allowed 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.189 -1.569 . . . . 0.0 112.532 -176.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -162.58 165.4 15.37 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 -174.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -58.06 128.82 30.26 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 122.564 2.176 . . . . 0.0 107.879 167.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.13 2.65 73.21 Favored Glycine 0 CA--C 1.528 0.875 0 CA-C-O 116.912 -2.049 . . . . 0.0 114.895 -176.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -39.08 80.58 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 121.44 2.62 . . . . 0.0 110.255 169.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 9.7 mt -58.85 -20.86 54.66 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 126.193 1.797 . . . . 0.0 112.561 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.9 -35.56 80.46 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.703 0.401 . . . . 0.0 111.593 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.95 -46.72 64.67 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.243 0.617 . . . . 0.0 111.15 170.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -58.27 -38.59 77.26 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 114.128 1.158 . . . . 0.0 114.128 178.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 27.8 mt -97.13 -16.55 20.41 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.4 1.08 . . . . 0.0 113.545 -173.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.07 5.14 64.81 Favored Glycine 0 CA--C 1.537 1.445 0 CA-C-N 119.249 0.931 . . . . 0.0 113.931 -169.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 96.5 mt -108.33 146.11 33.45 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.926 1.29 . . . . 0.0 111.251 -173.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 10.3 t -57.83 139.16 54.75 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.485 0.66 . . . . 0.0 112.448 -173.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -58.6 -32.19 68.76 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.208 1.003 . . . . 0.0 112.911 -176.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 4.1 m -62.26 -44.8 95.72 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.636 0.653 . . . . 0.0 111.862 173.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -77.79 -39.99 42.11 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -178.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 61.2 t -60.46 -38.44 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 118.992 0.815 . . . . 0.0 110.695 173.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 18.4 m -69.21 -24.2 63.99 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 177.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -56.09 -43.95 78.53 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 122.916 1.341 . . . . 0.0 111.232 173.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 -74.11 -17.26 60.96 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 125.11 1.364 . . . . 0.0 114.525 170.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 96.0 mt -76.65 -28.99 56.23 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 120.394 1.452 . . . . 0.0 112.297 169.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 7.6 t -46.67 -56.19 6.53 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.95 0.796 . . . . 0.0 111.901 -179.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 52.7 t -78.4 -28.98 47.02 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 118.321 -0.847 . . . . 0.0 113.262 177.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.4 tp -52.2 -41.03 62.34 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 120.84 1.654 . . . . 0.0 111.461 175.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 30.4 mtm180 -81.94 -21.64 37.16 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.283 1.433 . . . . 0.0 112.521 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.71 -39.96 11.4 Favored Glycine 0 N--CA 1.477 1.402 0 C-N-CA 124.969 1.271 . . . . 0.0 113.024 174.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 20.9 m -72.12 -11.79 60.91 Favored 'General case' 0 CA--C 1.561 1.371 0 C-N-CA 126.185 1.794 . . . . 0.0 111.883 169.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.96 11.8 85.04 Favored Glycine 0 N--CA 1.472 1.085 0 C-N-CA 124.818 1.199 . . . . 0.0 114.593 169.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 20.7 mt -67.71 -33.87 75.75 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.991 1.316 . . . . 0.0 111.492 -178.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -112.02 145.43 18.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 C-N-CA 127.865 2.466 . . . . 0.0 110.314 170.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.07 143.94 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.902 1.281 . . . . 0.0 110.796 177.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.09 136.67 52.62 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.015 0.926 . . . . 0.0 112.293 171.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 2.8 m -134.28 144.63 48.45 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 106.02 -1.845 . . . . 0.0 106.02 168.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -82.14 103.82 12.03 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.948 0.795 . . . . 0.0 110.13 169.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.27 1.1 pp20? -71.65 -160.49 0.06 Allowed 'General case' 0 CA--C 1.559 1.298 0 CA-C-N 118.249 0.477 . . . . 0.0 111.83 168.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -60.48 -27.54 66.03 Favored Glycine 0 CA--C 1.536 1.373 0 O-C-N 119.53 -1.982 . . . . 0.0 115.607 -169.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 3.4 tpt85 -157.93 11.44 0.19 Allowed 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 174.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.24 176.83 8.68 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.734 1.613 . . . . 0.0 110.724 -177.021 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 7.1 p -90.15 134.45 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 168.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.18 161.99 17.67 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.098 1.759 . . . . 0.0 110.184 174.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -117.29 118.71 33.02 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 121.853 -0.529 . . . . 0.0 110.306 175.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -106.3 149.04 27.31 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.674 1.59 . . . . 0.0 110.724 177.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 tp -58.23 151.86 18.43 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 166.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.14 -66.76 0.47 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.926 0.87 . . . . 0.0 112.923 -174.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -142.07 163.4 32.97 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.953 1.359 . . . . 0.0 111.049 -178.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -32.51 -35.2 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 130.681 3.592 . . . . 0.0 113.159 166.587 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -48.54 -69.77 0.11 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.312 2.245 . . . . 0.0 113.56 170.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.92 -32.35 74.02 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 120.097 1.317 . . . . 0.0 110.266 179.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.08 -41.97 98.73 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.782 0.719 . . . . 0.0 110.896 -177.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 19.0 tpp85 -68.27 -54.17 19.45 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.628 1.171 . . . . 0.0 111.863 171.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.02 -33.78 75.0 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 120.325 1.421 . . . . 0.0 113.347 -173.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 4.7 tt -70.12 -54.49 12.76 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.613 0.765 . . . . 0.0 109.522 168.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.68 -25.12 75.88 Favored Glycine 0 CA--C 1.54 1.609 0 C-N-CA 124.982 1.277 . . . . 0.0 115.282 -167.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -70.78 -29.25 65.4 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 126.461 1.904 . . . . 0.0 111.07 167.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . 0.419 ' C ' ' H ' ' B' ' 91' ' ' GLN . 20.6 tp 81.46 121.21 0.05 OUTLIER 'General case' 0 C--N 1.341 0.222 0 C-N-CA 130.147 3.379 . . . . 0.0 109.581 -172.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 12.0 m -62.01 3.72 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.242 0 C-N-CA 125.208 1.403 . . . . 0.0 114.739 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.419 ' H ' ' C ' ' B' ' 89' ' ' LEU . 21.8 mm-40 71.75 -9.79 0.92 Allowed 'General case' 0 C--O 1.217 -0.612 0 C-N-CA 125.404 1.482 . . . . 0.0 114.605 165.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 7.9 p -59.39 45.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 C-N-CA 129.35 3.06 . . . . 0.0 115.242 171.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.3 t 63.29 5.97 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 128.865 2.866 . . . . 0.0 113.742 173.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 18.6 tp 80.66 109.38 0.07 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 127.608 2.363 . . . . 0.0 106.308 -164.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.76 0 C-N-CA 123.506 0.722 . . . . 0.0 112.863 171.062 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.471 0.596 0 CA-C-O 117.672 -1.156 . . . . 0.0 113.158 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.6 -58.19 7.03 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 120.72 1.6 . . . . 0.0 111.711 176.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -54.73 -40.09 68.9 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.076 1.35 . . . . 0.0 112.856 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -75.34 -53.89 7.99 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.823 1.249 . . . . 0.0 111.55 177.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.18 -17.98 70.64 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-O 118.103 -1.387 . . . . 0.0 112.895 -175.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.2 mtt-85 -56.92 -19.59 18.68 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 119.844 1.822 . . . . 0.0 113.45 168.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.18 -6.53 15.54 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.576 1.151 . . . . 0.0 114.051 169.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.6 tp -101.34 -32.11 10.63 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.728 1.149 . . . . 0.0 111.638 -175.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -87.0 65.8 9.13 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 127.503 2.321 . . . . 0.0 111.133 -178.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -138.07 167.73 18.93 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 125.769 1.628 . . . . 0.0 110.541 -174.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -66.31 -103.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.553 1.432 1 C-N-CA 125.622 4.215 . . . . 0.0 111.059 169.037 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.57 ' HG1' ' CD2' ' A' ' 54' ' ' HIS . 18.0 p -37.56 -45.89 0.79 Allowed 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 128.347 2.659 . . . . 0.0 113.175 169.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.406 ' HA ' HG13 ' A' ' 26' ' ' ILE . 5.1 ttm180 -62.83 -42.45 99.74 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.108 0.867 . . . . 0.0 111.621 -171.579 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 19.5 t -58.27 -53.5 57.6 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 118.324 0.511 . . . . 0.0 110.385 168.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 -53.84 -36.38 62.5 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 178.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.406 HG13 ' HA ' ' A' ' 23' ' ' ARG . 1.5 mt -48.75 -58.43 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 CA-C-N 119.593 1.088 . . . . 0.0 109.039 170.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 79.0 mt -66.21 -37.45 85.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.435 -171.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -69.33 -31.9 51.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 122.719 0.407 . . . . 0.0 111.934 177.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.02 -30.47 31.47 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.356 1.062 . . . . 0.0 112.709 177.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.47 -35.51 81.13 Favored 'General case' 0 C--O 1.224 -0.243 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 177.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.3 mt -46.18 -21.59 0.17 Allowed 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 117.3 -1.333 . . . . 0.0 114.55 169.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -122.38 -35.04 3.18 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 126.392 1.877 . . . . 0.0 113.815 178.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.9 -76.54 0.94 Allowed Glycine 0 N--CA 1.475 1.253 0 C-N-CA 127.043 2.259 . . . . 0.0 113.172 -170.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 1.4 m 45.44 31.29 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 C-N-CA 125.283 1.433 . . . . 0.0 114.82 178.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 32.8 m -88.16 -79.3 0.3 Allowed 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.141 0.976 . . . . 0.0 112.888 -178.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -140.54 154.86 69.74 Favored Pre-proline 0 N--CA 1.478 0.961 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -168.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -66.41 16.05 0.11 Allowed 'Trans proline' 0 CA--C 1.55 1.322 0 C-N-CA 124.668 3.579 . . . . 0.0 115.068 171.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -124.21 -10.37 5.16 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 125.885 1.707 . . . . 0.0 113.688 168.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.59 -39.75 70.33 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.695 1.747 . . . . 0.0 111.115 -174.301 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.7 mt -57.18 -19.2 19.21 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 123.925 0.89 . . . . 0.0 112.915 173.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.19 -30.99 71.94 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 120.019 1.281 . . . . 0.0 112.036 -179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.81 -49.96 11.22 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.565 0.746 . . . . 0.0 111.304 173.114 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -53.89 -31.11 48.79 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 60.0 mt -102.52 -7.6 21.74 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.848 1.659 . . . . 0.0 112.995 -177.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.27 0.72 8.17 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.272 1.415 . . . . 0.0 114.069 -173.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.5 mp -110.76 144.21 40.08 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 124.334 1.054 . . . . 0.0 111.864 -169.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.9 t -59.42 149.22 29.99 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 121.932 0.873 . . . . 0.0 111.205 177.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -63.42 -16.24 59.96 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.966 1.098 . . . . 0.0 113.966 -170.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.8 p -71.34 -48.3 51.18 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.065 1.302 . . . . 0.0 112.043 168.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -60.67 -43.1 98.06 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.219 0.918 . . . . 0.0 111.48 172.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 69.6 t -62.84 -40.95 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 O-C-N 121.827 -0.546 . . . . 0.0 111.34 176.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 73.8 m -62.14 -36.93 83.3 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 178.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -56.39 -41.54 76.45 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.138 0.575 . . . . 0.0 111.778 172.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.57 ' CD2' ' HG1' ' A' ' 22' ' ' THR . 94.2 m-70 -73.66 -35.23 65.22 Favored 'General case' 0 CA--C 1.558 1.288 0 O-C-N 121.264 -0.897 . . . . 0.0 112.805 174.202 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.1 mt -69.88 -37.02 75.91 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 120.607 1.549 . . . . 0.0 114.127 176.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 38.9 m -54.61 -39.72 68.17 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.926 1.239 . . . . 0.0 113.094 -177.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 9.0 t -67.63 -43.53 80.16 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 118.578 0.626 . . . . 0.0 112.021 175.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.3 tp -61.96 -37.33 84.35 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 127.94 2.496 . . . . 0.0 112.823 -175.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.0 mtm105 -82.35 2.45 32.25 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.34 1.856 . . . . 0.0 112.721 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -112.63 -45.16 0.79 Allowed Glycine 0 N--CA 1.475 1.241 0 C-N-CA 126.582 2.039 . . . . 0.0 112.352 173.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 98.6 m -66.01 3.31 0.86 Allowed 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 127.2 2.2 . . . . 0.0 113.751 171.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 58.21 35.89 79.99 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 125.625 1.583 . . . . 0.0 113.687 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.6 mt -86.56 -29.07 22.92 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.563 1.145 . . . . 0.0 112.698 173.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.1 m -140.17 143.84 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 125.39 1.476 . . . . 0.0 112.115 -175.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.4 t -131.12 142.81 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 125.98 1.712 . . . . 0.0 110.236 -174.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.08 158.35 35.88 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.475 1.91 . . . . 0.0 113.961 176.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.3 m -156.67 174.71 15.05 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 168.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -111.07 119.34 38.7 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.481 0.712 . . . . 0.0 110.519 169.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -77.42 -157.32 0.09 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.248 0.619 . . . . 0.0 110.767 167.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.86 -24.9 68.74 Favored Glycine 0 CA--C 1.537 1.465 0 O-C-N 119.479 -2.013 . . . . 0.0 115.819 -171.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -157.18 2.0 0.12 Allowed 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.298 1.549 . . . . 0.0 114.861 172.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -125.39 164.23 20.87 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 126.017 1.727 . . . . 0.0 109.584 -179.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 30.7 m -79.21 150.75 5.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 166.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -125.57 179.86 4.95 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.411 1.485 . . . . 0.0 110.205 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -142.87 132.06 23.24 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 124.443 1.097 . . . . 0.0 110.849 174.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.78 162.01 29.42 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.793 2.037 . . . . 0.0 110.079 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.0 mp -57.47 149.52 20.77 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 119.026 0.83 . . . . 0.0 110.293 169.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.5 -21.03 66.18 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 114.684 1.364 . . . . 0.0 114.684 -172.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -170.92 173.44 5.16 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 122.416 1.103 . . . . 0.0 113.223 168.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 52.9 p -40.5 -31.3 0.14 Allowed 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 128.958 2.903 . . . . 0.0 112.284 165.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -44.16 -76.27 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 127.379 2.272 . . . . 0.0 112.762 168.047 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.4 ' H ' HD23 ' A' ' 82' ' ' LEU . 0.0 OUTLIER -71.17 -28.69 64.43 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -171.635 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.5 -45.51 93.9 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.125 0.97 . . . . 0.0 111.586 177.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . 0.281 3.1 ppt_? -72.66 -46.12 55.51 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.618 177.112 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.09 -42.51 90.64 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 179.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 tt -73.54 -43.46 59.87 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.534 -0.729 . . . . 0.0 110.408 175.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.88 -35.92 57.94 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.261 0.934 . . . . 0.0 113.753 -172.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -78.21 -3.56 43.29 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.858 1.263 . . . . 0.0 112.353 169.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.459 ' C ' ' H ' ' A' ' 91' ' ' GLN . 54.8 tp 67.48 107.73 0.04 OUTLIER 'General case' 0 C--N 1.342 0.275 0 C-N-CA 129.028 2.931 . . . . 0.0 111.579 169.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.7 m -66.59 23.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 125.999 1.72 . . . . 0.0 114.424 178.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.459 ' H ' ' C ' ' A' ' 89' ' ' LEU . 28.1 mm-40 83.07 -13.93 0.77 Allowed 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.399 -1.438 . . . . 0.0 112.116 152.338 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 14.4 p -54.77 32.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.525 1 C-N-CA 133.166 4.587 . . . . 0.0 116.475 169.007 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.1 t 58.48 31.32 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 128.193 2.597 . . . . 0.0 111.533 168.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 79.37 113.87 0.07 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 127.589 2.356 . . . . 0.0 105.715 -165.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.51 64.68 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 127.201 2.2 . . . . 0.0 114.803 -179.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -51.57 161.16 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 127.631 2.372 . . . . 0.0 113.008 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.03 16.67 7.93 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 128.542 2.737 . . . . 0.0 114.422 -172.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 10.2 p -86.98 150.19 24.24 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.229 1.411 . . . . 0.0 112.402 176.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -140.7 139.99 34.83 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.904 1.682 . . . . 0.0 110.623 176.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -163.05 158.61 18.4 Favored Pre-proline 0 CA--C 1.541 0.609 0 O-C-N 120.32 -1.488 . . . . 0.0 111.727 -166.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -73.6 174.66 11.86 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 122.478 2.118 . . . . 0.0 108.275 165.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 48.9 t . . . . . 0 CA--C 1.543 0.692 0 CA-C-O 123.182 1.468 . . . . 0.0 114.033 -171.731 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.467 0.39 0 CA-C-O 117.479 -1.248 . . . . 0.0 113.437 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.24 -57.73 9.5 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.858 1.663 . . . . 0.0 111.425 174.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 13.9 mtp85 -54.46 -38.96 66.97 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.173 1.389 . . . . 0.0 112.398 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -76.22 -54.01 7.42 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.319 1.448 . . . . 0.0 112.497 177.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -73.42 -14.75 79.24 Favored Glycine 0 CA--C 1.53 1.009 0 CA-C-O 117.907 -1.496 . . . . 0.0 112.704 -174.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 62.1 mtt-85 -57.9 -12.79 3.5 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 119.947 1.873 . . . . 0.0 113.658 168.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -122.41 -1.44 9.12 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.026 1.73 . . . . 0.0 113.978 170.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 3.9 tp -106.91 -30.3 8.95 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.615 1.098 . . . . 0.0 111.566 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.22 66.61 9.81 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.405 2.282 . . . . 0.0 110.331 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.61 162.93 50.34 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 125.724 1.61 . . . . 0.0 111.343 -171.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -69.65 -100.54 0.01 OUTLIER 'Trans proline' 0 CA--C 1.551 1.337 0 C-N-CA 125.184 3.922 . . . . 0.0 109.584 169.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.6 ' HG1' ' CD2' ' B' ' 54' ' ' HIS . 22.7 p -36.74 -46.4 0.6 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 129.028 2.931 . . . . 0.0 113.458 168.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . 0.423 ' HA ' HG13 ' B' ' 26' ' ' ILE . 7.4 ttm180 -70.9 -37.06 72.95 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.582 1.083 . . . . 0.0 112.947 -171.109 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 12.1 t -60.03 -52.47 65.24 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.853 0.835 . . . . 0.0 109.254 167.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 3.9 mmt85 -55.65 -36.75 67.39 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 177.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . 0.423 HG13 ' HA ' ' B' ' 23' ' ' ARG . 1.7 mt -49.9 -60.1 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 CA-C-N 119.756 1.162 . . . . 0.0 108.945 171.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 87.9 mt -63.78 -38.8 92.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 118.144 -0.932 . . . . 0.0 111.748 -173.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -68.93 -33.72 60.54 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-N 119.149 0.886 . . . . 0.0 111.881 177.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.44 -23.99 27.64 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.664 0.786 . . . . 0.0 113.028 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.06 -45.05 94.02 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 117.749 -1.12 . . . . 0.0 112.27 171.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -42.61 -43.16 3.68 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.719 2.408 . . . . 0.0 113.573 -174.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -100.47 -31.85 11.09 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.104 1.762 . . . . 0.0 112.67 177.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.04 -61.03 2.17 Favored Glycine 0 C--N 1.343 0.937 0 C-N-CA 124.542 1.068 . . . . 0.0 113.933 -171.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 30.91 46.59 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 C-N-CA 127.598 2.359 . . . . 0.0 115.192 178.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 3.3 m -107.73 -67.91 0.93 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.665 1.586 . . . . 0.0 112.777 -176.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -143.17 152.77 58.77 Favored Pre-proline 0 N--CA 1.476 0.839 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -167.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -68.27 8.93 0.44 Allowed 'Trans proline' 0 CA--C 1.55 1.289 0 C-N-CA 124.689 3.593 . . . . 0.0 113.764 168.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -122.43 -10.18 6.17 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 125.811 1.672 . . . . 0.0 113.754 168.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.51 -40.11 80.98 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 119.717 1.758 . . . . 0.0 110.331 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 47.7 mt -63.14 -11.34 19.64 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 124.05 0.94 . . . . 0.0 112.355 -179.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -73.2 -33.69 65.53 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 119.743 -0.783 . . . . 0.0 111.003 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.56 -53.46 10.48 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.173 0.989 . . . . 0.0 110.34 169.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -52.62 -30.86 33.69 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 -178.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 65.5 mt -102.4 -18.78 15.22 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.319 1.447 . . . . 0.0 113.349 -178.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.51 -1.54 56.92 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.555 1.074 . . . . 0.0 113.854 -170.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 8.5 mp -110.95 146.94 35.71 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 119.222 1.511 . . . . 0.0 112.313 -174.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 8.9 t -56.37 150.52 14.68 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 122.291 1.043 . . . . 0.0 112.383 176.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -63.98 -14.18 52.05 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -171.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 13.5 p -72.66 -44.01 62.39 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 120.144 1.338 . . . . 0.0 112.235 169.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -61.27 -44.7 96.8 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.673 0.669 . . . . 0.0 111.506 170.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 52.6 t -57.73 -47.54 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.831 174.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 75.5 m -59.53 -40.3 86.72 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.86 0.864 . . . . 0.0 113.155 -177.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -54.32 -46.26 72.81 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.921 0.888 . . . . 0.0 112.086 171.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . 0.6 ' CD2' ' HG1' ' B' ' 22' ' ' THR . 86.0 m-70 -73.67 -28.22 61.64 Favored 'General case' 0 CA--C 1.558 1.27 0 O-C-N 121.141 -0.974 . . . . 0.0 112.682 176.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 45.3 mt -73.66 -33.98 64.72 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 120.864 1.665 . . . . 0.0 113.613 174.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 33.6 m -52.78 -40.67 63.39 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.447 1.022 . . . . 0.0 113.461 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.2 t -70.16 -39.64 75.22 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.208 0.913 . . . . 0.0 112.329 177.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 2.3 tp -60.95 -47.47 86.27 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 128.071 2.548 . . . . 0.0 111.688 -174.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 33.1 mtm105 -80.17 4.75 16.42 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.827 1.651 . . . . 0.0 112.214 177.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -106.22 -47.62 1.06 Allowed Glycine 0 CA--C 1.532 1.112 0 C-N-CA 125.958 1.742 . . . . 0.0 112.02 169.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 92.8 m -76.56 13.74 0.92 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 126.514 1.925 . . . . 0.0 114.431 177.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.03 29.06 69.92 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 125.731 1.634 . . . . 0.0 114.418 174.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 24.9 mt -80.78 -26.49 37.17 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.377 -1.072 . . . . 0.0 112.943 176.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.5 m -147.17 152.3 13.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 126.152 1.781 . . . . 0.0 112.572 -171.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -130.13 158.12 42.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.783 1.633 . . . . 0.0 111.187 173.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.53 161.08 30.1 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.04 1.336 . . . . 0.0 112.267 167.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.1 m -156.56 176.71 12.35 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.583 1.553 . . . . 0.0 107.046 168.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -117.52 118.88 33.36 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.928 0.891 . . . . 0.0 111.344 172.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.25 1.2 pp20? -77.32 -151.96 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.457 0.703 . . . . 0.0 111.233 167.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -66.98 -24.79 73.2 Favored Glycine 0 CA--C 1.54 1.594 0 O-C-N 119.572 -1.955 . . . . 0.0 116.035 -173.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 5.4 ttp85 -158.71 0.32 0.09 Allowed 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 119.263 1.532 . . . . 0.0 114.528 174.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -124.98 162.93 23.43 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 126.11 1.764 . . . . 0.0 109.327 -178.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 20.8 m -80.29 152.44 4.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 O-C-N 121.709 -0.619 . . . . 0.0 109.415 165.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 8.0 ptt180 -124.62 172.47 9.22 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.263 1.425 . . . . 0.0 110.331 174.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -120.7 143.79 48.56 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.321 1.048 . . . . 0.0 110.027 167.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -142.02 149.45 40.0 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.566 1.546 . . . . 0.0 110.566 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 6.1 mp -52.93 146.78 10.25 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 119.216 0.916 . . . . 0.0 109.138 169.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.17 -16.22 63.27 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -172.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -169.91 172.4 6.63 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 123.055 1.407 . . . . 0.0 112.51 171.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 86.4 p -49.73 -26.13 3.55 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.408 2.283 . . . . 0.0 111.282 163.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 8.5 t60 -60.26 -58.06 10.11 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 128.298 2.639 . . . . 0.0 112.032 179.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.11 -33.15 71.49 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 120.579 1.536 . . . . 0.0 110.25 174.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.13 -37.41 82.74 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.949 0.9 . . . . 0.0 112.318 -176.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.26 -44.02 63.45 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-O 117.506 -1.235 . . . . 0.0 111.683 174.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.09 -43.72 95.32 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 120.017 1.281 . . . . 0.0 113.518 177.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 5.0 tt -67.02 -49.78 64.18 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.084 0.954 . . . . 0.0 110.312 174.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.81 -33.04 47.78 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.84 1.21 . . . . 0.0 114.623 -167.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -74.11 -10.96 60.14 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 118.958 1.379 . . . . 0.0 112.201 169.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . 0.48 ' C ' ' H ' ' B' ' 91' ' ' GLN . 57.9 tp 69.66 110.3 0.05 Allowed 'General case' 0 C--O 1.235 0.303 0 C-N-CA 129.59 3.156 . . . . 0.0 110.939 171.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 21.0 m -66.32 23.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 C-N-CA 126.295 1.838 . . . . 0.0 114.286 177.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.48 ' H ' ' C ' ' B' ' 89' ' ' LEU . 24.6 mm-40 78.22 -9.63 1.48 Allowed 'General case' 0 C--N 1.327 -0.402 0 O-C-N 120.43 -1.419 . . . . 0.0 113.166 156.323 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 11.2 p -54.22 26.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.25 1 C-N-CA 132.226 4.21 . . . . 0.0 115.993 167.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . 0.444 ' H ' ' C ' ' B' ' 91' ' ' GLN . 1.8 t 60.29 31.71 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 127.044 2.138 . . . . 0.0 111.589 167.52 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 80.86 112.33 0.07 Allowed 'General case' 0 C--N 1.347 0.485 0 C-N-CA 127.697 2.399 . . . . 0.0 106.338 -167.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.554 1.105 0 C-N-CA 128.38 2.672 . . . . 0.0 114.861 176.422 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 C--O 1.223 -0.313 0 CA-C-O 117.287 -1.34 . . . . 0.0 113.568 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.72 -37.99 63.87 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 121.611 2.005 . . . . 0.0 113.663 -172.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.45 HH21 ' HB3' ' A' ' 61' ' ' CYS . 0.0 OUTLIER -53.68 -23.26 10.87 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.645 0.979 . . . . 0.0 113.645 177.599 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.14 -41.82 75.96 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.29 1.836 . . . . 0.0 111.92 174.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.38 -35.8 92.54 Favored Glycine 0 CA--C 1.53 0.993 0 CA-C-N 120.388 1.449 . . . . 0.0 112.114 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.66 -45.71 61.17 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.803 0.841 . . . . 0.0 110.986 170.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.92 -24.17 67.63 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.728 1.149 . . . . 0.0 112.862 -178.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.7 mp -82.26 -28.39 31.85 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.014 0.825 . . . . 0.0 112.712 169.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -87.91 67.23 8.98 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.559 1.944 . . . . 0.0 112.831 173.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.551 ' HB3' HH11 ' A' ' 23' ' ' ARG . 31.3 t70 -143.55 135.86 13.33 Favored Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 128.241 2.616 . . . . 0.0 107.353 -176.615 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -52.68 -102.74 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.902 1 C-N-CA 127.26 5.307 . . . . 0.0 116.722 -163.677 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.4 m -56.0 -30.72 62.25 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.573 1.149 . . . . 0.0 110.511 -177.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.551 HH11 ' HB3' ' A' ' 20' ' ' ASP . 0.0 OUTLIER -50.33 -42.08 52.26 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 172.717 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 36.8 t -58.7 -43.48 90.07 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.314 -0.866 . . . . 0.0 111.346 175.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.5 tpt180 -63.67 -29.47 70.7 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 118.051 -0.976 . . . . 0.0 112.118 174.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.6 mt -62.56 -53.57 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 120.756 1.616 . . . . 0.0 110.999 167.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.482 ' CD1' HH21 ' A' ' 23' ' ' ARG . 8.5 mt -60.17 -39.47 86.54 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 117.704 -1.141 . . . . 0.0 112.608 -177.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -68.73 -27.35 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 CA-C-N 120.292 1.406 . . . . 0.0 112.825 175.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.25 1.5 36.36 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 126.167 1.787 . . . . 0.0 114.222 169.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.64 -20.0 14.59 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 120.651 -1.281 . . . . 0.0 111.853 168.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.2 mt -66.79 -44.64 80.75 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.375 1.47 . . . . 0.0 109.218 165.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -132.49 95.94 3.73 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.666 1.986 . . . . 0.0 110.99 168.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -179.22 -83.48 0.06 OUTLIER Glycine 0 N--CA 1.468 0.769 0 C-N-CA 125.999 1.761 . . . . 0.0 110.592 171.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 19.5 m 43.06 25.37 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 116.881 2.178 . . . . 0.0 116.881 171.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 99.1 m -83.61 -76.48 0.29 Allowed 'General case' 0 C--O 1.223 -0.307 0 O-C-N 121.047 -1.033 . . . . 0.0 109.919 178.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -139.38 159.71 64.84 Favored Pre-proline 0 CA--C 1.54 0.578 0 CA-C-O 118.549 -0.739 . . . . 0.0 112.902 -170.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -57.27 -18.8 31.81 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.183 2.588 . . . . 0.0 114.819 175.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -97.18 -6.48 57.74 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 118.175 -1.347 . . . . 0.0 115.766 172.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -28.7 65.31 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.43 2.115 . . . . 0.0 113.143 -170.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 23.4 mt -63.75 -18.67 64.29 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 123.839 0.856 . . . . 0.0 111.717 178.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.24 -45.03 68.58 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.273 0.629 . . . . 0.0 111.496 177.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.46 -41.02 69.92 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.786 0.834 . . . . 0.0 112.151 176.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -64.04 -21.37 66.48 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.903 1.446 . . . . 0.0 114.903 176.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 86.8 mt -115.32 -15.59 11.56 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.803 1.641 . . . . 0.0 114.029 -172.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.7 4.14 57.0 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.021 0.82 . . . . 0.0 113.405 -170.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 71.9 mt -102.31 172.86 6.64 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.814 1.246 . . . . 0.0 111.286 -176.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.1 p -86.27 158.34 19.72 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.503 -0.748 . . . . 0.0 110.065 175.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -61.92 -21.33 64.66 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 174.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.0 p -73.52 -52.58 13.05 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.078 -1.013 . . . . 0.0 109.712 168.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -69.77 -30.05 67.53 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.009 0.924 . . . . 0.0 112.505 -173.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 80.0 t -67.25 -30.26 48.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 O-C-N 120.681 -1.262 . . . . 0.0 111.769 167.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 74.3 m -70.52 -16.11 62.85 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.607 -1.308 . . . . 0.0 114.091 -175.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -54.2 -58.95 5.44 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.761 0.824 . . . . 0.0 110.635 169.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -77.02 -14.81 59.79 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-O 117.837 -1.078 . . . . 0.0 113.78 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 92.9 mt -70.81 -26.99 63.56 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 121.241 1.837 . . . . 0.0 111.668 169.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 65.1 p -59.26 -47.32 85.79 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 -175.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.9 t -72.97 -38.12 66.83 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.766 0.712 . . . . 0.0 111.829 172.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.5 tp -51.1 -48.86 61.58 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.202 1.001 . . . . 0.0 112.397 176.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 43.8 mtm180 -88.96 -5.54 57.89 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.627 1.571 . . . . 0.0 113.56 -176.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -100.9 -41.48 2.65 Favored Glycine 0 N--CA 1.474 1.2 0 C-N-CA 125.538 1.542 . . . . 0.0 112.811 175.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.45 ' HB3' HH21 ' A' ' 13' ' ' ARG . 3.8 m -77.44 8.73 3.87 Favored 'General case' 0 CA--C 1.552 1.051 0 O-C-N 120.832 -1.393 . . . . 0.0 113.297 169.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 58.41 34.65 75.92 Favored Glycine 0 CA--C 1.533 1.191 0 O-C-N 120.904 -1.123 . . . . 0.0 114.045 176.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 26.2 mt -82.38 -25.88 33.38 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.275 1.538 . . . . 0.0 111.989 171.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.5 m -133.98 149.3 30.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 127.34 2.256 . . . . 0.0 109.366 176.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.6 t -129.08 135.82 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 C-N-CA 124.995 1.318 . . . . 0.0 109.883 -176.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.72 148.23 44.87 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.671 1.189 . . . . 0.0 112.863 171.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 34.2 m -160.0 162.77 34.37 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.498 1.919 . . . . 0.0 106.584 -178.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -87.65 138.74 31.2 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.136 1.334 . . . . 0.0 110.917 169.072 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.98 -20.2 39.01 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 118.318 0.508 . . . . 0.0 112.239 169.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 139.76 -47.31 0.9 Allowed Glycine 0 CA--C 1.528 0.906 0 C-N-CA 126.009 1.766 . . . . 0.0 112.237 175.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 19.8 ttp180 -101.0 -29.67 12.05 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.562 1.945 . . . . 0.0 112.027 171.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.13 171.21 13.93 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.662 1.985 . . . . 0.0 110.913 -170.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 13.0 p -87.35 144.46 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 124.011 0.924 . . . . 0.0 109.438 169.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -128.8 174.22 9.66 Favored 'General case' 0 CA--C 1.522 -0.126 0 C-N-CA 126.244 1.818 . . . . 0.0 109.718 178.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -117.23 170.85 8.36 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.373 1.069 . . . . 0.0 109.08 166.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -164.97 154.97 13.5 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.46 1.904 . . . . 0.0 109.246 177.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 tp -56.71 142.44 40.22 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.315 0.961 . . . . 0.0 111.683 171.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -83.39 11.34 6.97 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 116.224 1.935 . . . . 0.0 116.224 -169.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.2 t0 165.65 144.87 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 128.69 2.796 . . . . 0.0 110.874 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 83.8 p -45.67 -29.87 1.39 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.924 2.089 . . . . 0.0 114.074 167.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -61.93 -49.74 74.93 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 124.062 0.945 . . . . 0.0 112.744 174.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 54.0 mt -60.85 -42.71 98.36 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 176.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.97 -34.08 65.38 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.617 1.167 . . . . 0.0 112.014 -174.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.7 mtt-85 -71.79 -60.68 2.11 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.417 1.087 . . . . 0.0 113.212 177.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.45 -34.6 75.69 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 120.309 1.413 . . . . 0.0 112.543 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 70.0 tp -62.46 -49.73 74.28 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.659 1.584 . . . . 0.0 110.795 169.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -67.93 -39.82 89.23 Favored Glycine 0 N--CA 1.475 1.239 0 C-N-CA 126.616 2.055 . . . . 0.0 113.926 -176.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 51.9 tp10 -64.79 -8.23 14.21 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 127.763 2.425 . . . . 0.0 112.713 168.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.417 ' C ' ' H ' ' A' ' 91' ' ' GLN . 8.3 tp 67.69 36.38 3.64 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 128.721 2.808 . . . . 0.0 110.6 169.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 3.8 m 48.63 -18.05 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 131.483 3.913 . . . . 0.0 117.366 -168.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.417 ' H ' ' C ' ' A' ' 89' ' ' LEU . 56.2 mm-40 69.94 -7.39 0.94 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 128.271 2.628 . . . . 0.0 114.076 -174.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -66.61 -10.38 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 C-N-CA 126.39 1.876 . . . . 0.0 114.467 170.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 79.5 42.57 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.043 0 C-N-CA 129.937 3.295 . . . . 0.0 113.158 168.071 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 tt 78.09 95.85 0.06 Allowed 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 123.614 1.673 . . . . 0.0 109.09 -168.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -49.55 70.72 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 128.355 2.662 . . . . 0.0 116.336 169.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 94.1 t -58.73 130.97 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 N-CA-C 106.09 -1.818 . . . . 0.0 106.09 165.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -60.93 -80.3 0.03 OUTLIER 'General case' 0 C--O 1.235 0.33 0 O-C-N 123.905 0.753 . . . . 0.0 112.294 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 5.7 p 66.24 132.59 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 128.785 2.834 . . . . 0.0 108.777 -169.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -84.92 83.67 7.97 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 120.974 1.715 . . . . 0.0 110.011 178.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.52 151.23 76.94 Favored Pre-proline 0 CA--C 1.551 1.007 0 CA-C-N 114.042 -1.435 . . . . 0.0 109.717 177.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -86.17 -102.39 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 124.083 3.189 . . . . 0.0 108.196 174.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 34.9 t . . . . . 0 N--CA 1.447 -0.598 0 CA-C-O 123.438 1.589 . . . . 0.0 109.784 165.205 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? . . . . . 0 CA--C 1.543 0.677 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.22 -39.82 22.54 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 121.016 1.734 . . . . 0.0 111.154 166.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -59.07 -21.37 59.06 Favored 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 124.583 1.153 . . . . 0.0 111.518 176.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -47.78 -47.07 30.87 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.976 2.511 . . . . 0.0 111.668 165.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.07 -15.0 69.1 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-O 119.139 -0.812 . . . . 0.0 112.557 -175.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.39 -56.25 4.59 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 166.303 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.24 -27.81 68.72 Favored 'General case' 0 CA--C 1.549 0.914 0 N-CA-C 115.583 1.698 . . . . 0.0 115.583 -173.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 5.8 mp -84.19 -20.05 33.01 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 119.284 0.947 . . . . 0.0 113.458 171.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.6 51.88 1.95 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.092 1.357 . . . . 0.0 110.995 169.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -117.21 146.85 39.14 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 127.511 2.325 . . . . 0.0 107.808 176.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -59.78 -94.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.929 1 C-N-CA 126.248 4.632 . . . . 0.0 113.663 -168.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.3 m -58.54 -24.23 60.17 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 120.773 -1.204 . . . . 0.0 111.213 175.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . 0.424 ' HD3' ' CD1' ' B' ' 58' ' ' LEU . 13.1 ttm-85 -70.72 -41.22 72.18 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 113.977 1.102 . . . . 0.0 113.977 -178.538 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 38.1 t -56.02 -42.62 76.76 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.84 1.2 . . . . 0.0 109.449 169.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -64.66 -33.87 76.95 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 116.936 -1.507 . . . . 0.0 113.179 174.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.5 mt -56.8 -62.75 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 CA-C-N 121.317 1.871 . . . . 0.0 108.419 168.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 41.2 mt -54.88 -43.13 72.9 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.155 -0.926 . . . . 0.0 112.204 -170.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.9 p -74.59 -19.49 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-N 119.535 1.061 . . . . 0.0 113.197 -178.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.57 -27.46 21.36 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.486 1.515 . . . . 0.0 112.629 172.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.82 -47.02 83.83 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 125.5 1.52 . . . . 0.0 109.523 170.43 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.36 -61.11 1.8 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 129.946 3.298 . . . . 0.0 112.252 179.342 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -95.53 34.73 1.43 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.929 2.492 . . . . 0.0 110.395 174.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -128.92 -80.75 0.27 Allowed Glycine 0 C--N 1.337 0.613 0 C-N-CA 125.281 1.42 . . . . 0.0 113.532 -173.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 27.5 m 27.79 24.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 N-CA-C 119.651 3.204 . . . . 0.0 119.651 -174.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 76.1 m -83.7 -67.28 0.8 Allowed 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 121.331 1.878 . . . . 0.0 112.138 -178.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -147.15 162.57 32.24 Favored Pre-proline 0 CA--C 1.54 0.566 0 CA-C-O 117.919 -1.039 . . . . 0.0 111.231 -173.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -55.65 -27.5 61.12 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 122.7 2.267 . . . . 0.0 112.983 169.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -83.83 -3.9 89.08 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 117.432 -1.76 . . . . 0.0 115.521 175.011 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . 0.481 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -76.62 -36.92 57.14 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.953 2.376 . . . . 0.0 112.856 -172.419 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 14.7 mt -62.45 -22.31 66.11 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 123.431 0.693 . . . . 0.0 111.458 -179.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.87 -38.34 64.63 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.553 0.741 . . . . 0.0 111.904 176.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -52.61 13.38 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.618 0.767 . . . . 0.0 111.198 176.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . 0.481 ' CD2' HE22 ' B' ' 39' ' ' GLN . 8.9 m-70 -57.41 -24.16 53.77 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 65.9 mt -108.44 -11.23 15.19 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.603 1.561 . . . . 0.0 113.245 -176.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.36 8.04 42.66 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.292 0.948 . . . . 0.0 113.803 -170.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 53.4 mt -103.81 164.56 11.6 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.773 1.229 . . . . 0.0 112.066 -171.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 68.0 p -70.58 146.42 50.1 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.286 -0.884 . . . . 0.0 109.992 174.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 39.8 ptt180 -60.75 -17.07 46.45 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 172.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 47.6 p -73.6 -61.03 1.98 Allowed 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 166.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -66.57 -25.26 66.55 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.425 1.011 . . . . 0.0 113.124 -170.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 74.7 t -68.95 -31.11 49.2 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 CA-C-N 118.687 0.676 . . . . 0.0 111.896 169.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 75.8 m -61.28 -30.3 70.39 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.989 -1.069 . . . . 0.0 112.351 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -57.0 -13.68 2.94 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 128.053 2.541 . . . . 0.0 114.717 173.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -119.23 -8.01 10.19 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 120.325 -1.484 . . . . 0.0 114.411 170.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 71.4 mt -81.13 -25.06 37.21 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.067 0.947 . . . . 0.0 111.542 168.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 4.4 p -55.63 -49.63 72.33 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 7.3 t -72.76 -35.32 67.45 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.765 1.166 . . . . 0.0 111.889 176.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . 0.424 ' CD1' ' HD3' ' B' ' 23' ' ' ARG . 1.4 tp -56.91 -52.61 64.47 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.261 2.224 . . . . 0.0 111.726 -176.258 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 28.7 mtm105 -84.4 14.48 4.42 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.747 1.619 . . . . 0.0 111.863 178.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -110.17 -50.48 0.67 Allowed Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.712 1.149 . . . . 0.0 111.231 169.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 81.1 m -73.47 3.93 5.46 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 125.99 1.716 . . . . 0.0 113.748 -178.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.56 24.17 70.86 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 118.759 -1.023 . . . . 0.0 113.57 -176.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 63.3 mt -73.46 -21.57 60.4 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.545 1.672 . . . . 0.0 112.522 170.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -145.31 154.5 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 126.982 2.113 . . . . 0.0 110.109 175.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 89.8 t -135.23 141.89 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 127.118 2.167 . . . . 0.0 109.331 -177.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.12 155.21 22.73 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 123.102 1.429 . . . . 0.0 114.004 174.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 29.5 m -160.27 172.28 17.66 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.711 2.004 . . . . 0.0 107.082 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -92.51 152.39 19.68 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 119.958 1.254 . . . . 0.0 111.72 168.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -96.34 -4.69 41.55 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.151 0.981 . . . . 0.0 112.034 167.528 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 121.0 -34.81 3.89 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 127.14 2.305 . . . . 0.0 112.802 176.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 23.8 ttp180 -120.42 -29.92 4.68 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 130.419 3.487 . . . . 0.0 111.822 -176.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -135.38 171.96 13.7 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 128.425 2.69 . . . . 0.0 110.896 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 8.3 p -87.52 150.23 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.797 1.239 . . . . 0.0 110.283 169.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 31.3 ptt85 -137.25 172.27 13.24 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 126.552 1.941 . . . . 0.0 109.814 -174.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -114.69 171.98 7.31 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.534 0.734 . . . . 0.0 110.201 167.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -160.95 151.05 17.57 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 127.0 2.12 . . . . 0.0 107.919 179.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.3 tp -60.45 157.8 13.3 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.618 1.167 . . . . 0.0 113.193 172.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.84 -30.92 58.68 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 116.366 1.988 . . . . 0.0 116.366 -177.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 42.0 t0 173.49 153.12 0.09 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.345 2.258 . . . . 0.0 109.091 -166.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 90.8 p -44.23 -30.91 0.86 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.191 1.796 . . . . 0.0 112.917 166.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -53.55 -59.01 5.15 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 126.236 1.814 . . . . 0.0 113.763 171.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 21.6 mt -60.77 -44.96 96.11 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.482 1.037 . . . . 0.0 108.202 176.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.6 -33.7 64.2 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.766 1.226 . . . . 0.0 112.262 -172.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 7.6 mtt-85 -70.78 -56.81 5.52 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.352 1.061 . . . . 0.0 113.342 175.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.84 -37.08 83.79 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 120.005 1.275 . . . . 0.0 112.697 -178.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 36.1 tp -63.57 -34.76 78.52 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.424 1.89 . . . . 0.0 111.781 169.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.68 -29.4 29.57 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 126.845 2.164 . . . . 0.0 114.646 -174.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -11.24 60.26 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.126 1.463 . . . . 0.0 111.568 167.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.5 tp 73.77 133.79 0.05 OUTLIER 'General case' 0 C--N 1.347 0.482 0 C-N-CA 130.903 3.681 . . . . 0.0 106.54 -169.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 79.0 t -67.75 5.5 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 -167.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.437 ' C ' ' H ' ' B' ' 93' ' ' VAL . 2.3 tp-100 86.91 -25.18 0.1 Allowed 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.032 -1.042 . . . . 0.0 111.615 138.238 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 7.2 p -52.85 25.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.83 1 C-N-CA 134.702 5.201 . . . . 0.0 115.264 166.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . 0.437 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.2 OUTLIER 62.37 14.22 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 126.305 1.842 . . . . 0.0 113.689 171.961 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 4.7 tt 91.65 104.27 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 128.349 2.659 . . . . 0.0 108.735 -168.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.554 1.103 0 N-CA-C 115.862 1.801 . . . . 0.0 115.862 176.888 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.93 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.64 -31.27 24.77 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.951 1.3 . . . . 0.0 112.332 166.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.7 mtm105 -84.18 -32.37 24.63 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.991 1.316 . . . . 0.0 113.458 173.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -54.72 -49.75 69.99 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.834 1.254 . . . . 0.0 109.992 172.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.82 -24.92 70.25 Favored Glycine 0 N--CA 1.473 1.158 0 O-C-N 121.202 -0.937 . . . . 0.0 113.476 176.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.86 1.27 15.49 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.896 1.278 . . . . 0.0 112.336 173.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -118.41 -38.59 3.14 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.234 1.414 . . . . 0.0 111.848 167.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mp -86.18 -8.76 57.58 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -175.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -128.09 35.53 4.43 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.337 1.455 . . . . 0.0 110.698 167.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -114.59 144.42 31.81 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 127.379 2.271 . . . . 0.0 106.38 176.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -54.29 -94.41 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.791 1 C-N-CA 126.15 4.567 . . . . 0.0 114.314 -166.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.401 ' HG1' HD13 ' A' ' 46' ' ' LEU . 15.3 t -60.25 -23.86 64.42 Favored 'General case' 0 C--O 1.223 -0.342 0 O-C-N 121.375 -0.828 . . . . 0.0 111.51 175.014 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -69.73 -34.87 74.44 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.253 1.388 . . . . 0.0 113.783 -178.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.6 t -70.05 -36.82 75.28 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 121.44 1.927 . . . . 0.0 110.53 169.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.1 mtm180 -59.35 -46.98 87.14 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-O 117.65 -1.166 . . . . 0.0 112.532 172.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.1 mt -44.89 -56.88 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 CA-C-N 121.137 1.789 . . . . 0.0 110.307 172.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 94.8 mt -61.8 -41.39 97.69 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 117.702 -1.142 . . . . 0.0 111.545 -175.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.8 p -75.21 -27.76 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-N 120.793 1.633 . . . . 0.0 112.833 176.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.37 -30.26 63.18 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.423 1.489 . . . . 0.0 112.441 173.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 mp -63.44 -47.04 83.52 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.425 167.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.51 -45.89 56.81 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.112 1.765 . . . . 0.0 112.469 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -107.29 40.53 1.66 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.103 1.761 . . . . 0.0 111.102 174.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -150.56 -78.3 0.02 OUTLIER Glycine 0 C--N 1.339 0.731 0 O-C-N 120.555 -1.34 . . . . 0.0 115.267 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 27.6 m 31.37 31.01 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 C-N-CA 128.055 2.542 . . . . 0.0 117.6 -168.075 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 36.1 m -84.65 -67.66 0.78 Allowed 'General case' 0 N--CA 1.469 0.481 0 O-C-N 120.551 -1.343 . . . . 0.0 113.933 -173.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -143.64 164.03 32.83 Favored Pre-proline 0 CA--C 1.54 0.565 0 CA-C-O 118.054 -0.974 . . . . 0.0 112.541 -171.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -66.19 -25.49 50.31 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 121.99 1.794 . . . . 0.0 113.061 -169.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.16 11.34 48.14 Favored Glycine 0 CA--C 1.53 0.979 0 CA-C-O 117.913 -1.493 . . . . 0.0 114.439 173.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.572 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -64.23 -34.27 77.72 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.501 2.151 . . . . 0.0 111.126 179.826 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 46.0 mt -56.36 -21.54 25.36 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 124.901 1.28 . . . . 0.0 112.647 175.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.43 -28.4 69.78 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.189 -0.944 . . . . 0.0 112.194 -178.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.2 -57.05 3.99 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.769 0.828 . . . . 0.0 111.099 169.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.572 ' CD2' HE22 ' A' ' 39' ' ' GLN . 5.7 m-70 -53.41 -31.48 45.25 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -179.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 70.4 mt -98.09 -22.93 15.97 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.147 0.979 . . . . 0.0 113.44 -175.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.56 -0.73 48.07 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 124.787 1.184 . . . . 0.0 113.484 -169.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.401 HD13 ' HG1' ' A' ' 22' ' ' THR . 94.9 mt -97.32 149.21 22.34 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.276 1.43 . . . . 0.0 110.326 -176.285 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.7 p -66.2 152.05 45.68 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 121.233 -0.917 . . . . 0.0 110.975 -174.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -56.14 -44.05 78.86 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.495 0.718 . . . . 0.0 111.988 -178.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.6 m -64.24 -35.56 81.22 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.588 1.155 . . . . 0.0 112.782 173.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -73.89 -44.54 54.94 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 178.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 67.9 t -60.6 -30.65 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 119.409 1.004 . . . . 0.0 112.447 176.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.8 m -53.16 -38.54 62.85 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 119.825 1.193 . . . . 0.0 113.683 174.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 64.3 m-80 -58.63 -48.02 82.43 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.236 1.014 . . . . 0.0 111.718 175.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 34.6 m80 -65.79 -31.73 72.86 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.569 1.148 . . . . 0.0 112.343 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 60.1 mt -74.46 -32.48 62.61 Favored 'General case' 0 C--O 1.222 -0.395 0 C-N-CA 124.088 0.955 . . . . 0.0 112.767 169.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.3 m -61.97 -33.97 75.28 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 120.798 1.636 . . . . 0.0 115.375 -170.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 38.5 t -77.04 -34.12 57.27 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.717 1.144 . . . . 0.0 111.512 170.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.3 tp -64.14 -38.28 90.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.37 2.268 . . . . 0.0 112.271 -177.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 66.4 mtm-85 -75.23 -13.51 60.45 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.905 1.682 . . . . 0.0 113.059 174.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.89 -34.99 4.71 Favored Glycine 0 N--CA 1.473 1.153 0 C-N-CA 126.317 1.913 . . . . 0.0 113.548 175.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 56.1 m -76.51 7.69 4.24 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.422 1.489 . . . . 0.0 111.425 168.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.48 -20.03 1.78 Allowed Glycine 0 CA--C 1.533 1.171 0 C-N-CA 126.71 2.1 . . . . 0.0 116.095 175.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.3 mt -55.63 -24.99 36.54 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 127.367 2.267 . . . . 0.0 115.675 -170.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.7 m -121.64 127.53 75.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 C-N-CA 124.27 1.028 . . . . 0.0 112.937 171.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 90.4 t -115.7 132.91 63.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 125.792 1.637 . . . . 0.0 109.513 -176.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -91.13 155.17 18.83 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 122.242 1.02 . . . . 0.0 112.684 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 26.3 m -147.79 152.09 37.11 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.301 1.44 . . . . 0.0 109.001 177.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -98.98 110.48 23.08 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.051 1.34 . . . . 0.0 111.14 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -87.52 68.37 9.6 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.036 2.135 . . . . 0.0 111.177 -179.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 63.01 -1.43 1.84 Allowed Glycine 0 CA--C 1.538 1.504 0 N-CA-C 117.72 1.848 . . . . 0.0 117.72 168.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.6 mtm-85 154.7 -25.83 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 131.533 3.933 . . . . 0.0 111.363 -172.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -94.43 179.16 5.38 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 166.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 24.5 m -128.43 168.89 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 O-C-N 121.042 -1.036 . . . . 0.0 108.838 168.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -137.63 -176.11 4.3 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.777 1.631 . . . . 0.0 111.14 172.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -135.43 151.33 50.31 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.769 2.027 . . . . 0.0 109.01 169.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -152.39 151.62 31.05 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.017 1.327 . . . . 0.0 110.58 -173.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -57.3 143.77 38.36 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.568 1.147 . . . . 0.0 109.711 173.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.49 -10.75 60.0 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 116.806 2.15 . . . . 0.0 116.806 -169.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -176.17 161.59 2.36 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.235 2.214 . . . . 0.0 109.563 173.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 90.2 p -41.59 -32.76 0.38 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 128.247 2.619 . . . . 0.0 112.711 166.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -42.07 -60.71 1.34 Allowed 'General case' 0 C--N 1.343 0.291 0 C-N-CA 126.666 1.986 . . . . 0.0 112.801 168.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.37 -34.96 36.05 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -170.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.69 -38.4 69.61 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 118.62 0.645 . . . . 0.0 112.664 169.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -71.78 -63.74 1.07 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.946 0.898 . . . . 0.0 113.245 173.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.47 -25.99 67.6 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.88 -1.137 . . . . 0.0 113.548 -171.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.77 -40.47 22.58 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 123.268 0.627 . . . . 0.0 111.779 169.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.12 -60.12 5.41 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 127.059 2.266 . . . . 0.0 115.045 -176.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.6 pm0 -66.44 -21.67 66.21 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.676 1.738 . . . . 0.0 111.406 168.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.474 ' C ' ' H ' ' A' ' 91' ' ' GLN . 2.8 tt 80.38 132.68 0.06 Allowed 'General case' 0 C--N 1.343 0.294 0 C-N-CA 128.565 2.746 . . . . 0.0 112.225 166.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 29.4 m -63.29 16.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 126.797 2.039 . . . . 0.0 114.732 178.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.474 ' H ' ' C ' ' A' ' 89' ' ' LEU . 14.1 mm-40 73.22 -11.0 0.94 Allowed 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 126.365 1.866 . . . . 0.0 113.212 169.177 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 2.9 p -55.73 22.78 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 C-N-CA 129.864 3.266 . . . . 0.0 117.698 175.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.41 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.9 t 68.7 9.75 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 126.771 2.028 . . . . 0.0 112.779 166.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 95.31 110.51 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 131.09 3.756 . . . . 0.0 107.665 -168.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.3 74.75 0.05 Allowed 'General case' 0 CA--C 1.553 1.089 0 O-C-N 121.446 -0.783 . . . . 0.0 113.05 169.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.8 t -70.77 146.59 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 126.082 1.753 . . . . 0.0 111.8 174.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.69 78.8 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 128.69 2.796 . . . . 0.0 112.401 170.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 19.7 p -141.02 121.67 14.26 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.036 1.335 . . . . 0.0 112.61 -172.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -111.84 134.41 53.42 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.858 1.263 . . . . 0.0 110.041 173.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -165.11 158.62 14.23 Favored Pre-proline 0 CA--C 1.548 0.866 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 -170.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -83.16 170.32 12.22 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.972 2.448 . . . . 0.0 113.203 -172.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.6 t . . . . . 0 CA--C 1.558 1.274 0 C-N-CA 125.395 1.478 . . . . 0.0 110.205 167.144 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.458 0 N-CA-C 114.882 1.438 . . . . 0.0 114.882 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.81 -21.4 11.07 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 120.671 -1.268 . . . . 0.0 112.691 168.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 38.0 mtm105 -83.6 -46.72 12.05 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.151 1.781 . . . . 0.0 111.798 169.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -51.17 -57.89 7.58 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.913 1.685 . . . . 0.0 110.262 173.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.5 -23.71 75.2 Favored Glycine 0 C--N 1.339 0.725 0 CA-C-O 117.908 -1.495 . . . . 0.0 112.757 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 25.8 ttm105 -63.99 -49.19 73.44 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 119.792 1.796 . . . . 0.0 110.386 169.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.19 -33.85 75.33 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 120.065 1.302 . . . . 0.0 114.093 175.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 7.6 mp -84.57 -2.04 56.8 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 178.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -119.87 -12.82 9.13 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 172.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.55 157.32 27.08 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 126.347 1.859 . . . . 0.0 111.384 169.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -65.23 -99.49 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 0.992 1 C-N-CA 126.009 4.473 . . . . 0.0 111.725 -176.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.424 ' HG1' ' CD1' ' B' ' 46' ' ' LEU . 12.1 t -58.48 -25.27 62.13 Favored 'General case' 0 N--CA 1.464 0.262 0 O-C-N 120.637 -1.29 . . . . 0.0 112.469 175.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.54 -39.91 85.0 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 119.707 1.14 . . . . 0.0 112.844 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 44.0 t -66.54 -37.19 84.47 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.72 1.6 . . . . 0.0 111.008 169.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 7.2 mtm180 -61.53 -35.88 78.99 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 172.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.8 mt -52.59 -59.9 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 CA-C-N 120.334 1.425 . . . . 0.0 108.851 169.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 96.9 mt -57.24 -45.95 83.45 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.75 -171.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 5.7 p -75.06 -31.3 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.58 -30.81 57.17 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.131 0.878 . . . . 0.0 112.387 174.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 12.1 tp -64.42 -37.09 86.3 Favored 'General case' 0 C--N 1.339 0.152 0 O-C-N 120.926 -1.109 . . . . 0.0 112.768 175.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.05 -31.75 8.28 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 128.907 2.883 . . . . 0.0 114.237 175.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.84 -33.17 18.67 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.663 1.985 . . . . 0.0 113.152 174.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -99.22 -65.02 0.84 Allowed Glycine 0 C--N 1.338 0.687 0 N-CA-C 115.465 0.946 . . . . 0.0 115.465 -165.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 16.1 m 34.5 38.8 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 125.969 1.708 . . . . 0.0 114.075 -167.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 30.0 m -86.47 -86.65 0.14 Allowed 'General case' 0 C--O 1.225 -0.23 0 C-N-CA 124.028 0.931 . . . . 0.0 110.944 -176.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -133.69 162.89 54.92 Favored Pre-proline 0 CA--C 1.544 0.72 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -169.127 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -63.91 -25.53 67.21 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 122.64 2.226 . . . . 0.0 113.843 -167.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.66 7.81 50.42 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-O 117.114 -1.937 . . . . 0.0 114.918 172.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.99 -31.97 71.55 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 121.083 2.442 . . . . 0.0 111.409 -175.084 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 31.4 mt -63.13 -18.75 63.77 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 125.32 1.448 . . . . 0.0 112.215 -179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.0 -32.18 70.61 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 119.731 1.15 . . . . 0.0 112.245 177.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.62 -54.88 6.08 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.491 0.716 . . . . 0.0 111.306 170.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -53.55 -31.37 46.21 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 70.3 mt -100.55 -27.13 13.58 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.558 1.143 . . . . 0.0 112.984 -174.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.56 4.97 88.0 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 124.998 1.285 . . . . 0.0 113.27 -169.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . 0.424 ' CD1' ' HG1' ' B' ' 22' ' ' THR . 96.6 mt -105.78 150.3 25.67 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.019 1.328 . . . . 0.0 111.207 -172.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 9.5 p -64.34 149.63 47.82 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.262 -0.899 . . . . 0.0 110.402 -175.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -58.57 -35.56 72.57 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.654 0.612 . . . . 0.0 112.654 -177.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.7 m -66.82 -44.01 82.3 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.356 -0.84 . . . . 0.0 112.018 170.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -65.81 -45.31 82.81 Favored 'General case' 0 CA--C 1.548 0.884 0 O-C-N 121.162 -0.961 . . . . 0.0 112.215 177.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 94.8 t -59.59 -31.72 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 120.335 -1.478 . . . . 0.0 111.692 169.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 69.7 m -65.13 -26.99 68.43 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.02 1.282 . . . . 0.0 113.728 175.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -62.97 -55.58 24.6 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.104 0.866 . . . . 0.0 109.557 169.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 33.9 m80 -59.04 -39.86 83.29 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.594 1.158 . . . . 0.0 113.18 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 56.0 mt -66.59 -33.75 76.36 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 124.59 1.156 . . . . 0.0 112.709 172.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 59.9 m -63.7 -35.55 80.94 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 120.484 1.493 . . . . 0.0 114.293 -169.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 34.1 t -72.05 -34.69 68.95 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.597 0.635 . . . . 0.0 112.07 169.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.4 tp -68.41 -32.05 71.83 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.556 2.342 . . . . 0.0 112.581 -175.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 51.3 mtm-85 -82.09 -19.64 39.76 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.39 1.476 . . . . 0.0 112.239 171.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -88.88 -37.85 7.14 Favored Glycine 0 N--CA 1.476 1.325 0 C-N-CA 124.811 1.196 . . . . 0.0 113.398 177.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 97.0 m -81.39 15.34 2.05 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 126.332 1.853 . . . . 0.0 111.364 169.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.93 -26.3 1.16 Allowed Glycine 0 CA--C 1.534 1.259 0 C-N-CA 126.265 1.888 . . . . 0.0 116.525 172.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 21.3 mt -50.86 -29.41 11.78 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 127.664 2.386 . . . . 0.0 116.592 -168.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -118.03 122.44 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 124.915 1.286 . . . . 0.0 111.301 169.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 80.4 t -107.45 130.65 59.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 125.507 1.523 . . . . 0.0 108.656 -176.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -96.86 146.46 24.91 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 124.624 1.17 . . . . 0.0 111.395 -177.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 96.4 m -154.09 147.35 24.81 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 124.432 1.093 . . . . 0.0 109.001 -172.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -97.62 93.23 6.3 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.36 1.064 . . . . 0.0 111.719 -176.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -69.3 74.88 0.36 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.815 1.646 . . . . 0.0 114.078 173.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 63.15 -5.69 0.56 Allowed Glycine 0 N--CA 1.475 1.257 0 C-N-CA 126.808 2.147 . . . . 0.0 118.313 167.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 4.1 mtm-85 161.04 -24.98 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 130.36 3.464 . . . . 0.0 111.759 -175.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -100.6 170.4 8.39 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 166.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 11.1 m -115.1 163.32 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 119.036 0.834 . . . . 0.0 109.134 168.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 10.3 ptt-85 -129.63 172.93 11.09 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 122.2 1.0 . . . . 0.0 110.784 170.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -127.93 140.34 52.06 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 167.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -146.52 154.75 41.9 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 123.753 0.821 . . . . 0.0 110.675 -178.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 1.2 mp -57.25 142.96 41.24 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.593 0.757 . . . . 0.0 110.614 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.13 0.44 1.97 Allowed 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 118.751 2.871 . . . . 0.0 118.751 -167.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 11.8 t70 169.02 158.33 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 129.835 3.254 . . . . 0.0 109.832 173.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 88.7 p -40.58 -35.39 0.46 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.806 2.442 . . . . 0.0 112.756 167.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -38.66 -63.16 0.53 Allowed 'General case' 0 C--N 1.342 0.278 0 C-N-CA 127.242 2.217 . . . . 0.0 113.013 167.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.2 -34.16 61.49 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -170.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.17 -30.22 71.41 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.857 0.863 . . . . 0.0 112.3 177.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.8 mmt85 -71.17 -65.74 0.71 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.645 1.178 . . . . 0.0 110.905 168.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.97 -25.83 63.93 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.599 1.333 . . . . 0.0 114.599 -173.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -87.26 -34.3 18.97 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.374 -0.829 . . . . 0.0 112.647 169.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.35 -58.33 5.11 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 127.27 2.367 . . . . 0.0 113.645 -175.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 14.0 pm0 -70.21 -17.72 63.15 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 119.22 1.51 . . . . 0.0 111.165 166.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . 0.513 ' C ' ' H ' ' B' ' 91' ' ' GLN . 26.5 tp 82.07 146.44 0.08 Allowed 'General case' 0 C--N 1.343 0.321 0 C-N-CA 129.989 3.315 . . . . 0.0 112.904 167.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 5.8 m -57.34 5.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 127.513 2.325 . . . . 0.0 114.122 168.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.513 ' H ' ' C ' ' B' ' 89' ' ' LEU . 7.3 mm-40 69.0 -9.27 0.6 Allowed 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 127.111 2.164 . . . . 0.0 114.228 176.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 1.2 p -56.26 26.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 130.174 3.39 . . . . 0.0 117.765 179.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 73.05 10.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 126.672 1.989 . . . . 0.0 112.496 168.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 78.99 101.27 0.06 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 127.716 2.407 . . . . 0.0 108.986 -171.224 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.552 1.039 0 C-N-CA 125.14 1.376 . . . . 0.0 114.681 177.4 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 pp . . . . . 0 N--CA 1.471 0.593 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.44 1.26 8.29 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.372 1.469 . . . . 0.0 113.878 176.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -112.21 -21.18 11.58 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.967 1.307 . . . . 0.0 112.478 169.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.08 -59.71 4.98 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.705 1.138 . . . . 0.0 109.534 168.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.08 -27.56 72.45 Favored Glycine 0 CA--C 1.538 1.473 0 O-C-N 121.292 -0.88 . . . . 0.0 113.234 -178.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -51.93 28.7 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.287 1.035 . . . . 0.0 111.478 172.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.44 -25.11 59.22 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.125 -0.984 . . . . 0.0 112.524 -175.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.1 mp -82.83 -6.96 59.67 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 118.138 -0.934 . . . . 0.0 111.362 168.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -92.34 -35.62 13.63 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 119.995 1.271 . . . . 0.0 112.28 166.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -47.56 127.81 10.51 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 125.309 1.443 . . . . 0.0 108.697 173.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -50.06 -85.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 1 C-N-CA 127.621 5.547 . . . . 0.0 113.516 -165.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.475 ' HG1' ' CD2' ' A' ' 54' ' ' HIS . 0.9 OUTLIER -56.36 -22.24 29.78 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 126.614 1.965 . . . . 0.0 113.747 174.351 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 37.8 mtt180 -74.19 -40.69 62.34 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 120.249 1.386 . . . . 0.0 112.215 178.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 6.9 t -60.18 -48.32 82.21 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.353 0.979 . . . . 0.0 110.09 169.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -62.18 -35.84 80.06 Favored 'General case' 0 CA--C 1.556 1.178 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 176.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -55.27 -53.47 34.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 CA-C-N 120.674 1.579 . . . . 0.0 108.719 167.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 25.0 mt -63.88 -45.61 88.63 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 117.483 -1.246 . . . . 0.0 112.664 -174.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.2 m -58.27 -27.22 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 CA-C-N 120.667 1.576 . . . . 0.0 112.378 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -95.63 -18.43 20.55 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.972 0.909 . . . . 0.0 113.312 179.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.9 mt -68.72 -41.28 79.25 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 118.247 -0.883 . . . . 0.0 112.482 168.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.8 tt -29.81 -62.32 0.14 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 130.4 3.48 . . . . 0.0 113.251 -178.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -98.55 -17.5 18.65 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.746 2.018 . . . . 0.0 112.684 174.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.39 -43.16 25.76 Favored Glycine 0 C--N 1.341 0.853 0 CA-C-O 116.153 -2.471 . . . . 0.0 115.833 -168.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.6 m 4.03 48.65 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 C-N-CA 131.125 3.77 . . . . 0.0 119.798 177.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 68.7 m -104.61 -63.17 1.24 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.975 1.71 . . . . 0.0 110.424 176.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -151.26 149.14 23.91 Favored Pre-proline 0 N--CA 1.474 0.762 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -173.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -55.99 -44.44 47.06 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 121.756 1.638 . . . . 0.0 111.082 175.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -69.04 -5.06 45.56 Favored Glycine 0 CA--C 1.535 1.288 0 CA-C-O 118.276 -1.291 . . . . 0.0 114.678 177.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.464 ' C ' ' H ' ' A' ' 41' ' ' ALA . 3.9 pt20 -69.91 -34.97 74.19 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 118.965 1.382 . . . . 0.0 111.383 173.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.8 mt -64.56 -3.2 2.88 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 118.43 0.559 . . . . 0.0 111.9 -177.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.464 ' H ' ' C ' ' A' ' 39' ' ' GLN . . . -65.96 -44.3 85.41 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.724 -0.61 . . . . 0.0 110.264 172.49 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.58 -38.55 70.92 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.821 0.849 . . . . 0.0 111.813 173.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -62.9 -20.03 64.77 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 75.5 mt -121.24 -19.37 7.1 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.996 1.718 . . . . 0.0 114.285 -172.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.49 17.29 78.95 Favored Glycine 0 CA--C 1.535 1.289 0 CA-C-N 118.673 0.669 . . . . 0.0 112.438 -168.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 87.1 mt -111.09 157.3 20.15 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.693 1.246 . . . . 0.0 112.749 -173.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.3 t -62.97 147.47 50.45 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.466 -0.771 . . . . 0.0 109.904 168.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 19.3 ptt-85 -61.58 -13.63 23.38 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 174.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.6 m -66.7 -51.18 58.99 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.033 -1.042 . . . . 0.0 111.71 169.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -65.14 -44.92 87.05 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.036 0.935 . . . . 0.0 110.142 177.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.0 t -52.72 -48.38 49.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.266 171.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 66.5 m -60.84 -39.58 89.62 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 118.954 0.797 . . . . 0.0 112.487 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -57.89 -44.54 86.8 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.074 0.949 . . . . 0.0 111.858 173.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.475 ' CD2' ' HG1' ' A' ' 22' ' ' THR . 23.0 m170 -61.73 -41.59 97.84 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 120.895 -1.128 . . . . 0.0 112.149 172.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 54.8 mt -75.09 -20.5 59.46 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.2 t -49.81 -51.64 38.23 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.889 1.276 . . . . 0.0 113.508 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 40.0 t -77.87 -39.8 42.13 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.574 0.75 . . . . 0.0 111.904 175.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.7 tp -55.58 -36.61 67.07 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.456 1.503 . . . . 0.0 112.302 -176.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.423 ' HD3' ' CE2' ' A' ' 75' ' ' TYR . 69.0 mtm180 -74.13 -40.23 62.78 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 173.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.43 -39.03 31.7 Favored Glycine 0 N--CA 1.467 0.733 0 C-N-CA 123.798 0.713 . . . . 0.0 112.122 -170.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 67.6 m -81.18 12.33 3.55 Favored 'General case' 0 CA--C 1.562 1.417 0 C-N-CA 126.206 1.802 . . . . 0.0 112.315 171.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.88 -12.08 54.55 Favored Glycine 0 N--CA 1.473 1.133 0 C-N-CA 128.574 2.988 . . . . 0.0 118.946 167.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.7 mt -58.59 -29.82 66.73 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.45 1.5 . . . . 0.0 114.815 -175.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.6 m -132.0 132.33 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.7 t -118.85 135.23 59.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 127.871 2.468 . . . . 0.0 110.883 -168.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.68 126.55 31.42 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.29 0.636 . . . . 0.0 111.845 175.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -141.67 156.45 45.64 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.413 1.085 . . . . 0.0 109.395 174.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.35 124.43 28.41 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.55 1.068 . . . . 0.0 110.112 168.16 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.0 -32.57 57.3 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 121.28 -0.888 . . . . 0.0 112.758 173.488 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 166.33 -17.92 0.09 OUTLIER Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.569 1.557 . . . . 0.0 115.246 174.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.96 -16.65 0.26 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.16 2.184 . . . . 0.0 113.584 177.294 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.04 173.98 10.98 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.659 1.984 . . . . 0.0 109.729 175.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 8.4 p -81.26 136.95 22.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 C-N-CA 124.315 1.046 . . . . 0.0 111.072 169.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -110.24 160.4 16.55 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 126.553 1.941 . . . . 0.0 109.648 169.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.423 ' CE2' ' HD3' ' A' ' 59' ' ' ARG . 3.4 m-30 -107.99 100.76 10.08 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 107.027 -1.471 . . . . 0.0 107.027 170.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -93.61 142.15 27.67 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.32 1.048 . . . . 0.0 110.055 179.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 8.6 mt -55.33 153.19 7.46 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.667 0.787 . . . . 0.0 112.049 171.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.85 -32.89 66.25 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 115.054 1.502 . . . . 0.0 115.054 -169.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -167.35 161.69 14.31 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 125.071 1.348 . . . . 0.0 109.718 -175.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 68.6 m -48.35 -32.59 7.7 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.363 1.065 . . . . 0.0 112.332 168.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -47.84 -52.78 17.79 Favored 'General case' 0 C--N 1.345 0.397 0 C-N-CA 125.614 1.565 . . . . 0.0 112.829 171.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.3 mt -76.03 -46.08 31.13 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 117.926 -1.035 . . . . 0.0 108.808 -173.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.52 -33.69 46.38 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 172.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 -68.01 -67.36 0.47 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.982 1.713 . . . . 0.0 112.327 173.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.94 -30.14 71.25 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.74 1.155 . . . . 0.0 113.276 -174.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 47.1 tp -65.56 -38.82 90.65 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.249 1.42 . . . . 0.0 110.905 169.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.02 -51.52 6.89 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 128.548 2.975 . . . . 0.0 115.091 -175.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -71.53 -2.49 17.07 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.43 1.615 . . . . 0.0 113.23 172.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 32.9 tp 69.84 110.62 0.05 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 128.605 2.762 . . . . 0.0 113.288 167.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 29.5 m -64.9 17.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 127.097 2.159 . . . . 0.0 116.376 -169.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.449 ' C ' ' H ' ' A' ' 93' ' ' VAL . 43.1 mm-40 75.55 -11.01 1.16 Allowed 'General case' 0 C--O 1.216 -0.676 0 O-C-N 120.525 -1.359 . . . . 0.0 113.277 158.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.3 p -70.74 40.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 126.769 2.028 . . . . 0.0 111.271 166.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.449 ' H ' ' C ' ' A' ' 91' ' ' GLN . 2.2 t 72.0 -33.49 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 130.82 3.648 . . . . 0.0 114.657 176.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 51.4 tp 128.91 94.08 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.66 1 C-N-CA 132.044 4.138 . . . . 0.0 105.792 -166.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.14 138.61 37.65 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -174.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 25.5 t -114.0 154.26 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 126.556 1.943 . . . . 0.0 108.917 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.8 -4.76 0.49 Allowed 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 127.205 2.202 . . . . 0.0 114.885 173.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.1 p -84.73 109.85 18.35 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.857 1.663 . . . . 0.0 113.254 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -89.61 157.95 17.82 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.194 0.998 . . . . 0.0 108.89 166.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -160.21 147.34 12.42 Favored Pre-proline 0 CA--C 1.556 1.19 0 CA-C-O 117.365 -1.303 . . . . 0.0 109.362 -169.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -38.77 146.84 0.14 Allowed 'Trans proline' 0 C--N 1.357 1.017 1 C-N-CA 127.111 5.208 . . . . 0.0 121.349 -166.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.548 0.885 0 CA-C-O 123.021 1.391 . . . . 0.0 108.645 168.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . 0.272 1.8 pp . . . . . 0 N--CA 1.479 0.994 0 N-CA-C 117.248 2.314 . . . . 0.0 117.248 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.38 -23.63 63.76 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 120.398 1.454 . . . . 0.0 112.731 178.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -20.44 61.4 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 116.626 -1.654 . . . . 0.0 112.055 172.204 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.58 -67.77 0.3 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 120.778 1.626 . . . . 0.0 108.589 170.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -57.63 -38.7 88.96 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-O 119.512 -0.604 . . . . 0.0 112.721 -175.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -62.47 -50.99 69.25 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 118.105 0.952 . . . . 0.0 112.669 173.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.27 -11.71 60.83 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.364 0.983 . . . . 0.0 113.37 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.3 mp -96.42 -14.2 22.61 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.34 1.056 . . . . 0.0 112.145 168.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.95 -13.86 56.9 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.397 1.079 . . . . 0.0 112.282 166.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -79.98 133.05 58.65 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 128.414 2.686 . . . . 0.0 108.927 -177.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . 0.402 ' HG2' ' H ' ' B' ' 22' ' ' THR . 61.4 Cg_endo -52.88 -84.7 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.614 1 C-N-CA 126.819 5.013 . . . . 0.0 113.297 -167.845 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.455 ' HG1' ' CD2' ' B' ' 54' ' ' HIS . 0.8 OUTLIER -63.03 -23.29 67.38 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 126.251 1.821 . . . . 0.0 112.508 179.868 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 47.0 mtt85 -73.84 -43.44 58.7 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 120.248 1.385 . . . . 0.0 112.663 176.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 4.5 t -58.32 -44.87 88.83 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.918 1.235 . . . . 0.0 110.023 170.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 19.5 tpt180 -61.31 -33.86 74.28 Favored 'General case' 0 CA--C 1.559 1.301 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 172.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -63.83 -52.15 60.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 O-C-N 119.601 -1.937 . . . . 0.0 108.957 168.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 88.5 mt -59.47 -44.7 92.96 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 117.674 -1.155 . . . . 0.0 112.437 -177.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 3.8 m -59.32 -23.89 26.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 CA-C-N 120.427 1.467 . . . . 0.0 112.734 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -98.92 -8.18 25.97 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.4 1.08 . . . . 0.0 112.784 -179.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.8 mt -87.14 -25.17 24.23 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.005 1.322 . . . . 0.0 112.932 168.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.2 -30.17 10.93 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 127.991 2.516 . . . . 0.0 111.676 166.144 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -131.0 -37.72 1.27 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.436 1.894 . . . . 0.0 115.447 -170.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.26 -63.23 3.01 Favored Glycine 0 C--N 1.343 0.963 0 C-N-CA 125.022 1.296 . . . . 0.0 114.688 -165.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 4.3 m 41.01 36.2 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 173.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 60.0 m -98.76 -76.37 0.54 Allowed 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 125.587 1.555 . . . . 0.0 112.198 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -143.08 153.29 60.02 Favored Pre-proline 0 N--CA 1.478 0.933 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 -169.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -54.41 -35.52 84.89 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.253 2.635 . . . . 0.0 112.64 178.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -80.41 -8.84 87.17 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-O 117.849 -1.528 . . . . 0.0 115.102 175.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.17 -32.35 73.74 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 120.627 2.213 . . . . 0.0 112.879 -171.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 5.2 mt -67.71 -7.87 30.63 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 118.543 0.611 . . . . 0.0 111.634 -178.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.51 -39.15 89.97 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.299 -0.875 . . . . 0.0 111.162 169.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.81 -44.22 33.44 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.295 1.038 . . . . 0.0 112.187 175.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 25.6 m-70 -57.45 -25.04 59.08 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 178.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 66.5 mt -115.21 -19.71 10.69 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.374 1.87 . . . . 0.0 114.251 -173.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.89 17.9 77.22 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-N 119.137 0.881 . . . . 0.0 113.065 -169.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 85.9 mt -110.27 162.05 15.0 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.563 1.182 . . . . 0.0 112.889 -174.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.9 t -68.67 148.91 49.74 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.123 -0.986 . . . . 0.0 110.092 168.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 22.8 ptt-85 -60.29 -15.34 24.26 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 174.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 1.8 m -67.35 -50.79 58.44 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.986 -1.071 . . . . 0.0 111.68 169.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -65.92 -43.22 88.79 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.68 0.792 . . . . 0.0 110.398 176.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 16.6 t -54.6 -44.39 69.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 O-C-N 121.588 -0.695 . . . . 0.0 112.074 171.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.1 m -62.3 -39.91 94.57 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.51 1.05 . . . . 0.0 112.802 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -55.78 -44.8 78.09 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.45 1.1 . . . . 0.0 111.487 172.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . 0.455 ' CD2' ' HG1' ' B' ' 22' ' ' THR . 22.2 m80 -63.27 -40.6 97.86 Favored 'General case' 0 CA--C 1.549 0.906 0 O-C-N 121.179 -0.95 . . . . 0.0 112.305 172.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 82.7 mt -73.83 -28.36 61.57 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -176.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 68.1 m -50.68 -53.39 31.54 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 120.798 1.636 . . . . 0.0 113.785 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 36.2 t -68.87 -42.85 76.47 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 118.551 0.614 . . . . 0.0 112.525 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 mp -49.0 -41.88 35.96 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.552 1.941 . . . . 0.0 114.287 174.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 85.7 mtm180 -91.4 -20.85 21.36 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -177.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -86.52 -45.72 5.44 Favored Glycine 0 N--CA 1.472 1.054 0 CA-C-N 119.921 1.237 . . . . 0.0 112.122 176.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 84.8 m -74.29 9.08 1.81 Allowed 'General case' 0 CA--C 1.561 1.399 0 C-N-CA 126.083 1.753 . . . . 0.0 113.612 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 84.81 -5.67 81.3 Favored Glycine 0 C--N 1.341 0.853 0 C-N-CA 128.797 3.094 . . . . 0.0 116.713 168.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 12.0 mt -64.26 -22.56 66.99 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 119.007 1.404 . . . . 0.0 114.6 -173.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 31.9 t -137.91 134.8 45.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 125.533 1.533 . . . . 0.0 112.284 -171.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 15.7 t -118.6 132.62 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 126.843 2.057 . . . . 0.0 111.281 -169.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -82.36 129.93 34.99 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.878 0.871 . . . . 0.0 110.8 169.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.01 159.76 42.03 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.111 0.964 . . . . 0.0 110.42 174.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.38 128.74 34.17 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.457 0.571 . . . . 0.0 109.912 166.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.65 -28.65 30.54 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.443 -0.786 . . . . 0.0 112.731 170.005 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 159.77 -39.79 0.47 Allowed Glycine 0 CA--C 1.531 1.038 0 C-N-CA 124.556 1.074 . . . . 0.0 115.005 172.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.31 -19.23 11.34 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.689 1.596 . . . . 0.0 113.103 172.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.85 171.74 13.8 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.485 1.914 . . . . 0.0 110.588 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 7.1 p -80.68 152.4 4.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 C-N-CA 124.328 1.051 . . . . 0.0 109.682 168.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 22.0 ptt180 -132.04 173.96 10.68 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.52 2.328 . . . . 0.0 110.749 177.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -120.09 120.93 37.67 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.643 166.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -109.87 164.04 12.96 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.159 1.384 . . . . 0.0 109.165 172.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 64.8 mt -70.02 166.35 19.91 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.725 -0.609 . . . . 0.0 111.018 172.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.8 -48.88 66.59 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 -177.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -161.99 164.66 28.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.988 2.115 . . . . 0.0 109.377 -171.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 73.2 m -51.53 -26.83 9.21 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.918 0.887 . . . . 0.0 112.58 168.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -52.26 -58.38 6.82 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 125.024 1.329 . . . . 0.0 112.292 170.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 8.9 mt -70.22 -42.62 72.03 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.563 1.074 . . . . 0.0 109.774 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.25 -35.77 50.69 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.242 1.017 . . . . 0.0 113.237 173.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 -67.01 -64.66 0.81 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.704 1.201 . . . . 0.0 112.337 175.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.63 -17.97 64.98 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 -176.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 43.0 tp -82.58 -30.94 29.26 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 127.104 2.162 . . . . 0.0 112.352 169.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -87.23 -59.71 1.73 Allowed Glycine 0 N--CA 1.473 1.102 0 C-N-CA 128.776 3.084 . . . . 0.0 114.252 -172.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -71.81 -16.57 62.18 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 119.045 1.422 . . . . 0.0 110.708 167.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . 0.496 ' C ' ' H ' ' B' ' 91' ' ' GLN . 23.5 tp 78.24 147.79 0.09 Allowed 'General case' 0 C--N 1.343 0.312 0 C-N-CA 129.16 2.984 . . . . 0.0 114.488 165.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 15.6 m -59.05 10.39 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 127.366 2.266 . . . . 0.0 114.46 168.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.496 ' H ' ' C ' ' B' ' 89' ' ' LEU . 8.6 mm-40 70.57 -17.2 0.29 Allowed 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 127.083 2.153 . . . . 0.0 115.571 172.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 2.5 p -59.06 31.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 C-N-CA 130.622 3.569 . . . . 0.0 116.803 -178.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.4 t 69.77 12.96 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 127.702 2.401 . . . . 0.0 113.086 168.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 46.6 tp 84.06 104.41 0.05 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 129.285 3.034 . . . . 0.0 108.743 -169.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.831 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.165 168.979 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 pp . . . . . 0 N--CA 1.475 0.776 0 N-CA-C 113.747 1.018 . . . . 0.0 113.747 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.34 -20.76 66.54 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.973 0.909 . . . . 0.0 113.111 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.8 mmt180 -87.77 -43.03 12.18 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.141 0.977 . . . . 0.0 110.564 173.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -59.17 -43.34 92.11 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.55 1.14 . . . . 0.0 112.095 -178.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -56.13 -30.98 58.6 Favored Glycine 0 CA--C 1.533 1.205 0 CA-C-N 118.963 0.801 . . . . 0.0 112.586 176.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.6 ttp85 -90.69 -13.77 33.53 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 174.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.1 -30.05 62.15 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 121.033 1.742 . . . . 0.0 111.108 169.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.8 mp -81.96 -45.89 14.76 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.137 0.975 . . . . 0.0 110.298 169.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.19 64.98 5.19 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-O 122.459 1.123 . . . . 0.0 112.874 170.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -136.55 138.52 26.84 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 128.876 2.87 . . . . 0.0 109.523 -177.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -52.18 -89.26 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.807 1 C-N-CA 126.22 4.614 . . . . 0.0 114.159 -168.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 m -67.72 -24.22 65.35 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.833 0.853 . . . . 0.0 110.734 -177.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.9 ttm105 -74.74 -37.82 62.42 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.849 1.204 . . . . 0.0 112.601 -177.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 14.0 t -55.75 -46.48 77.82 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 120.126 1.33 . . . . 0.0 109.982 166.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 58.0 mmt-85 -58.95 -44.7 91.51 Favored 'General case' 0 C--O 1.217 -0.652 0 CA-C-O 117.801 -1.095 . . . . 0.0 112.809 174.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mm -53.26 -48.93 54.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 CA-C-N 120.867 1.667 . . . . 0.0 110.763 173.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 89.3 mt -61.88 -42.39 99.01 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 118.538 -0.744 . . . . 0.0 111.44 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -77.19 -26.26 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -179.2 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.82 -31.67 59.49 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.289 1.436 . . . . 0.0 111.056 173.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 tp -65.1 -45.11 86.54 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 116.567 -1.682 . . . . 0.0 111.882 169.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 mt -47.59 -45.3 27.2 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.58 1.952 . . . . 0.0 113.677 -178.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -98.3 -1.81 40.95 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 125.97 1.708 . . . . 0.0 113.193 177.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -107.7 -76.52 0.98 Allowed Glycine 0 C--N 1.341 0.85 0 C-N-CA 126.561 2.029 . . . . 0.0 113.636 -174.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.2 m 36.45 34.7 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 C-N-CA 127.576 2.351 . . . . 0.0 115.362 -169.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.56 -62.33 1.61 Allowed 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.247 -0.908 . . . . 0.0 112.814 -172.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -164.63 155.89 13.34 Favored Pre-proline 0 N--CA 1.476 0.835 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -169.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -57.79 129.88 35.72 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.075 1.85 . . . . 0.0 108.682 169.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.17 -2.67 83.77 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 117.486 -1.73 . . . . 0.0 114.312 -173.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.549 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -60.86 -36.08 78.26 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 120.828 2.314 . . . . 0.0 110.323 169.96 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.96 -19.67 63.02 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.601 1.161 . . . . 0.0 112.221 179.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.59 -25.58 68.3 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 118.393 0.542 . . . . 0.0 111.839 178.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.08 -54.76 5.48 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.98 0.912 . . . . 0.0 111.377 169.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.549 ' CD2' HE22 ' A' ' 39' ' ' GLN . 5.4 m-70 -55.01 -26.38 36.65 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 57.0 mt -108.39 -12.79 14.98 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.26 1.424 . . . . 0.0 113.432 -176.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.45 6.11 32.82 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 124.202 0.906 . . . . 0.0 113.935 -171.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 57.5 mt -108.1 138.8 43.75 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.399 1.08 . . . . 0.0 111.39 -169.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.7 t -60.37 151.63 27.4 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.654 0.74 . . . . 0.0 112.324 -173.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -50.53 -35.91 31.76 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.374 1.469 . . . . 0.0 113.484 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.03 -45.74 80.37 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.373 1.069 . . . . 0.0 111.944 175.077 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -66.55 -45.5 79.19 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.36 -0.837 . . . . 0.0 111.569 175.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.6 t -63.39 -28.6 45.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 O-C-N 120.748 -1.22 . . . . 0.0 112.153 175.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.8 m -63.51 -41.53 98.51 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.007 0.821 . . . . 0.0 112.726 171.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -59.48 -34.03 72.06 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.912 0.885 . . . . 0.0 112.463 172.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -70.69 -45.75 64.42 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 121.105 -0.997 . . . . 0.0 112.849 172.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 83.2 mt -69.76 -18.58 63.51 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.312 1.445 . . . . 0.0 113.81 176.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 t -57.2 -55.56 33.13 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.97 1.259 . . . . 0.0 111.303 -178.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 16.0 t -69.6 -34.63 74.37 Favored 'General case' 0 C--O 1.219 -0.537 0 O-C-N 121.749 -0.594 . . . . 0.0 111.858 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.3 tp -64.76 -37.36 87.35 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.994 0.918 . . . . 0.0 112.514 -176.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 88.5 mtm180 -85.16 -30.4 23.97 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.884 1.273 . . . . 0.0 110.979 175.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.61 -44.55 81.78 Favored Glycine 0 N--CA 1.474 1.195 0 C-N-CA 123.915 0.769 . . . . 0.0 112.532 176.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 20.6 m -72.95 -10.2 59.55 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.376 1.47 . . . . 0.0 112.816 169.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.71 2.59 61.12 Favored Glycine 0 CA--C 1.533 1.187 0 O-C-N 120.531 -1.356 . . . . 0.0 115.127 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.5 mt -53.94 -25.94 23.0 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 120.092 1.946 . . . . 0.0 113.391 173.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.9 m -124.47 141.92 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.833 1.653 . . . . 0.0 113.881 169.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 65.6 t -133.92 137.8 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 126.186 1.795 . . . . 0.0 110.508 -175.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -91.28 154.43 19.26 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 174.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.8 m -143.06 135.34 27.26 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.332 1.853 . . . . 0.0 110.065 -173.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -79.63 105.36 10.87 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.827 0.851 . . . . 0.0 112.333 169.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -83.59 174.34 10.64 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.555 1.142 . . . . 0.0 110.76 167.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -69.57 24.16 0.38 Allowed Glycine 0 N--CA 1.481 1.649 0 N-CA-C 117.891 1.916 . . . . 0.0 117.891 -168.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.82 -14.04 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 128.174 2.59 . . . . 0.0 113.913 179.024 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -140.77 171.37 14.19 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 126.777 2.031 . . . . 0.0 108.191 -175.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 34.2 m -118.06 148.14 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 123.581 0.752 . . . . 0.0 109.004 170.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.2 ptt85 -117.21 -178.73 3.52 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.319 0.648 . . . . 0.0 112.499 174.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -131.34 131.23 43.59 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.068 1.747 . . . . 0.0 106.886 166.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.88 163.73 25.7 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.673 1.589 . . . . 0.0 110.284 176.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.8 mp -59.3 146.25 40.23 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.763 0.825 . . . . 0.0 109.564 169.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -47.64 -40.86 20.76 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.808 1.243 . . . . 0.0 114.048 -178.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -167.92 167.24 12.97 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.737 1.615 . . . . 0.0 111.401 176.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -35.61 -35.79 0.06 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 130.399 3.479 . . . . 0.0 112.228 165.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -44.05 -61.23 1.54 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 126.587 1.955 . . . . 0.0 113.059 169.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.6 mt -74.75 -29.85 61.28 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.345 0.975 . . . . 0.0 110.24 -176.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.54 -26.83 68.88 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.633 -1.175 . . . . 0.0 111.69 178.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -67.67 -71.78 0.19 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 120.117 1.326 . . . . 0.0 111.688 172.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.48 -41.79 90.58 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.451 1.023 . . . . 0.0 112.262 -169.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.94 -35.42 74.52 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.846 1.259 . . . . 0.0 111.745 175.03 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.42 -45.6 94.57 Favored Glycine 0 CA--C 1.527 0.837 0 C-N-CA 126.064 1.792 . . . . 0.0 113.571 173.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . 0.328 16.4 pt-20 -85.25 21.12 1.78 Allowed 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.629 1.172 . . . . 0.0 112.953 169.655 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 33.9 tp 77.75 -43.71 0.4 Allowed 'General case' 0 N--CA 1.474 0.769 1 C-N-CA 131.856 4.062 . . . . 0.0 113.986 166.512 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.365 5.2 t 145.3 5.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.286 1 C-N-CA 134.787 5.235 . . . . 0.0 110.412 168.966 . . . . . . . . 3 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 87.47 -25.34 0.09 Allowed 'General case' 0 C--O 1.217 -0.658 0 O-C-N 120.119 -1.613 . . . . 0.0 111.115 137.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.32 48.1 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 130.391 3.476 . . . . 0.0 111.217 166.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER 68.54 -32.68 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 131.635 3.974 . . . . 0.0 115.145 175.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 50.1 tp 132.86 86.36 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.108 1 C-N-CA 132.417 4.287 . . . . 0.0 106.851 -167.57 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.22 16.22 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 118.708 2.855 . . . . 0.0 118.708 -168.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER 68.7 128.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 129.785 3.234 . . . . 0.0 114.508 176.2 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -72.8 2.52 6.54 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 127.333 2.253 . . . . 0.0 114.09 173.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 34.6 p -80.67 170.89 15.72 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.856 1.662 . . . . 0.0 111.446 172.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -134.61 126.69 29.7 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 165.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 48.1 mm-40 -151.05 170.06 8.35 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 126.968 2.107 . . . . 0.0 108.696 -167.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -73.6 -171.77 0.92 Allowed 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.657 2.238 . . . . 0.0 109.534 166.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 51.7 t . . . . . 0 CA--C 1.545 0.781 0 CA-C-O 123.352 1.548 . . . . 0.0 113.028 -177.945 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 pp . . . . . 0 N--CA 1.473 0.702 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.62 -25.55 68.01 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.398 1.079 . . . . 0.0 113.082 -178.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 15.9 mmt180 -84.0 -41.75 16.93 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.736 0.814 . . . . 0.0 110.498 176.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -57.95 -48.53 79.68 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.326 0.65 . . . . 0.0 111.523 177.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.75 -28.2 62.68 Favored Glycine 0 CA--C 1.533 1.165 0 CA-C-N 119.005 0.821 . . . . 0.0 113.046 -178.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -87.22 -21.53 25.79 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-O 118.028 -0.987 . . . . 0.0 113.651 171.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.45 -29.28 64.68 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 121.584 1.993 . . . . 0.0 112.205 172.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.2 mp -84.11 -44.74 13.73 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 118.089 -0.958 . . . . 0.0 110.489 169.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.68 66.68 5.23 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-O 122.804 1.288 . . . . 0.0 111.467 169.209 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -136.15 139.74 30.95 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 128.318 2.647 . . . . 0.0 109.242 -175.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . 0.404 ' HG2' ' H ' ' B' ' 22' ' ' THR . 56.0 Cg_endo -55.23 -79.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 125.179 3.92 . . . . 0.0 111.811 -171.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.404 ' H ' ' HG2' ' B' ' 21' ' ' PRO . 0.2 OUTLIER -68.88 -30.84 69.43 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 117.355 -1.307 . . . . 0.0 111.486 -178.046 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 64.5 mtt85 -72.95 -37.35 67.15 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 121.299 1.863 . . . . 0.0 112.715 -177.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 36.5 t -54.3 -48.69 71.0 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 121.438 1.926 . . . . 0.0 110.301 168.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 73.8 mmt-85 -58.59 -54.12 50.68 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.022 0.929 . . . . 0.0 112.949 175.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mm -49.78 -50.21 18.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 C-N-CA 125.939 1.696 . . . . 0.0 111.67 172.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 96.3 mt -65.56 -41.61 92.78 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.597 -175.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 p -78.08 -28.4 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 CA-C-N 119.102 0.865 . . . . 0.0 112.562 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.72 -31.73 69.9 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.494 1.118 . . . . 0.0 111.627 170.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 3.6 tp -63.58 -45.51 90.12 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 117.087 -1.435 . . . . 0.0 112.466 169.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.1 mt -47.63 -45.62 27.93 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 127.311 2.244 . . . . 0.0 113.856 -176.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -106.9 18.1 22.26 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 126.171 1.789 . . . . 0.0 112.317 179.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.67 -75.07 0.23 Allowed Glycine 0 N--CA 1.47 0.937 0 C-N-CA 125.94 1.734 . . . . 0.0 113.554 -175.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . 0.556 ' HB ' ' HE ' ' B' ' 74' ' ' ARG . 26.7 m 36.71 34.61 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 127.047 2.139 . . . . 0.0 116.477 -171.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.6 -59.58 2.39 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 -171.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 7.7 p90 -165.89 156.59 11.68 Favored Pre-proline 0 N--CA 1.473 0.684 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -170.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -57.51 129.97 36.57 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.209 1.939 . . . . 0.0 108.684 169.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.98 -0.83 81.94 Favored Glycine 0 CA--C 1.532 1.103 0 CA-C-O 117.252 -1.86 . . . . 0.0 114.559 -173.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . 0.597 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -61.1 -37.56 83.17 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 121.045 2.422 . . . . 0.0 109.818 169.546 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mt -60.59 -21.07 62.22 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 124.673 1.189 . . . . 0.0 111.948 179.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.75 -27.59 69.3 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.787 -0.57 . . . . 0.0 112.149 178.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.23 -52.53 7.62 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.177 0.991 . . . . 0.0 111.474 170.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . 0.597 ' CD2' HE22 ' B' ' 39' ' ' GLN . 2.6 m-70 -54.88 -27.55 43.64 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 179.44 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 53.1 mt -108.29 -14.92 14.59 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.967 1.307 . . . . 0.0 113.961 -174.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.57 5.26 49.67 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.309 0.957 . . . . 0.0 114.107 -170.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 75.7 mt -105.03 137.51 42.67 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.653 1.181 . . . . 0.0 111.309 -171.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 12.6 t -60.84 152.03 28.3 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.513 -0.742 . . . . 0.0 112.16 -173.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -50.45 -42.68 54.5 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.983 1.313 . . . . 0.0 112.81 -178.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 1.5 m -64.3 -38.95 92.85 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.138 -0.977 . . . . 0.0 112.547 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -70.48 -45.83 64.92 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.256 0.623 . . . . 0.0 111.308 174.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.2 t -63.13 -31.23 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 O-C-N 120.981 -1.075 . . . . 0.0 111.694 176.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 39.2 m -56.67 -44.39 81.36 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.956 1.253 . . . . 0.0 113.056 169.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -60.74 -28.13 68.46 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.228 0.922 . . . . 0.0 112.869 176.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -78.52 -41.76 31.38 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.878 -1.139 . . . . 0.0 112.616 173.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 89.5 mt -72.28 -17.64 61.86 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.747 1.219 . . . . 0.0 114.064 174.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.3 t -58.97 -58.54 8.18 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.449 1.022 . . . . 0.0 111.601 -177.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 9.1 t -64.59 -39.27 93.43 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.714 -0.616 . . . . 0.0 111.415 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 tp -55.8 -48.43 75.4 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.917 2.487 . . . . 0.0 113.1 -177.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -80.5 -12.53 59.53 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.118 0.967 . . . . 0.0 111.859 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -82.36 -47.05 6.23 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.205 0.907 . . . . 0.0 111.307 169.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 59.8 m -67.95 -3.26 9.37 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 127.358 2.263 . . . . 0.0 114.414 174.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 62.47 22.82 64.04 Favored Glycine 0 N--CA 1.471 0.999 0 CA-C-N 119.852 1.205 . . . . 0.0 114.006 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 85.1 mt -69.5 -24.32 63.74 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.188 1.494 . . . . 0.0 112.761 171.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 1.5 m -146.82 140.57 20.12 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 C-N-CA 126.223 1.809 . . . . 0.0 111.328 -169.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 9.3 t -138.25 140.64 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 O-C-N 124.115 0.884 . . . . 0.0 110.22 -169.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.94 147.74 26.1 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.852 1.261 . . . . 0.0 113.261 174.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 45.4 m -138.15 135.55 35.81 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.892 1.677 . . . . 0.0 109.544 -177.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -79.26 120.83 24.29 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 123.977 0.798 . . . . 0.0 110.525 168.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -106.05 173.73 6.19 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.003 1.721 . . . . 0.0 109.5 175.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -68.36 23.79 0.27 Allowed Glycine 0 N--CA 1.481 1.649 0 N-CA-C 118.366 2.107 . . . . 0.0 118.366 -168.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 170.15 -9.61 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 128.929 2.891 . . . . 0.0 114.076 177.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -142.77 172.89 12.08 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.169 1.788 . . . . 0.0 108.524 -177.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 35.6 m -116.39 148.02 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 169.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . 0.556 ' HE ' ' HB ' ' B' ' 34' ' ' VAL . 0.0 OUTLIER -122.38 -179.32 4.15 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.541 0.686 . . . . 0.0 111.871 178.558 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -128.88 136.27 50.2 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 166.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -134.6 161.59 34.67 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 124.6 1.16 . . . . 0.0 109.445 177.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.27 148.89 49.19 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 167.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.96 -27.97 69.2 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 115.873 1.805 . . . . 0.0 115.873 -169.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -172.94 162.42 4.69 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.234 1.813 . . . . 0.0 112.286 177.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.3 m -33.84 -38.57 0.06 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 129.524 3.13 . . . . 0.0 112.885 164.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -50.06 -58.15 6.12 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.588 1.955 . . . . 0.0 113.161 173.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 14.3 mt -72.66 -38.15 67.72 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.878 -1.139 . . . . 0.0 110.668 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -56.18 -31.37 63.35 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.975 1.31 . . . . 0.0 112.999 176.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -66.89 -66.24 0.58 Allowed 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 120.25 1.386 . . . . 0.0 111.5 171.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.48 -41.33 76.41 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.146 0.979 . . . . 0.0 112.527 -173.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -78.12 -32.47 50.46 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.27 1.828 . . . . 0.0 111.717 176.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.91 -45.59 91.99 Favored Glycine 0 N--CA 1.469 0.849 0 C-N-CA 125.637 1.589 . . . . 0.0 112.205 177.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . 0.313 19.6 pt-20 -92.05 20.0 6.26 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 167.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 24.8 tp 70.79 -42.87 0.54 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 131.057 3.743 . . . . 0.0 115.692 167.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.6 m 168.38 -21.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.956 1 C-N-CA 131.928 4.091 . . . . 0.0 110.581 -171.372 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 71.04 -15.73 0.39 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.454 2.302 . . . . 0.0 114.276 174.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 3.6 p -59.21 37.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 129.408 3.083 . . . . 0.0 115.51 170.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 80.38 -24.6 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 C-N-CA 127.909 2.484 . . . . 0.0 112.682 175.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 56.0 tp 117.05 95.04 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 131.347 3.859 . . . . 0.0 105.919 -167.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.665 0 O-C-N 121.422 -0.799 . . . . 0.0 108.891 171.801 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 25.9 tp . . . . . 0 N--CA 1.474 0.746 0 CA-C-O 120.253 0.073 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.81 -3.51 12.68 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 66.5 mtt-85 -124.46 -38.44 2.41 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.06 1.344 . . . . 0.0 111.265 178.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -50.9 -58.2 6.59 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.784 1.633 . . . . 0.0 107.941 166.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.12 -22.7 77.39 Favored Glycine 0 C--O 1.218 -0.856 0 CA-C-O 118.392 -1.227 . . . . 0.0 111.627 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.403 ' HG3' HH11 ' A' ' 16' ' ' ARG . 2.6 ttm-85 -68.75 -39.31 80.38 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 119.514 1.657 . . . . 0.0 111.688 171.57 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.88 -35.3 79.71 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.072 -1.018 . . . . 0.0 111.658 175.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.27 6.9 mp -87.53 10.42 17.85 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 123.536 0.734 . . . . 0.0 111.639 171.533 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -111.55 2.23 17.27 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 126.105 1.762 . . . . 0.0 113.52 166.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.425 ' CG ' ' HE ' ' A' ' 23' ' ' ARG . 7.4 t70 -105.07 136.3 19.19 Favored Pre-proline 0 CA--C 1.538 0.511 0 C-N-CA 126.08 1.752 . . . . 0.0 109.904 -172.012 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.516 ' HG2' ' H ' ' A' ' 22' ' ' THR . 55.2 Cg_endo -55.86 -62.94 0.21 Allowed 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 125.226 3.951 . . . . 0.0 111.201 -172.367 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.516 ' H ' ' HG2' ' A' ' 21' ' ' PRO . 85.3 m -62.6 -44.12 97.11 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 117.558 -1.211 . . . . 0.0 109.832 -174.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.425 ' HE ' ' CG ' ' A' ' 20' ' ' ASP . 30.1 mtm180 -68.51 -38.39 80.9 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 117.128 -1.415 . . . . 0.0 112.491 -175.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 88.1 m -57.97 -50.0 74.88 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 120.244 1.384 . . . . 0.0 111.02 170.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.3 ttm180 -62.54 -37.45 86.14 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 118.758 -0.639 . . . . 0.0 112.266 177.049 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.4 mt -54.04 -61.63 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 C-N-CA 125.059 1.344 . . . . 0.0 110.055 169.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 92.3 mt -56.15 -41.15 74.94 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.811 0.844 . . . . 0.0 111.501 -169.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.2 p -77.52 -32.43 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 175.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.79 -30.27 68.82 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 119.29 0.95 . . . . 0.0 112.507 174.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.0 tp -64.47 -43.46 94.16 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 121.094 -1.004 . . . . 0.0 112.244 177.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -44.28 -36.11 2.61 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.958 2.903 . . . . 0.0 113.916 174.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -90.9 -41.08 11.36 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.3 1.84 . . . . 0.0 112.723 176.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.38 -69.93 1.3 Allowed Glycine 0 C--N 1.337 0.587 0 C-N-CA 124.026 0.822 . . . . 0.0 112.449 -168.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.3 m 37.88 33.23 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 125.371 1.469 . . . . 0.0 114.692 -167.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -83.91 -64.46 1.16 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.016 -1.053 . . . . 0.0 112.177 -171.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -156.97 157.11 30.53 Favored Pre-proline 0 N--CA 1.473 0.688 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -169.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -58.98 118.97 5.95 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.24 1.96 . . . . 0.0 108.52 171.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 90.68 1.46 73.97 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 117.335 -1.814 . . . . 0.0 114.936 -175.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.469 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -61.47 -35.83 78.74 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 121.184 2.492 . . . . 0.0 110.468 169.429 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 33.7 mt -54.45 -22.53 12.95 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 126.135 1.774 . . . . 0.0 112.077 174.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.86 -27.26 69.05 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.348 -1.47 . . . . 0.0 112.2 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.54 -57.09 4.01 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 118.203 0.456 . . . . 0.0 110.267 169.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.469 ' CD2' HE22 ' A' ' 39' ' ' GLN . 3.0 m-70 -54.57 -31.0 55.9 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 -177.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 37.5 mt -103.05 -2.67 27.12 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.968 1.307 . . . . 0.0 113.417 -175.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.24 7.83 20.76 Favored Glycine 0 CA--C 1.535 1.324 0 CA-C-N 118.968 0.804 . . . . 0.0 114.441 -175.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 36.2 mt -107.25 160.19 15.78 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.61 1.164 . . . . 0.0 112.91 -171.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.2 t -62.49 144.54 55.88 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.124 -0.985 . . . . 0.0 111.768 170.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -55.46 -29.21 58.28 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 127.007 2.123 . . . . 0.0 111.602 175.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 29.8 p -72.03 -57.33 4.37 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.431 -0.793 . . . . 0.0 111.739 169.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -66.09 -26.43 67.47 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 120.075 -1.641 . . . . 0.0 113.94 -175.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 75.9 t -66.54 -35.47 74.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 CA-C-N 120.402 1.456 . . . . 0.0 111.439 167.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.9 p -77.11 -22.29 52.94 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.697 -1.252 . . . . 0.0 114.137 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 -39.64 -44.94 1.58 Allowed 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 126.239 1.815 . . . . 0.0 111.198 167.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . 0.264 11.6 m-70 -104.33 -11.02 17.39 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -173.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 80.7 mt -71.64 -21.63 61.8 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.735 -1.228 . . . . 0.0 112.695 168.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.6 t -50.96 -42.59 60.01 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.576 1.08 . . . . 0.0 113.809 178.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 48.4 t -89.85 -32.15 17.03 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 118.79 0.723 . . . . 0.0 111.771 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 tp -56.58 -40.36 75.11 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.79 0.836 . . . . 0.0 111.311 176.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -78.32 -16.43 57.73 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 175.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -88.69 -56.19 2.03 Favored Glycine 0 N--CA 1.47 0.954 0 C-N-CA 125.931 1.729 . . . . 0.0 111.883 -177.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 52.0 m -64.27 -6.66 7.29 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 125.309 1.444 . . . . 0.0 111.942 168.052 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.49 6.62 84.52 Favored Glycine 0 C--N 1.341 0.849 0 C-N-CA 124.979 1.276 . . . . 0.0 114.176 171.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.7 mt -48.41 -28.73 3.42 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.262 1.425 . . . . 0.0 113.15 170.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.7 m -132.12 143.73 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 126.173 1.789 . . . . 0.0 112.23 173.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 45.4 t -126.5 143.3 40.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 127.154 2.182 . . . . 0.0 110.047 -175.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -89.54 154.03 20.32 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.111 1.364 . . . . 0.0 113.795 173.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.4 m -163.01 161.59 25.55 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.702 1.601 . . . . 0.0 108.471 -174.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -80.47 156.63 26.49 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 119.672 1.124 . . . . 0.0 113.05 169.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -115.41 -152.5 0.5 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.04 1.336 . . . . 0.0 108.825 166.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.02 -22.19 60.07 Favored Glycine 0 CA--C 1.537 1.414 0 CA-C-N 121.01 1.732 . . . . 0.0 115.156 -175.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.74 -23.34 0.08 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.708 1.203 . . . . 0.0 113.871 169.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -95.14 -170.24 2.15 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.484 1.914 . . . . 0.0 109.982 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 35.1 m -109.9 166.09 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 124.61 1.164 . . . . 0.0 109.959 169.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.0 ptt180 -140.8 171.04 14.64 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 128.178 2.591 . . . . 0.0 110.319 -170.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -124.03 139.05 54.32 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.88 1.272 . . . . 0.0 108.008 167.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -131.98 161.4 33.22 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 126.314 1.846 . . . . 0.0 109.547 175.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.0 mt -60.77 159.53 10.87 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 118.732 0.696 . . . . 0.0 110.248 169.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -42.49 -44.37 4.05 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.436 1.494 . . . . 0.0 114.334 -176.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.527 ' CG ' ' H ' ' A' ' 80' ' ' SER . 17.4 t70 -177.55 -172.35 0.36 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 129.491 3.116 . . . . 0.0 109.576 169.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.527 ' H ' ' CG ' ' A' ' 79' ' ' ASP . 14.3 t -53.37 -20.92 5.0 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 127.32 2.248 . . . . 0.0 113.396 174.185 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -46.92 87.76 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.224 1.009 . . . . 0.0 111.692 176.406 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 8.8 mt -86.52 -31.99 20.98 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.193 0.906 . . . . 0.0 111.202 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.58 -28.6 65.69 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.036 0.835 . . . . 0.0 112.893 170.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.9 mmt180 -69.33 -65.68 0.68 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.256 1.422 . . . . 0.0 112.002 169.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.83 -19.54 64.18 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -175.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.34 -38.82 14.82 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.6 -1.312 . . . . 0.0 111.949 167.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.47 -52.71 20.16 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 126.361 1.934 . . . . 0.0 114.372 -177.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.26 -6.89 56.32 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.562 1.181 . . . . 0.0 112.56 169.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 18.8 tp 77.79 128.47 0.05 OUTLIER 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 129.393 3.077 . . . . 0.0 113.201 167.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.4 m -34.13 -21.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 131.129 3.771 . . . . 0.0 116.532 170.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 76.57 -9.9 1.41 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.287 1.835 . . . . 0.0 114.063 165.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 17.3 m -64.57 57.44 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.717 1 C-N-CA 132.497 4.319 . . . . 0.0 112.159 169.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . 0.396 0.5 OUTLIER 19.04 44.86 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.424 -1.762 0 CA-C-N 108.581 -3.918 . . . . 0.0 116.272 -162.805 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 50.8 tp 61.29 83.91 0.14 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.851 2.061 . . . . 0.0 111.674 -169.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.69 85.76 0.05 OUTLIER 'General case' 0 CA--C 1.55 0.948 0 O-C-N 121.057 -1.027 . . . . 0.0 111.712 170.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 89.9 t -59.04 153.94 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 127.829 2.452 . . . . 0.0 111.199 169.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -42.96 1.79 0.0 OUTLIER 'General case' 0 CA--C 1.565 1.524 1 C-N-CA 131.727 4.011 . . . . 0.0 117.162 169.885 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -97.17 146.82 24.7 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 128.23 2.612 . . . . 0.0 116.501 -169.42 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -89.21 73.29 8.11 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.967 1.707 . . . . 0.0 109.759 167.012 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -65.64 146.91 98.95 Favored Pre-proline 0 CA--C 1.549 0.907 0 O-C-N 120.845 -1.16 . . . . 0.0 109.93 169.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.67 97.17 0.78 Allowed 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.477 2.785 . . . . 0.0 112.746 -178.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.557 1.24 0 C-N-CA 129.452 3.101 . . . . 0.0 116.155 -178.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 19.0 tp . . . . . 0 N--CA 1.472 0.675 0 CA-C-O 120.504 0.192 . . . . 0.0 110.691 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.48 -3.07 3.87 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 116.416 2.006 . . . . 0.0 116.416 178.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 66.2 mtt-85 -124.29 -42.21 2.13 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.004 1.321 . . . . 0.0 110.757 -179.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.73 -52.89 58.67 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.94 1.696 . . . . 0.0 108.763 168.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.52 -23.19 78.34 Favored Glycine 0 C--O 1.222 -0.649 0 CA-C-O 118.645 -1.086 . . . . 0.0 111.392 -178.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.1 ttm-85 -68.37 -44.51 75.04 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.214 1.507 . . . . 0.0 110.515 168.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.99 -30.13 70.63 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.987 0.812 . . . . 0.0 112.511 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 5.9 mp -93.42 9.56 35.97 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 124.335 1.054 . . . . 0.0 113.095 169.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -111.6 1.63 16.91 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.625 1.57 . . . . 0.0 112.16 165.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -75.19 146.3 81.61 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 126.034 1.734 . . . . 0.0 112.371 -169.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -59.31 -19.3 49.92 Favored 'Trans proline' 0 C--N 1.349 0.571 1 C-N-CA 125.479 4.119 . . . . 0.0 116.073 179.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -143.09 -30.57 0.51 Allowed 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.121 -176.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.11 -30.6 70.46 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.359 1.436 . . . . 0.0 112.744 176.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 88.0 m -53.4 -52.76 58.32 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.581 1.152 . . . . 0.0 111.134 168.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 12.5 ttm180 -61.53 -43.19 99.31 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.274 1.03 . . . . 0.0 112.413 173.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 mt -51.36 -57.65 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 C-N-CA 124.734 1.214 . . . . 0.0 110.839 174.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 86.4 mt -55.81 -44.34 77.75 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.501 1.12 . . . . 0.0 111.817 -175.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 8.8 p -76.45 -31.41 20.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 CA-C-N 119.373 0.988 . . . . 0.0 113.1 178.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.13 -31.51 66.07 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.716 -0.615 . . . . 0.0 111.985 174.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 10.7 tp -60.64 -41.27 94.6 Favored 'General case' 0 C--N 1.341 0.221 0 O-C-N 120.924 -1.11 . . . . 0.0 112.828 178.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -43.33 -36.74 1.98 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 129.377 3.071 . . . . 0.0 113.423 173.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -90.33 -34.17 15.81 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.447 1.899 . . . . 0.0 112.697 178.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -93.38 -68.27 1.09 Allowed Glycine 0 C--N 1.338 0.676 0 C-N-CA 123.706 0.669 . . . . 0.0 114.105 -168.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 31.2 m 36.78 33.98 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 C-N-CA 126.47 1.908 . . . . 0.0 115.311 -167.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.04 -63.6 1.35 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.456 -0.778 . . . . 0.0 113.064 -169.022 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 6.0 p90 -161.1 161.31 24.0 Favored Pre-proline 0 C--O 1.24 0.59 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 -169.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -58.65 127.16 23.52 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.288 1.992 . . . . 0.0 107.601 167.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.47 2.93 90.7 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-O 117.321 -1.822 . . . . 0.0 114.782 -175.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . 0.546 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -62.8 -41.07 99.12 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 121.279 2.539 . . . . 0.0 110.394 169.731 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 29.7 mt -54.66 -19.07 5.38 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 125.647 1.579 . . . . 0.0 112.958 176.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.89 -32.47 67.74 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.571 1.078 . . . . 0.0 112.553 172.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.81 -51.29 11.61 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.286 0.634 . . . . 0.0 111.96 170.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . 0.546 ' CD2' HE22 ' B' ' 39' ' ' GLN . 3.7 m-70 -56.03 -24.29 38.37 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.997 1.481 . . . . 0.0 114.997 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 56.4 mt -112.29 -4.16 14.39 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.845 1.658 . . . . 0.0 113.277 -177.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 61.05 7.81 9.62 Favored Glycine 0 CA--C 1.536 1.377 0 CA-C-O 119.013 -0.881 . . . . 0.0 114.818 -172.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 16.2 mt -102.04 162.44 12.91 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.703 1.601 . . . . 0.0 113.067 -169.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.5 t -61.57 138.5 58.3 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 121.237 -0.914 . . . . 0.0 111.24 172.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 66.7 mtt180 -49.93 -31.62 12.84 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.561 1.945 . . . . 0.0 111.936 173.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 60.7 p -72.47 -52.39 15.99 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 118.664 0.665 . . . . 0.0 112.724 173.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -69.5 -25.57 64.12 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 120.662 1.573 . . . . 0.0 113.259 -179.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 37.2 t -61.1 -51.87 68.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 O-C-N 121.514 -0.741 . . . . 0.0 109.436 167.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 78.0 p -75.77 -27.56 58.09 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 115.741 1.756 . . . . 0.0 115.741 -176.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -36.86 -56.15 0.87 Allowed 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 123.984 1.85 . . . . 0.0 109.895 168.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 27.4 m-70 -90.43 -4.33 57.08 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -178.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 86.9 mt -72.19 -16.64 61.96 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.73 -1.231 . . . . 0.0 108.979 164.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 21.3 t -49.92 -42.11 47.5 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.911 1.232 . . . . 0.0 112.64 168.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 7.2 t -84.34 -44.84 13.4 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 119.478 1.035 . . . . 0.0 112.03 178.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.9 tp -56.71 -34.61 67.64 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.382 0.673 . . . . 0.0 111.683 -176.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 38.3 mtm105 -81.68 -31.46 32.23 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.121 0.968 . . . . 0.0 113.551 174.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.5 -50.14 39.67 Favored Glycine 0 N--CA 1.473 1.116 0 CA-C-N 119.253 0.933 . . . . 0.0 111.931 177.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 56.9 m -65.95 -0.63 2.43 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 125.737 1.615 . . . . 0.0 113.115 172.013 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.04 -8.78 10.82 Favored Glycine 0 C--N 1.342 0.863 0 C-N-CA 125.67 1.605 . . . . 0.0 114.88 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 20.7 mt -52.33 -28.12 18.05 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.819 1.647 . . . . 0.0 113.59 -176.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 3.0 m -125.98 141.64 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 126.624 1.97 . . . . 0.0 112.036 167.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 64.7 t -132.58 141.73 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 127.376 2.27 . . . . 0.0 109.557 -174.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.67 164.43 22.83 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.971 1.309 . . . . 0.0 113.175 178.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.89 173.1 10.88 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.325 1.05 . . . . 0.0 108.671 178.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -94.9 157.15 16.04 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.21 0.604 . . . . 0.0 110.196 164.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -120.92 -151.03 0.47 Allowed 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.282 1.433 . . . . 0.0 109.321 167.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.6 -24.61 59.91 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-N 120.719 1.599 . . . . 0.0 115.105 -174.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.79 -21.94 0.08 Allowed 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 118.628 1.214 . . . . 0.0 113.93 168.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -97.1 -174.21 2.9 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.307 1.843 . . . . 0.0 109.78 -178.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 34.6 m -105.46 162.02 4.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.514 1.125 . . . . 0.0 109.482 168.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 6.7 ptt180 -137.54 175.45 9.59 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 126.928 2.091 . . . . 0.0 111.039 -171.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -129.14 141.41 51.19 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.435 1.094 . . . . 0.0 109.032 166.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -138.47 159.77 41.22 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 125.855 1.662 . . . . 0.0 110.113 178.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 50.0 mt -58.21 152.62 16.74 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 122.699 0.4 . . . . 0.0 111.362 172.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -46.89 -46.64 21.31 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.834 1.654 . . . . 0.0 114.01 -174.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -162.3 166.12 25.74 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 127.014 2.126 . . . . 0.0 108.58 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 8.0 t -52.12 -20.11 2.33 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.035 1.334 . . . . 0.0 113.322 168.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.54 -48.07 82.08 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.86 1.664 . . . . 0.0 113.428 170.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 18.2 mt -75.96 -35.37 59.69 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 119.578 1.081 . . . . 0.0 110.084 176.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.17 -28.59 66.75 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 118.848 0.749 . . . . 0.0 112.823 173.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 12.0 mmt180 -76.15 -64.31 1.13 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.679 1.591 . . . . 0.0 112.314 174.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.81 -22.46 64.18 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -178.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.35 -45.12 13.1 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.262 -0.899 . . . . 0.0 111.097 168.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.59 -49.21 45.4 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.895 1.712 . . . . 0.0 115.006 -173.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.9 -5.23 55.17 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.644 1.222 . . . . 0.0 112.292 169.345 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . 0.407 ' C ' ' H ' ' B' ' 91' ' ' GLN . 17.9 tp 77.49 127.58 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 128.825 2.85 . . . . 0.0 113.294 168.347 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.2 m -35.71 -19.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 131.234 3.814 . . . . 0.0 115.951 168.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.407 ' H ' ' C ' ' B' ' 89' ' ' LEU . 1.1 tt0 75.37 -7.48 1.77 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 127.272 2.229 . . . . 0.0 114.273 167.325 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 13.5 m -69.45 60.29 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.616 1 C-N-CA 131.715 4.006 . . . . 0.0 112.069 174.055 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.39 0.5 OUTLIER 21.79 38.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.425 -1.697 2 CA-C-N 107.302 -4.499 . . . . 0.0 116.461 -163.375 . . . . . . . . 4 3 . 1 . 017 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 37.8 tp 64.39 73.8 0.42 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.023 1.729 . . . . 0.0 111.511 -169.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.955 0 O-C-N 120.764 -1.21 . . . . 0.0 111.91 169.696 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.1 tt . . . . . 0 N--CA 1.471 0.579 0 CA-C-O 120.807 0.337 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.41 -9.28 32.25 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.2 mmp_? -96.2 -58.53 2.05 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.376 -0.828 . . . . 0.0 108.983 165.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -59.94 -54.49 45.5 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.246 1.418 . . . . 0.0 111.878 -173.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.91 -28.79 73.96 Favored Glycine 0 CA--C 1.528 0.864 0 O-C-N 121.647 -0.658 . . . . 0.0 113.015 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 54.8 ttt-85 -74.9 -26.93 60.0 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.119 0.967 . . . . 0.0 111.78 174.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -87.21 -3.92 59.08 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.293 1.037 . . . . 0.0 113.616 172.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.1 mt -99.42 -24.22 14.86 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.747 1.219 . . . . 0.0 110.857 168.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.38 82.78 3.17 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.205 1.402 . . . . 0.0 114.166 -174.032 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -150.82 154.26 34.49 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 125.743 1.617 . . . . 0.0 111.229 -176.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -57.74 -67.4 0.07 OUTLIER 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 124.103 3.202 . . . . 0.0 112.025 175.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 55.9 m -74.2 -43.71 56.13 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.386 1.074 . . . . 0.0 111.241 -177.012 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -32.83 71.43 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 118.343 -0.837 . . . . 0.0 112.704 -175.486 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.5 t -56.54 -53.45 57.38 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.292 0.951 . . . . 0.0 111.072 168.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -57.76 -46.28 84.74 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.747 -0.596 . . . . 0.0 112.49 175.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.7 mt -45.33 -56.48 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-N 118.677 0.671 . . . . 0.0 110.075 173.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 21.5 mt -65.77 -32.78 74.51 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -169.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.6 m -66.85 -34.63 71.24 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 CA-C-N 120.435 1.471 . . . . 0.0 111.62 170.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.52 -6.15 57.77 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.078 1.351 . . . . 0.0 113.766 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -80.5 -48.11 13.28 Favored 'General case' 0 CA--C 1.519 -0.242 0 C-N-CA 125.262 1.425 . . . . 0.0 109.219 -178.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.0 mt -48.38 -59.36 3.52 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.913 2.485 . . . . 0.0 110.873 172.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -85.95 26.67 0.97 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.636 1.575 . . . . 0.0 111.827 174.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.07 -87.28 0.7 Allowed Glycine 0 C--N 1.337 0.601 0 C-N-CA 125.469 1.509 . . . . 0.0 111.274 -173.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 26.9 m 36.6 22.5 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 N-CA-C 118.826 2.899 . . . . 0.0 118.826 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 98.5 m -83.72 -67.08 0.82 Allowed 'General case' 0 N--CA 1.471 0.579 0 O-C-N 120.137 -1.602 . . . . 0.0 112.887 -177.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 45.4 p90 -156.57 162.15 28.11 Favored Pre-proline 0 CA--C 1.544 0.749 0 O-C-N 121.25 -0.906 . . . . 0.0 113.015 -172.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -56.79 109.98 0.52 Allowed 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.607 2.871 . . . . 0.0 111.304 175.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 90.99 7.75 65.62 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-O 117.464 -1.742 . . . . 0.0 115.532 -175.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.415 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -59.66 -37.22 78.15 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 120.582 2.191 . . . . 0.0 110.564 168.799 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 20.3 mt -50.76 -26.21 5.34 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 126.054 1.741 . . . . 0.0 112.562 173.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.64 -36.95 77.4 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.895 -0.574 . . . . 0.0 112.253 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -42.58 62.33 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.233 0.469 . . . . 0.0 111.527 175.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.415 ' CD2' HE22 ' A' ' 39' ' ' GLN . 7.4 m-70 -60.13 -32.58 71.15 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 176.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 16.8 mt -105.6 -21.28 13.23 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -172.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.79 2.51 64.98 Favored Glycine 0 CA--C 1.536 1.374 0 CA-C-N 119.323 0.965 . . . . 0.0 114.331 -171.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -98.13 142.28 30.02 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.282 1.433 . . . . 0.0 109.759 175.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.8 p -61.4 150.94 33.79 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.136 -0.977 . . . . 0.0 111.853 -173.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -59.43 -19.83 50.39 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 175.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -78.17 -46.25 21.04 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 118.937 0.79 . . . . 0.0 110.981 171.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -65.73 -45.08 83.99 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.363 1.065 . . . . 0.0 112.552 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 80.9 t -61.22 -39.17 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 CA-C-N 118.53 0.604 . . . . 0.0 111.504 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 69.6 m -66.26 -26.46 67.36 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -178.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -51.32 -37.27 46.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.902 1.281 . . . . 0.0 111.727 170.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -90.34 -12.38 37.86 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 176.202 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 95.0 mt -81.23 -27.71 35.14 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 117.922 -1.037 . . . . 0.0 111.675 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.42 -37.47 83.62 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 121.0 1.727 . . . . 0.0 113.467 -177.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 51.5 t -86.48 -15.33 40.47 Favored 'General case' 0 CA--C 1.558 1.265 0 O-C-N 120.827 -1.171 . . . . 0.0 111.718 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.4 tp -68.11 -41.79 81.23 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 119.579 -1.95 . . . . 0.0 108.895 167.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 45.5 mtm180 -78.44 -13.51 59.81 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.066 1.746 . . . . 0.0 112.292 176.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.442 ' C ' ' H ' ' A' ' 62' ' ' GLY . . . -96.07 -57.38 1.15 Allowed Glycine 0 N--CA 1.47 0.901 0 C-N-CA 125.97 1.748 . . . . 0.0 111.659 -178.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.7 m -74.48 23.63 0.09 Allowed 'General case' 0 CA--C 1.566 1.58 0 C-N-CA 125.098 1.359 . . . . 0.0 112.854 173.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.442 ' H ' ' C ' ' A' ' 60' ' ' GLY . . . 59.2 28.73 64.61 Favored Glycine 0 N--CA 1.476 1.313 0 C-N-CA 127.152 2.31 . . . . 0.0 117.482 167.062 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.6 mt -82.21 -30.14 31.02 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.187 0.995 . . . . 0.0 113.324 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.0 m -133.33 144.93 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.951 1.7 . . . . 0.0 111.092 -178.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 72.0 t -129.09 139.95 50.51 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 126.295 1.838 . . . . 0.0 109.179 -175.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.94 142.92 52.83 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.577 1.151 . . . . 0.0 112.267 172.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 16.8 m -155.58 155.38 33.24 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.438 1.095 . . . . 0.0 108.233 176.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.23 125.71 31.25 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 119.379 0.99 . . . . 0.0 109.144 167.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.42 -16.32 63.87 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.525 1.057 . . . . 0.0 113.525 175.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 154.71 -32.89 0.68 Allowed Glycine 0 CA--C 1.531 1.087 0 C-N-CA 126.804 2.145 . . . . 0.0 112.153 -179.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.48 -21.45 0.2 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.346 1.458 . . . . 0.0 113.376 172.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -104.59 169.26 8.56 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.393 2.277 . . . . 0.0 110.028 174.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 10.0 p -92.58 145.52 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.621 0.768 . . . . 0.0 110.948 173.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -131.27 164.4 25.67 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.139 1.775 . . . . 0.0 110.855 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -115.93 120.02 37.83 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.265 1.026 . . . . 0.0 108.547 167.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -121.76 155.37 35.42 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 118.59 0.632 . . . . 0.0 112.191 175.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 tp -52.82 140.71 23.42 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.855 1.262 . . . . 0.0 109.626 173.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.57 -31.55 72.66 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -171.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -164.79 179.56 6.46 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 -178.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 20.1 m -55.89 -33.03 64.24 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.088 1.755 . . . . 0.0 114.208 171.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -68.74 -45.02 72.56 Favored 'General case' 0 C--N 1.344 0.333 0 CA-C-N 119.926 1.239 . . . . 0.0 112.467 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.9 mt -69.94 -40.65 75.37 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 120.13 1.332 . . . . 0.0 109.881 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.9 -35.15 75.92 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.455 0.702 . . . . 0.0 109.877 -178.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -71.95 -50.2 31.02 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 126.377 1.871 . . . . 0.0 112.649 172.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.94 -46.63 77.48 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 121.115 1.779 . . . . 0.0 111.593 -177.266 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.4 -51.27 70.22 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.715 0.806 . . . . 0.0 109.647 171.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -79.99 21.69 4.71 Favored Glycine 0 CA--C 1.537 1.462 0 C-N-CA 126.465 1.983 . . . . 0.0 114.699 -179.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 23.5 tp10 -101.8 -65.49 0.98 Allowed 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 126.427 1.891 . . . . 0.0 108.782 167.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 7.7 tp 165.85 -29.34 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.95 1.7 . . . . 0.0 112.021 -167.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.293 22.9 t 58.39 11.59 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 127.514 2.326 . . . . 0.0 111.837 -166.22 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.462 ' C ' ' H ' ' A' ' 93' ' ' VAL . 1.8 tp-100 88.01 -19.32 0.23 Allowed 'General case' 0 C--O 1.218 -0.575 0 O-C-N 120.315 -1.49 . . . . 0.0 109.452 135.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.9 p -75.01 37.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 127.338 2.255 . . . . 0.0 110.268 163.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.462 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.6 t 71.19 -8.9 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 C-N-CA 127.776 2.43 . . . . 0.0 114.106 174.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 99.02 102.75 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 131.112 3.765 . . . . 0.0 107.865 -169.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.13 137.6 58.23 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.251 1.821 . . . . 0.0 115.179 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 25.4 m -74.97 162.39 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 126.53 1.932 . . . . 0.0 113.906 171.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.03 -41.13 97.53 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 128.738 2.815 . . . . 0.0 115.235 178.669 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 23.6 p -71.26 76.77 0.72 Allowed 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.767 1.167 . . . . 0.0 111.007 170.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . 0.267 1.8 p-10 -71.43 80.3 0.77 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 123.799 1.762 . . . . 0.0 109.473 169.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -61.2 138.42 94.45 Favored Pre-proline 0 CA--C 1.545 0.762 0 CA-C-N 114.205 -1.362 . . . . 0.0 109.894 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.76 160.49 49.52 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 123.97 3.114 . . . . 0.0 116.077 -166.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 8.1 t . . . . . 0 C--N 1.347 0.476 0 C-N-CA 125.721 1.608 . . . . 0.0 111.303 -169.114 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 tt . . . . . 0 N--CA 1.473 0.709 0 CA-C-O 120.637 0.256 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.28 -11.36 30.97 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 178.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 13.0 mmp_? -98.2 -56.2 2.55 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.227 1.011 . . . . 0.0 109.663 167.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -60.49 -51.58 68.84 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.369 1.468 . . . . 0.0 111.618 -173.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.97 -34.1 89.0 Favored Glycine 0 CA--C 1.529 0.952 0 C-N-CA 124.094 0.854 . . . . 0.0 112.976 175.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -70.19 -36.58 74.73 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.208 1.004 . . . . 0.0 111.109 175.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.3 -24.65 60.43 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.971 0.908 . . . . 0.0 112.745 175.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 11.7 mt -77.89 -29.87 50.48 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.414 1.086 . . . . 0.0 111.387 168.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -99.93 50.37 0.91 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.465 1.506 . . . . 0.0 114.436 -171.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -114.87 149.72 42.9 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 127.21 2.204 . . . . 0.0 108.593 174.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . 0.402 ' HG2' ' H ' ' B' ' 22' ' ' THR . 60.5 Cg_endo -61.48 -52.84 2.78 Favored 'Trans proline' 0 CA--C 1.534 0.485 0 C-N-CA 124.317 3.345 . . . . 0.0 111.888 -171.091 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.467 ' HB ' ' CD2' ' B' ' 54' ' ' HIS . 15.9 m -76.6 -41.63 45.43 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 117.866 -1.064 . . . . 0.0 110.759 177.124 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 22.3 mtm180 -59.51 -36.9 76.98 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 120.177 1.353 . . . . 0.0 112.963 -176.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 53.8 t -48.79 -55.92 10.17 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.547 0.739 . . . . 0.0 110.37 169.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -57.93 -51.86 67.9 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 118.502 -0.761 . . . . 0.0 113.027 172.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 3.8 mt -44.7 -55.69 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 CA-C-N 119.387 0.994 . . . . 0.0 109.6 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 29.2 mt -64.26 -38.11 89.87 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 116.701 -1.618 . . . . 0.0 114.374 -169.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -65.92 -35.44 75.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 CA-C-N 120.88 1.673 . . . . 0.0 111.296 172.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.58 -13.44 56.54 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.793 1.237 . . . . 0.0 113.821 179.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.45 -47.08 28.84 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.045 0.938 . . . . 0.0 109.748 -175.279 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 mt -48.46 -48.35 37.66 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 128.735 2.814 . . . . 0.0 112.382 172.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -94.79 18.81 11.06 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.052 1.741 . . . . 0.0 111.968 175.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.73 -85.46 1.08 Allowed Glycine 0 C--O 1.222 -0.609 0 C-N-CA 125.343 1.449 . . . . 0.0 111.16 -172.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 11.5 m 32.15 27.57 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 N-CA-C 118.761 2.874 . . . . 0.0 118.761 -174.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 73.1 m -81.82 -75.99 0.27 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 120.941 1.7 . . . . 0.0 111.497 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -155.72 166.52 16.13 Favored Pre-proline 0 CA--C 1.55 0.968 0 O-C-N 120.55 -1.344 . . . . 0.0 113.052 -170.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.18 89.73 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 124.756 3.637 . . . . 0.0 113.017 177.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 123.83 -4.97 9.14 Favored Glycine 0 C--O 1.221 -0.67 0 CA-C-O 117.309 -1.828 . . . . 0.0 115.624 -176.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . 0.499 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -57.75 -34.99 70.12 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 120.425 2.113 . . . . 0.0 112.426 175.563 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 23.2 mt -53.85 -22.68 10.32 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 124.669 1.188 . . . . 0.0 112.445 177.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.33 88.84 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 118.926 -0.559 . . . . 0.0 111.938 -177.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.3 -34.86 65.96 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 122.999 0.52 . . . . 0.0 112.02 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . 0.499 ' CD2' HE22 ' B' ' 39' ' ' GLN . 5.4 m-70 -65.54 -27.61 68.57 Favored 'General case' 0 CA--C 1.553 1.067 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 174.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 15.1 mt -114.7 -20.39 10.68 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.684 1.364 . . . . 0.0 114.684 -170.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.94 -2.1 61.19 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 125.204 1.383 . . . . 0.0 114.417 -171.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -93.96 143.72 26.1 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.693 1.197 . . . . 0.0 110.113 176.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.4 p -61.52 149.99 37.21 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 121.14 -0.975 . . . . 0.0 111.175 -177.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -60.8 -19.25 59.17 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 174.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 6.5 t -77.24 -37.66 52.74 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 118.752 0.705 . . . . 0.0 112.185 170.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -74.68 -47.91 29.03 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.751 0.821 . . . . 0.0 111.424 175.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 63.2 t -58.92 -38.1 71.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-N 119.643 1.11 . . . . 0.0 111.803 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 55.5 m -66.6 -21.52 66.13 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -56.38 -51.19 69.24 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 122.947 1.356 . . . . 0.0 109.835 174.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . 0.467 ' CD2' ' HB ' ' B' ' 22' ' ' THR . 55.4 m-70 -73.84 -8.92 57.89 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 172.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 95.6 mt -83.25 -22.69 33.0 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 117.358 -1.306 . . . . 0.0 112.285 173.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.34 -37.81 81.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 121.201 1.819 . . . . 0.0 112.627 178.243 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 48.5 t -91.06 -13.74 32.61 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 118.129 0.422 . . . . 0.0 111.32 176.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 4.9 tp -70.34 -42.99 71.14 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 119.461 -2.024 . . . . 0.0 109.286 167.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 37.1 mtm105 -83.07 -5.98 59.31 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.966 1.706 . . . . 0.0 112.519 174.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . 0.433 ' C ' ' H ' ' B' ' 62' ' ' GLY . . . -92.22 -65.11 1.12 Allowed Glycine 0 C--N 1.336 0.536 0 N-CA-C 109.409 -1.477 . . . . 0.0 109.409 174.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 60.6 m -72.22 26.43 0.05 Allowed 'General case' 0 CA--C 1.564 1.482 0 C-N-CA 126.517 1.927 . . . . 0.0 113.287 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . 0.433 ' H ' ' C ' ' B' ' 60' ' ' GLY . . . 60.95 20.76 58.07 Favored Glycine 0 N--CA 1.474 1.18 0 C-N-CA 127.515 2.483 . . . . 0.0 117.409 167.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 60.4 mt -77.65 -35.9 52.06 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.885 0.874 . . . . 0.0 113.205 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 1.7 m -126.64 142.07 44.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 126.273 1.829 . . . . 0.0 111.225 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 54.6 t -123.76 138.31 53.94 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 127.068 2.147 . . . . 0.0 108.85 -178.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.06 139.99 38.0 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 123.976 0.91 . . . . 0.0 111.317 176.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 41.1 m -152.48 159.58 43.33 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.584 1.554 . . . . 0.0 107.128 -174.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -87.86 135.69 33.28 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.497 1.499 . . . . 0.0 112.246 169.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -78.13 45.2 0.53 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.269 1.428 . . . . 0.0 109.808 167.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 76.51 -46.5 2.27 Favored Glycine 0 CA--C 1.534 1.262 0 O-C-N 120.204 -1.56 . . . . 0.0 113.011 -169.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -126.37 -46.43 1.62 Allowed 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.725 1.263 . . . . 0.0 114.073 -173.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -97.9 175.49 6.12 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.896 1.225 . . . . 0.0 110.504 173.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 14.9 p -93.34 141.29 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.255 1.022 . . . . 0.0 111.26 174.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 29.4 ptt180 -125.38 163.11 23.31 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 127.477 2.311 . . . . 0.0 110.853 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -113.19 118.82 35.76 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.993 0.917 . . . . 0.0 108.728 168.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -119.09 152.26 36.8 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.077 0.951 . . . . 0.0 111.355 178.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 tp -52.77 141.69 20.69 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.95 0.9 . . . . 0.0 109.989 171.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.54 -32.28 72.1 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -172.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -164.94 176.1 8.95 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 22.5 m -52.23 -31.66 33.22 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.104 1.762 . . . . 0.0 114.501 171.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 7.9 m-70 -72.19 -44.37 63.1 Favored 'General case' 0 C--N 1.345 0.37 0 CA-C-O 117.286 -1.34 . . . . 0.0 112.822 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 9.5 mt -69.13 -40.28 78.38 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 120.665 1.575 . . . . 0.0 109.701 174.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.23 -38.7 84.19 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.612 0.765 . . . . 0.0 109.874 -179.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 4.8 tpm_? -71.36 -50.13 35.3 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.571 1.549 . . . . 0.0 112.776 171.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.61 -44.36 86.76 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 121.589 1.995 . . . . 0.0 111.657 -173.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.67 -53.26 58.48 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.616 1.167 . . . . 0.0 109.45 170.545 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.46 -7.86 83.25 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.175 1.369 . . . . 0.0 115.63 -172.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 28.1 tp10 -69.07 -63.51 1.05 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 126.387 1.875 . . . . 0.0 109.016 169.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . 0.448 ' C ' ' H ' ' B' ' 91' ' ' GLN . 10.7 tp 163.22 -26.59 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.838 2.055 . . . . 0.0 113.232 -170.128 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . 0.305 42.1 t 58.17 11.97 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 126.827 2.051 . . . . 0.0 111.935 -164.065 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.452 ' C ' ' H ' ' B' ' 93' ' ' VAL . 3.0 tp-100 86.34 -23.06 0.15 Allowed 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 125.136 1.374 . . . . 0.0 110.818 135.613 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.6 p -69.01 33.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 C-N-CA 129.068 2.947 . . . . 0.0 112.444 168.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . 0.452 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.3 OUTLIER 67.88 11.56 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 126.966 2.106 . . . . 0.0 113.402 176.0 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 tt 91.97 101.23 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 130.228 3.411 . . . . 0.0 109.709 -176.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.802 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -178.715 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.47 0.562 0 CA-C-O 118.698 -0.668 . . . . 0.0 111.482 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.82 -44.15 90.8 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.652 1.115 . . . . 0.0 112.569 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -64.58 -61.21 2.35 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.704 -0.622 . . . . 0.0 111.312 172.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -52.67 63.99 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.757 1.623 . . . . 0.0 110.272 -171.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.63 -32.49 71.01 Favored Glycine 0 CA--C 1.529 0.942 0 CA-C-O 118.672 -1.071 . . . . 0.0 113.411 -170.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -33.87 66.18 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.412 1.606 . . . . 0.0 111.19 175.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.13 -31.25 71.57 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 118.648 0.658 . . . . 0.0 111.754 176.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.7 mp -84.48 -30.31 25.31 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 118.567 -0.73 . . . . 0.0 111.496 174.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.12 60.65 1.05 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.374 1.47 . . . . 0.0 113.961 171.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -153.26 155.14 31.59 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 124.663 1.185 . . . . 0.0 109.042 174.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -59.76 -95.24 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.76 1 C-N-CA 126.156 4.571 . . . . 0.0 113.733 -166.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.548 ' HG1' ' CD2' ' A' ' 54' ' ' HIS . 10.6 p -44.92 -30.09 0.94 Allowed 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 127.386 2.274 . . . . 0.0 113.436 169.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.3 ttm105 -73.74 -43.16 59.89 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.076 0.853 . . . . 0.0 112.407 -175.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 8.2 t -54.21 -51.96 62.77 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.547 0.739 . . . . 0.0 109.346 166.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -52.17 -50.78 61.15 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.35 1.06 . . . . 0.0 113.2 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.7 mm -50.76 -48.12 28.19 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 124.049 0.94 . . . . 0.0 111.736 174.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 77.4 mt -65.22 -48.23 74.06 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 118.726 0.694 . . . . 0.0 112.278 -176.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.1 p -69.42 -27.42 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 123.483 0.713 . . . . 0.0 112.301 179.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.21 -38.46 66.08 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.75 0.82 . . . . 0.0 111.697 169.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 tp -64.61 -28.75 69.84 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 120.308 1.413 . . . . 0.0 114.569 -175.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 mt -42.32 -30.02 0.29 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.88 1.672 . . . . 0.0 112.614 169.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -110.74 -32.43 6.86 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 126.987 2.115 . . . . 0.0 111.446 167.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.22 8.06 34.01 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 128.711 3.053 . . . . 0.0 116.034 -166.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 23.5 m -58.87 26.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.029 0 C-N-CA 127.215 2.206 . . . . 0.0 116.583 168.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 73.6 m -82.44 -81.86 0.15 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.425 1.09 . . . . 0.0 111.464 172.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.23 156.54 78.01 Favored Pre-proline 0 N--CA 1.47 0.568 0 CA-C-O 118.11 -0.948 . . . . 0.0 111.461 -172.112 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -56.92 -36.31 99.01 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.035 2.49 . . . . 0.0 113.448 -174.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -85.3 1.52 88.52 Favored Glycine 0 CA--C 1.533 1.217 0 CA-C-O 118.554 -1.137 . . . . 0.0 115.327 177.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.29 -30.4 66.22 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.807 1.804 . . . . 0.0 113.28 -170.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mt -60.3 -16.9 38.66 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.091 0.557 . . . . 0.0 111.81 -179.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.32 -36.87 76.42 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.812 0.845 . . . . 0.0 111.702 175.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -51.73 16.57 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.01 0.924 . . . . 0.0 111.313 175.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -55.94 -33.35 64.66 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 21.7 mt -105.37 -15.68 14.96 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -174.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.75 11.19 68.86 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-N 119.657 1.117 . . . . 0.0 114.035 -170.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.9 mp -95.11 155.63 16.65 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 117.996 0.898 . . . . 0.0 112.492 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.7 p -64.84 151.81 44.51 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.245 0.618 . . . . 0.0 110.308 170.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -40.84 81.58 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.941 -0.475 . . . . 0.0 111.148 176.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.1 m -63.38 -38.5 91.41 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.353 0.661 . . . . 0.0 112.219 176.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 44.4 t-20 -70.99 -49.26 47.23 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.807 -0.558 . . . . 0.0 111.199 176.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.587 ' HA ' ' HD1' ' A' ' 54' ' ' HIS . 1.3 t -55.98 -35.88 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 120.338 -1.476 . . . . 0.0 112.765 172.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 72.0 m -66.69 -32.78 74.31 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -57.64 -38.63 75.35 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.759 0.708 . . . . 0.0 111.616 171.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.587 ' HD1' ' HA ' ' A' ' 51' ' ' VAL . 23.3 m80 -69.72 -39.5 76.8 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.396 -0.815 . . . . 0.0 112.577 175.486 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.8 mt -75.28 -12.92 60.38 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.771 0.828 . . . . 0.0 113.137 177.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.6 t -60.4 -55.36 34.52 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.404 1.002 . . . . 0.0 110.675 168.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.8 t -67.69 -39.67 84.43 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.326 -0.859 . . . . 0.0 111.739 177.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.4 tp -62.02 -37.69 85.86 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -175.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 45.0 mtm105 -82.46 -7.3 59.64 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.865 0.866 . . . . 0.0 111.9 177.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -102.13 -45.24 1.76 Allowed Glycine 0 CA--C 1.535 1.283 0 C-N-CA 126.036 1.779 . . . . 0.0 114.685 178.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 7.2 m -67.36 4.41 1.0 Allowed 'General case' 0 CA--C 1.563 1.447 0 C-N-CA 126.008 1.723 . . . . 0.0 112.229 168.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.97 21.21 78.24 Favored Glycine 0 C--N 1.343 0.955 0 C-N-CA 126.018 1.771 . . . . 0.0 114.36 170.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.1 mt -85.13 -22.92 28.65 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.121 1.368 . . . . 0.0 113.61 -174.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -137.28 147.4 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 C-N-CA 125.795 1.638 . . . . 0.0 111.286 -178.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 88.5 t -130.37 144.63 37.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.82 1.648 . . . . 0.0 109.849 -179.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.59 134.36 34.81 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.91 0.884 . . . . 0.0 111.769 172.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.9 166.6 24.34 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.483 0.713 . . . . 0.0 109.596 171.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -80.39 127.48 32.45 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 165.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.265 0.0 OUTLIER -78.73 -16.22 57.5 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 120.038 1.29 . . . . 0.0 114.313 171.706 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 130.65 -21.74 4.71 Favored Glycine 0 N--CA 1.477 1.4 0 C-N-CA 125.602 1.572 . . . . 0.0 113.987 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.1 -19.78 1.49 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.558 2.743 . . . . 0.0 112.62 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 -148.28 173.14 13.32 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 129.564 3.146 . . . . 0.0 111.071 -177.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 14.1 p -88.97 145.13 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 167.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 -126.98 165.83 18.68 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.978 1.711 . . . . 0.0 111.224 -179.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 17.2 m-30 -112.49 120.75 42.71 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 164.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -121.44 154.36 36.66 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.932 1.293 . . . . 0.0 109.819 -178.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 81.6 mt -57.58 151.01 17.85 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.994 0.815 . . . . 0.0 110.226 169.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.51 -37.21 75.12 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 -168.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -162.18 167.8 23.52 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 126.288 1.835 . . . . 0.0 109.064 175.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 51.1 m -44.76 -32.16 1.44 Allowed 'General case' 0 C--O 1.214 -0.775 0 CA-C-O 117.604 -1.189 . . . . 0.0 110.998 167.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -37.58 -65.03 0.34 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.702 1.601 . . . . 0.0 114.026 169.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 15.3 mt -73.46 -41.0 63.72 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.749 1.613 . . . . 0.0 110.826 -176.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.67 -26.55 65.64 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 177.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -79.22 -59.79 2.63 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 126.793 2.037 . . . . 0.0 109.469 178.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.88 -37.72 85.6 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.83 -42.9 85.04 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.74 -0.6 . . . . 0.0 109.483 169.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.51 -34.17 73.3 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 126.296 1.903 . . . . 0.0 117.043 -174.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.77 -11.97 59.91 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 121.533 2.666 . . . . 0.0 112.261 167.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 41.2 tp 64.08 113.33 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 127.85 2.46 . . . . 0.0 109.225 -174.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 19.3 m -66.61 26.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 126.281 1.832 . . . . 0.0 114.907 -175.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.424 ' C ' ' H ' ' A' ' 93' ' ' VAL . 39.2 mm-40 79.98 -2.96 2.01 Favored 'General case' 0 N--CA 1.442 -0.856 0 O-C-N 119.911 -1.743 . . . . 0.0 111.271 157.371 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 13.5 p -60.63 31.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 131.153 3.781 . . . . 0.0 113.871 166.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.424 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.3 t 56.87 18.96 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 127.987 2.515 . . . . 0.0 113.99 169.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 tt 99.59 105.74 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 129.891 3.276 . . . . 0.0 107.099 -169.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.29 61.5 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.992 2.117 . . . . 0.0 116.078 -176.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.5 t -64.35 152.51 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 125.165 1.386 . . . . 0.0 108.427 167.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.93 -72.45 0.38 Allowed 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.796 1.638 . . . . 0.0 113.186 178.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.1 p 70.91 144.36 0.06 Allowed 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 129.596 3.158 . . . . 0.0 115.13 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -90.93 131.94 36.25 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 163.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -168.32 138.43 2.06 Favored Pre-proline 0 CA--C 1.541 0.597 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.46 -179.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -69.55 166.27 27.89 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 122.676 2.251 . . . . 0.0 111.626 174.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 5.7 t . . . . . 0 CA--C 1.553 1.061 0 C-N-CA 126.582 1.953 . . . . 0.0 111.151 -176.653 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.532 0.283 0 CA-C-O 118.05 -0.976 . . . . 0.0 112.645 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.75 -56.18 17.51 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.999 1.272 . . . . 0.0 111.752 171.051 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -59.03 -58.95 6.41 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.802 0.841 . . . . 0.0 111.828 175.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.72 -52.52 56.66 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 125.869 1.668 . . . . 0.0 109.945 -172.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.59 -39.25 96.62 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-O 118.358 -1.246 . . . . 0.0 112.247 -175.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -37.59 79.77 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.123 1.461 . . . . 0.0 110.923 174.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.86 -16.43 60.68 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 178.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 10.3 mp -90.62 -32.73 16.13 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 118.962 0.801 . . . . 0.0 110.031 168.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -74.85 56.0 0.71 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.392 1.877 . . . . 0.0 113.633 169.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -146.63 135.15 10.94 Favored Pre-proline 0 CA--C 1.544 0.714 0 C-N-CA 125.419 1.488 . . . . 0.0 107.167 178.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -46.89 -70.01 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.803 1 C-N-CA 125.628 4.218 . . . . 0.0 113.525 -166.219 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.482 ' HG1' ' CD2' ' B' ' 54' ' ' HIS . 12.1 p -70.18 -16.49 63.08 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 117.849 -1.072 . . . . 0.0 112.59 -178.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . 0.414 HH22 HG13 ' B' ' 26' ' ' ILE . 0.0 OUTLIER -72.16 -46.3 56.96 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 116.551 -1.69 . . . . 0.0 112.252 -176.486 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 38.0 t -45.99 -52.34 11.93 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.454 1.025 . . . . 0.0 110.404 169.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -61.01 -50.37 73.64 Favored 'General case' 0 C--O 1.225 -0.221 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 179.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . 0.414 HG13 HH22 ' B' ' 23' ' ' ARG . 5.2 mm -51.37 -56.99 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.841 1.2 . . . . 0.0 110.526 171.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 59.7 mt -62.17 -42.76 99.57 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 118.699 -0.667 . . . . 0.0 111.906 -169.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 6.3 p -73.23 -32.64 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 123.614 0.765 . . . . 0.0 112.69 177.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.33 -31.6 60.65 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.409 0.55 . . . . 0.0 111.891 176.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 7.8 tp -62.0 -40.83 96.99 Favored 'General case' 0 C--N 1.341 0.235 0 O-C-N 121.093 -1.004 . . . . 0.0 112.536 -178.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.76 -31.0 1.81 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 130.023 3.329 . . . . 0.0 114.383 172.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -100.99 -14.06 18.01 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 127.032 2.133 . . . . 0.0 112.626 -178.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -114.68 -71.91 0.53 Allowed Glycine 0 C--N 1.344 1.006 0 C-N-CA 124.87 1.224 . . . . 0.0 115.642 -169.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 35.0 m 32.6 34.48 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 N-CA-C 117.314 2.339 . . . . 0.0 117.314 -169.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 68.6 m -82.9 -84.08 0.13 Allowed 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 125.975 1.71 . . . . 0.0 112.326 176.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.72 163.31 49.53 Favored Pre-proline 0 CA--C 1.543 0.701 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -172.459 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -57.81 -42.2 61.65 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.336 2.024 . . . . 0.0 111.943 178.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -72.11 -1.83 50.69 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 117.955 -1.47 . . . . 0.0 114.645 174.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -64.17 -51.5 63.52 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.533 1.666 . . . . 0.0 111.322 -177.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 5.3 mt -66.48 -28.57 68.68 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 118.77 0.714 . . . . 0.0 109.248 -174.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -75.06 23.96 0.1 Allowed 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 172.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -143.43 -45.39 0.28 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.385 2.674 . . . . 0.0 108.111 168.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -53.13 -29.55 31.71 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 126.323 1.849 . . . . 0.0 113.819 170.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.7 mt -101.61 -18.59 15.82 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 126.045 1.738 . . . . 0.0 113.323 175.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.27 -2.47 52.0 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 124.285 0.945 . . . . 0.0 114.667 -170.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mp -92.84 144.84 24.88 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.052 1.426 . . . . 0.0 110.383 -178.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 21.2 p -58.86 156.35 11.52 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.065 0.946 . . . . 0.0 113.544 -169.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -37.39 79.14 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 121.465 -0.772 . . . . 0.0 111.314 178.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 26.6 m -63.3 -47.08 83.8 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.754 0.822 . . . . 0.0 111.933 170.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -62.78 -50.43 71.05 Favored 'General case' 0 CA--C 1.546 0.795 0 O-C-N 121.038 -1.039 . . . . 0.0 112.375 178.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 3.9 t -67.8 -19.57 25.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 O-C-N 121.007 -1.058 . . . . 0.0 111.739 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 61.2 m -72.2 -46.61 55.52 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.496 1.498 . . . . 0.0 113.674 171.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -49.74 -46.91 50.89 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 123.644 1.687 . . . . 0.0 111.208 173.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . 0.482 ' CD2' ' HG1' ' B' ' 22' ' ' THR . 27.5 m170 -59.46 -55.08 39.21 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 113.134 -1.848 . . . . 0.0 113.783 170.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 52.5 mt -67.59 -14.99 63.41 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 120.003 -1.686 . . . . 0.0 112.78 -178.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.2 t -50.69 -50.96 53.68 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 119.452 1.024 . . . . 0.0 111.065 168.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.95 -21.19 31.88 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.821 1.191 . . . . 0.0 112.875 -171.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 4.7 tp -73.02 -47.17 47.35 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 121.659 -0.651 . . . . 0.0 111.69 176.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 43.3 mtm180 -72.35 -26.4 61.9 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.786 0.834 . . . . 0.0 110.94 174.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.3 -46.32 12.83 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-O 119.292 -0.727 . . . . 0.0 113.745 176.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 54.1 m -75.8 -15.93 60.18 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 119.161 1.481 . . . . 0.0 113.772 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 107.65 9.36 28.91 Favored Glycine 0 C--N 1.344 0.992 0 C-N-CA 125.259 1.409 . . . . 0.0 115.622 169.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 3.1 mt -85.12 -17.26 37.82 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 120.006 1.903 . . . . 0.0 114.55 -169.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.73 143.09 42.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 126.455 1.902 . . . . 0.0 110.455 177.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 98.1 t -131.1 141.2 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.304 1.041 . . . . 0.0 110.024 -176.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.49 136.87 33.24 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.496 1.119 . . . . 0.0 112.144 173.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -142.15 166.22 25.31 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.113 0.965 . . . . 0.0 109.506 172.235 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -77.36 127.38 32.47 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 165.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.254 0.0 OUTLIER -75.15 -21.13 59.01 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 172.757 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 135.21 -19.44 3.86 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.781 1.658 . . . . 0.0 114.02 -177.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 5.1 tmt_? -142.63 -25.48 0.63 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 129.503 3.121 . . . . 0.0 111.608 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -138.66 179.39 6.51 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 127.557 2.343 . . . . 0.0 110.8 -177.252 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 14.8 p -91.1 145.16 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.943 0.897 . . . . 0.0 108.865 166.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 20.2 ptt180 -128.92 164.29 23.44 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 126.295 1.838 . . . . 0.0 110.093 176.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -108.0 149.21 28.68 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 106.005 -1.85 . . . . 0.0 106.005 162.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -146.56 158.3 43.88 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 125.227 1.411 . . . . 0.0 108.571 176.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 62.3 mt -59.28 152.91 19.83 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.385 0.993 . . . . 0.0 109.32 167.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.79 -34.99 76.88 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -168.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -159.62 167.56 28.18 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 123.121 1.439 . . . . 0.0 110.292 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 14.7 m -50.28 -30.62 12.25 Favored 'General case' 0 C--O 1.22 -0.473 0 C-N-CA 125.601 1.56 . . . . 0.0 110.337 167.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -46.73 -65.52 0.55 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.118 1.367 . . . . 0.0 113.789 171.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 11.9 mt -67.68 -41.09 84.25 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 121.075 1.761 . . . . 0.0 111.036 -177.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.02 -24.09 65.9 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 177.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -80.03 -64.52 1.17 Allowed 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 124.982 1.313 . . . . 0.0 110.707 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.54 -34.9 77.84 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.112 1.152 . . . . 0.0 114.112 -178.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tt -65.32 -41.57 93.84 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 121.4 -0.813 . . . . 0.0 109.459 169.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.86 -40.14 95.37 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 126.709 2.099 . . . . 0.0 115.835 -175.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.06 -15.23 62.53 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 120.88 2.34 . . . . 0.0 112.9 169.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 43.2 tp 67.78 111.41 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 127.603 2.361 . . . . 0.0 109.834 -169.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 20.1 m -61.41 28.21 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 128.207 2.603 . . . . 0.0 115.232 174.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 81.87 -15.17 0.73 Allowed 'General case' 0 CA--C 1.535 0.394 0 O-C-N 119.768 -1.832 . . . . 0.0 113.077 156.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.3 p -56.14 31.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.098 1 C-N-CA 132.854 4.461 . . . . 0.0 115.649 168.172 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 2.0 t 56.71 26.27 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 128.15 2.58 . . . . 0.0 113.415 167.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 tt 80.42 106.47 0.07 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 127.51 2.324 . . . . 0.0 105.109 -167.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.554 1.098 0 C-N-CA 126.156 1.783 . . . . 0.0 115.695 -169.48 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 tm? . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.58 -14.9 59.9 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 175.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -93.03 -43.57 8.84 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.376 1.07 . . . . 0.0 111.991 172.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -62.89 -37.63 87.71 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.635 1.574 . . . . 0.0 112.417 -177.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.18 -23.23 52.14 Favored Glycine 0 CA--C 1.536 1.389 0 CA-C-N 120.034 1.288 . . . . 0.0 112.741 170.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.9 ttp85 -100.24 -0.43 38.62 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.903 1.446 . . . . 0.0 114.903 171.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -86.64 -35.66 19.24 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.918 1.235 . . . . 0.0 109.248 167.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.6 mp -70.65 -38.01 73.78 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 167.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -92.54 35.45 1.02 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 171.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.73 149.17 74.0 Favored Pre-proline 0 CA--C 1.542 0.664 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 165.513 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -41.79 -89.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.351 0.659 1 C-N-CA 126.495 4.797 . . . . 0.0 113.793 -167.257 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.52 -31.14 72.04 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 124.997 1.319 . . . . 0.0 111.066 175.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 54.5 mtm-85 -58.69 -33.76 70.52 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 119.547 1.067 . . . . 0.0 113.746 -177.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 49.3 t -58.64 -54.29 48.73 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.295 0.952 . . . . 0.0 110.694 172.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -72.01 -34.26 68.72 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.356 -0.84 . . . . 0.0 112.295 -179.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.5 mm -52.14 -46.39 43.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 124.61 1.164 . . . . 0.0 109.222 167.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 41.7 mt -64.71 -46.06 83.92 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 117.298 -1.334 . . . . 0.0 111.969 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.4 m -64.29 -35.23 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 CA-C-N 121.391 1.905 . . . . 0.0 112.235 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.37 -1.74 46.63 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.978 1.311 . . . . 0.0 113.483 177.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.54 -52.72 7.28 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 124.87 1.268 . . . . 0.0 108.533 169.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -44.47 -60.31 2.02 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.823 2.849 . . . . 0.0 114.015 -171.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -101.16 18.09 20.77 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 126.324 1.849 . . . . 0.0 111.279 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -109.44 -80.01 1.15 Allowed Glycine 0 C--N 1.337 0.635 0 C-N-CA 127.718 2.58 . . . . 0.0 111.164 -179.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.4 m 36.93 28.72 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 116.405 2.002 . . . . 0.0 116.405 -177.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 31.5 m -83.57 -72.12 0.47 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 120.506 1.503 . . . . 0.0 113.588 -173.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -137.36 160.8 64.1 Favored Pre-proline 0 N--CA 1.471 0.621 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -178.234 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -60.94 113.22 1.63 Allowed 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.234 1.956 . . . . 0.0 108.76 171.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.35 -2.33 60.97 Favored Glycine 0 CA--C 1.538 1.508 0 CA-C-O 118.099 -1.389 . . . . 0.0 116.042 -173.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -58.13 -20.1 37.76 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 120.579 2.189 . . . . 0.0 114.597 176.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.401 ' H ' HD12 ' A' ' 40' ' ' LEU . 1.8 mp -71.87 -9.16 57.93 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-O 118.758 -0.639 . . . . 0.0 112.327 176.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.96 -44.09 94.63 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.668 0.667 . . . . 0.0 111.688 177.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.7 -50.91 63.16 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 123.458 0.703 . . . . 0.0 110.684 172.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 -59.1 -27.62 65.74 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -177.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.9 mt -113.39 -22.39 10.41 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -173.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.44 -3.19 33.99 Favored Glycine 0 CA--C 1.535 1.301 0 CA-C-N 119.545 1.066 . . . . 0.0 114.337 -169.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -84.31 139.21 32.46 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.44 1.12 . . . . 0.0 109.803 175.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -55.16 147.82 15.51 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.545 -0.722 . . . . 0.0 111.053 -179.373 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -48.78 -27.75 3.19 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.483 1.113 . . . . 0.0 113.057 169.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.2 m -69.03 -46.35 68.18 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.1 0.96 . . . . 0.0 111.62 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -74.41 -39.35 62.69 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.119 0.872 . . . . 0.0 111.978 177.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.2 t -55.87 -48.43 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 118.621 -0.704 . . . . 0.0 110.57 169.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 39.2 m -64.88 -40.01 94.44 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 120.087 1.312 . . . . 0.0 113.073 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -56.08 -51.79 66.62 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.476 1.11 . . . . 0.0 111.675 176.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 -70.74 -28.51 64.76 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 120.595 -1.316 . . . . 0.0 113.506 177.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.9 mt -70.26 -30.07 67.01 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 117.933 -1.032 . . . . 0.0 112.751 172.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.1 p -49.52 -44.26 46.19 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.346 1.43 . . . . 0.0 113.259 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.5 t -70.51 -42.09 71.74 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.615 1.966 . . . . 0.0 112.873 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.1 tp -63.4 -29.54 70.82 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.927 1.691 . . . . 0.0 112.03 -177.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 56.1 mtm180 -83.67 -12.38 55.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.474 1.509 . . . . 0.0 113.651 172.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -97.17 -48.38 2.06 Favored Glycine 0 N--CA 1.474 1.21 0 C-N-CA 124.446 1.022 . . . . 0.0 111.13 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 69.1 m -68.49 10.62 0.23 Allowed 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 127.836 2.454 . . . . 0.0 114.142 170.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 63.48 14.5 54.62 Favored Glycine 0 N--CA 1.474 1.171 0 C-N-CA 126.581 2.038 . . . . 0.0 116.583 174.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 86.1 mt -75.7 -28.72 58.73 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 120.619 -1.518 . . . . 0.0 113.427 -179.147 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -134.05 135.12 55.14 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 125.757 1.623 . . . . 0.0 112.834 176.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 87.0 t -124.89 138.88 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 125.817 1.647 . . . . 0.0 109.235 -175.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.19 152.22 36.68 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 122.624 1.202 . . . . 0.0 112.9 178.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.2 m -160.4 163.21 33.3 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.769 1.627 . . . . 0.0 108.103 -170.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -85.87 148.32 25.85 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 119.125 0.875 . . . . 0.0 111.248 167.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.93 -14.39 41.98 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 121.35 -0.844 . . . . 0.0 111.745 167.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 138.21 -14.92 3.49 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 126.976 2.227 . . . . 0.0 113.628 -176.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 65.3 ttt-85 -157.49 -43.91 0.07 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.038 2.135 . . . . 0.0 111.861 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -101.33 179.33 4.39 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.408 1.883 . . . . 0.0 110.459 169.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 25.9 m -105.6 160.11 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 123.793 0.837 . . . . 0.0 112.484 171.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.8 ptt85 -142.88 170.28 15.98 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 129.397 3.079 . . . . 0.0 109.788 -172.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -110.9 120.36 42.14 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.358 1.063 . . . . 0.0 108.703 167.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -108.71 146.15 33.95 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.491 1.516 . . . . 0.0 111.159 174.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 tp -56.83 135.28 55.65 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 118.238 -0.886 . . . . 0.0 108.837 170.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.47 -42.34 70.56 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -170.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -154.35 159.28 41.09 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.849 1.66 . . . . 0.0 112.796 176.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.56 -36.98 0.12 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 130.797 3.639 . . . . 0.0 113.468 165.522 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -56.37 -48.3 77.12 Favored 'General case' 0 C--N 1.342 0.252 0 C-N-CA 126.178 1.791 . . . . 0.0 113.336 174.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 11.0 mt -69.59 -41.63 75.52 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 175.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.57 -37.99 76.94 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.974 1.309 . . . . 0.0 111.027 -175.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 -68.04 -55.42 12.65 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-O 117.538 -1.22 . . . . 0.0 112.177 173.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.41 -40.2 95.75 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 121.895 2.134 . . . . 0.0 112.753 -177.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.0 tp -61.54 -43.99 97.86 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.65 1.98 . . . . 0.0 112.664 170.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -78.55 -32.56 41.57 Favored Glycine 0 N--CA 1.478 1.442 0 C-N-CA 126.882 2.182 . . . . 0.0 114.301 -176.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.431 ' C ' ' H ' ' A' ' 90' ' ' VAL . 12.1 mm-40 -66.99 -6.12 15.61 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.538 1.135 . . . . 0.0 110.084 166.225 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 32.1 tp 78.56 -34.65 0.17 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 130.661 3.584 . . . . 0.0 112.794 167.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.431 ' H ' ' C ' ' A' ' 88' ' ' GLU . 0.2 OUTLIER 153.37 -21.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.021 1 C-N-CA 134.012 4.925 . . . . 0.0 111.423 173.19 . . . . . . . . 4 4 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 46.2 mm-40 71.24 -23.99 0.18 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.866 2.066 . . . . 0.0 114.428 -178.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.8 p -71.51 42.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 126.59 1.956 . . . . 0.0 115.135 -172.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER 63.28 17.73 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 C-N-CA 126.996 2.119 . . . . 0.0 112.504 177.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 62.4 mt 84.6 107.51 0.05 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 129.976 3.31 . . . . 0.0 109.693 -171.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.75 76.1 0.85 Allowed 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.089 -1.007 . . . . 0.0 110.002 169.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.0 t -44.74 149.09 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 127.487 2.315 . . . . 0.0 114.652 -169.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.62 25.75 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 128.532 2.733 . . . . 0.0 114.937 171.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 44.0 p -104.53 170.61 7.79 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.655 -1.278 . . . . 0.0 112.723 175.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -99.94 2.95 44.1 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 128.83 2.852 . . . . 0.0 113.842 -176.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -53.43 141.7 42.36 Favored Pre-proline 0 CA--C 1.556 1.192 0 N-CA-C 116.151 1.908 . . . . 0.0 116.151 -167.113 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -72.97 -168.97 0.45 Allowed 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 125.236 3.957 . . . . 0.0 111.489 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . 0.413 ' HA ' HH12 ' B' ' 13' ' ' ARG . 49.6 t . . . . . 0 CA--C 1.548 0.874 0 O-C-N 120.429 -1.42 . . . . 0.0 111.881 175.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 tm? . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.68 -5.7 39.4 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.933 1.457 . . . . 0.0 114.933 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . 0.413 HH12 ' HA ' ' A' ' 102' ' ' CYS . 67.3 ttt180 -86.08 -46.64 10.28 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 118.658 -0.687 . . . . 0.0 110.464 168.024 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.96 -41.37 99.51 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.368 0.985 . . . . 0.0 112.104 -168.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.8 -6.3 11.63 Favored Glycine 0 CA--C 1.542 1.774 0 CA-C-O 119.004 -0.887 . . . . 0.0 114.432 173.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 49.6 ttp85 -115.4 -3.68 12.41 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 127.187 2.195 . . . . 0.0 113.851 172.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -92.65 -27.96 16.97 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.478 1.511 . . . . 0.0 110.906 167.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 3.8 mp -79.18 -44.58 21.61 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 168.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -87.69 32.57 0.72 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 125.299 1.44 . . . . 0.0 114.619 171.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -64.17 151.94 89.25 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 126.924 2.09 . . . . 0.0 111.977 172.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -44.67 -36.27 10.17 Favored 'Trans proline' 0 C--N 1.357 0.987 1 C-N-CA 125.579 4.186 . . . . 0.0 114.718 177.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.411 ' HB ' HH21 ' B' ' 23' ' ' ARG . 5.6 m -130.18 -34.89 1.62 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.824 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . 0.411 HH21 ' HB ' ' B' ' 22' ' ' THR . 0.0 OUTLIER -60.28 -26.94 66.89 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 117.211 -1.376 . . . . 0.0 112.091 -179.742 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 42.3 t -55.13 -65.43 0.59 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 120.14 1.336 . . . . 0.0 112.193 168.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 17.4 ttm180 -68.65 -33.2 73.6 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.152 -0.968 . . . . 0.0 111.713 -177.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.1 mm -48.92 -55.03 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 O-C-N 121.049 -1.032 . . . . 0.0 109.053 168.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 56.6 mt -62.82 -36.44 83.17 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 116.798 -1.572 . . . . 0.0 112.613 -174.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 3.6 m -64.27 -38.48 82.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 CA-C-N 120.849 1.659 . . . . 0.0 111.045 175.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.35 -7.1 59.14 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.307 1.043 . . . . 0.0 113.547 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.15 -55.3 6.25 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 170.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -44.05 -61.29 1.51 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 128.433 2.693 . . . . 0.0 112.558 177.586 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -86.97 5.19 38.47 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.051 1.34 . . . . 0.0 112.086 -176.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.53 -73.16 0.53 Allowed Glycine 0 C--N 1.341 0.833 0 C-N-CA 126.465 1.983 . . . . 0.0 113.657 -173.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 25.4 m 37.65 29.52 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 116.183 1.92 . . . . 0.0 116.183 -174.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 25.7 m -82.91 -73.37 0.41 Allowed 'General case' 0 C--N 1.342 0.251 0 CA-C-N 120.358 1.435 . . . . 0.0 114.218 -173.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -148.36 164.68 20.79 Favored Pre-proline 0 N--CA 1.47 0.526 0 N-CA-C 114.012 1.115 . . . . 0.0 114.012 -175.486 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -55.1 119.65 6.87 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.136 1.891 . . . . 0.0 108.768 169.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.43 -4.05 83.97 Favored Glycine 0 CA--C 1.535 1.339 0 CA-C-O 117.249 -1.861 . . . . 0.0 115.897 -174.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -57.22 -27.17 61.78 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 121.203 2.501 . . . . 0.0 112.948 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 3.4 mt -67.96 -22.7 65.02 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 124.509 1.124 . . . . 0.0 111.593 178.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.16 -43.49 98.79 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 118.549 0.613 . . . . 0.0 111.156 -173.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.94 -50.86 64.76 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.664 0.786 . . . . 0.0 111.571 173.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -54.75 -35.77 64.09 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 178.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 17.3 mt -103.21 -21.64 13.84 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -172.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.41 -1.69 33.96 Favored Glycine 0 CA--C 1.537 1.467 0 CA-C-N 119.177 0.899 . . . . 0.0 113.418 -168.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -90.08 121.85 32.52 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 125.386 1.474 . . . . 0.0 108.531 176.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.8 t -47.7 139.08 7.63 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.29 1.036 . . . . 0.0 112.548 -175.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.12 -28.35 4.19 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.816 1.647 . . . . 0.0 113.577 174.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 50.3 m -62.32 -58.28 8.26 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.002 0.921 . . . . 0.0 111.358 170.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -76.12 -34.91 59.47 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.427 1.012 . . . . 0.0 113.483 -178.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 1.5 t -50.2 -47.83 24.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.906 1.23 . . . . 0.0 109.648 169.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 5.2 m -83.22 -27.9 29.64 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -177.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -45.88 -34.8 4.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.27 1.428 . . . . 0.0 112.429 173.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -113.26 2.12 15.44 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 127.373 2.269 . . . . 0.0 114.311 -178.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 46.7 mt -72.58 -24.64 61.12 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 119.615 -1.928 . . . . 0.0 109.116 166.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 18.3 p -43.11 -42.74 4.15 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.092 1.357 . . . . 0.0 111.75 167.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 12.5 t -75.36 -43.03 52.6 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tp -62.85 -34.57 77.62 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.488 1.515 . . . . 0.0 110.967 -176.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 60.5 mtm180 -82.46 -7.56 59.64 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.164 1.385 . . . . 0.0 113.867 173.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -97.89 -49.37 1.78 Allowed Glycine 0 N--CA 1.474 1.174 0 CA-C-N 119.391 0.996 . . . . 0.0 111.778 175.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 99.5 m -72.02 13.46 0.3 Allowed 'General case' 0 CA--C 1.565 1.551 0 C-N-CA 126.741 2.016 . . . . 0.0 113.223 175.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.89 0.04 12.53 Favored Glycine 0 N--CA 1.471 1.025 0 C-N-CA 127.597 2.522 . . . . 0.0 116.59 176.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 41.6 mt -65.62 -30.29 70.98 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.654 1.727 . . . . 0.0 113.702 -171.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -123.7 141.08 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 126.433 1.893 . . . . 0.0 111.771 170.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 74.3 t -123.7 138.15 54.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 125.538 1.535 . . . . 0.0 109.118 174.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.62 148.5 30.24 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.458 1.103 . . . . 0.0 113.013 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 8.7 m -160.48 162.87 33.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.144 1.378 . . . . 0.0 108.194 -168.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -81.75 147.28 29.52 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.842 1.201 . . . . 0.0 111.55 167.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.21 -14.62 43.38 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.169 0.895 . . . . 0.0 111.781 167.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 139.51 -18.01 3.06 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 126.851 2.167 . . . . 0.0 113.02 -177.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 58.5 ttt-85 -153.37 -46.09 0.09 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 127.326 2.251 . . . . 0.0 111.446 -176.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -97.61 -177.88 3.94 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.599 1.96 . . . . 0.0 109.975 170.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 33.8 m -109.09 158.74 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 123.869 0.868 . . . . 0.0 112.822 171.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 10.0 ptt85 -140.08 173.57 11.39 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 128.71 2.804 . . . . 0.0 110.12 -171.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -117.9 120.14 36.96 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.304 1.042 . . . . 0.0 108.476 167.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -103.96 151.43 23.19 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.901 1.28 . . . . 0.0 110.196 172.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 tp -60.43 143.81 52.48 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 168.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -42.66 -60.42 1.56 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.107 0.963 . . . . 0.0 112.612 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . 0.521 ' CG ' ' H ' ' B' ' 80' ' ' SER . 11.8 t70 -166.8 -174.83 2.87 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.42 1.488 . . . . 0.0 113.658 171.539 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 80' ' ' SER . . . . . 0.521 ' H ' ' CG ' ' B' ' 79' ' ' ASP . 4.2 m -35.65 -39.26 0.14 Allowed 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 130.196 3.398 . . . . 0.0 113.757 172.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -55.45 -52.41 63.71 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.344 1.057 . . . . 0.0 113.035 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 19.2 mt -75.1 -34.39 61.73 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.036 1.289 . . . . 0.0 110.08 175.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.31 -38.19 88.47 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.32 0.648 . . . . 0.0 110.729 -174.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -67.95 -55.04 14.21 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-O 117.425 -1.274 . . . . 0.0 111.816 169.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.99 -32.45 72.92 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 122.407 2.367 . . . . 0.0 113.977 -174.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.41 -43.37 50.28 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.245 1.418 . . . . 0.0 112.285 171.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -79.72 -26.35 56.56 Favored Glycine 0 CA--C 1.54 1.645 0 C-N-CA 124.809 1.195 . . . . 0.0 114.918 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.422 ' C ' ' H ' ' B' ' 90' ' ' VAL . 63.2 mm-40 -69.57 -10.6 58.83 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.704 1.202 . . . . 0.0 109.397 165.278 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 60.2 tp 80.87 -42.6 0.19 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 130.798 3.639 . . . . 0.0 110.574 171.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . 0.422 ' H ' ' C ' ' B' ' 88' ' ' GLU . 0.0 OUTLIER 160.54 -27.25 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.548 1 C-N-CA 133.057 4.543 . . . . 0.0 110.573 170.438 . . . . . . . . 4 4 . 1 . 020 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 79.93 -12.2 1.08 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.323 2.249 . . . . 0.0 113.129 -178.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 27.2 m -80.34 70.02 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 CA-C-O 125.641 2.639 . . . . 0.0 114.749 -168.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.344 0.7 OUTLIER 34.38 27.47 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.432 -1.347 2 C-N-CA 133.825 4.85 . . . . 0.0 114.595 -167.312 . . . . . . . . 4 3 . 1 . 020 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 34.3 mt 74.61 71.32 0.1 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.497 2.319 . . . . 0.0 110.985 -168.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.72 0 O-C-N 121.063 -1.023 . . . . 0.0 111.731 169.47 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp . . . . . 0 N--CA 1.488 1.442 0 N-CA-C 116.876 2.176 . . . . 0.0 116.876 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.93 -36.88 64.71 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.302 0.955 . . . . 0.0 111.475 -169.352 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.7 ttm105 -58.55 -48.05 82.18 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 117.648 -1.168 . . . . 0.0 110.622 169.748 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.66 -51.5 69.68 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.11 1.364 . . . . 0.0 111.095 -179.051 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.22 -38.86 91.35 Favored Glycine 0 CA--C 1.533 1.213 0 CA-C-N 119.044 0.838 . . . . 0.0 112.372 177.262 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -87.11 10.14 17.64 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.249 1.42 . . . . 0.0 114.174 175.972 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -117.93 -2.48 11.3 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.761 2.424 . . . . 0.0 111.469 169.364 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.0 mp -105.13 -36.26 7.33 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.232 0.923 . . . . 0.0 109.734 165.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.44 86.14 2.57 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 168.12 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -130.69 156.3 80.03 Favored Pre-proline 0 CA--C 1.54 0.576 0 C-N-CA 127.489 2.315 . . . . 0.0 110.71 -173.335 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -77.64 -122.81 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.361 3.374 . . . . 0.0 109.575 -174.603 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 54.1 m -57.65 -17.38 14.37 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 119.924 -1.735 . . . . 0.0 113.003 170.707 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.46 -18.27 60.66 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 120.8 -1.188 . . . . 0.0 112.606 171.475 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.5 t -85.38 -29.43 24.43 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 120.351 -1.468 . . . . 0.0 110.911 166.077 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.2 -43.28 74.27 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.678 -0.639 . . . . 0.0 109.798 167.859 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.3 mm -52.14 -51.3 31.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 CA-C-N 118.94 0.791 . . . . 0.0 112.177 169.211 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 52.9 mt -62.88 -38.39 90.67 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.126 0.788 . . . . 0.0 113.126 -177.167 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.9 p -79.18 -28.83 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 CA-C-N 119.395 0.998 . . . . 0.0 113.195 175.701 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.41 3.15 13.96 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.654 1.182 . . . . 0.0 112.953 169.351 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.45 HD22 ' CE2' ' A' ' 75' ' ' TYR . 0.3 OUTLIER -83.62 -52.38 6.5 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.02 1.328 . . . . 0.0 108.603 168.163 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.46 -52.73 27.17 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 128.728 2.811 . . . . 0.0 111.94 178.144 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -90.85 36.97 0.91 Allowed 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.861 2.064 . . . . 0.0 111.358 174.163 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -147.28 -93.26 0.12 Allowed Glycine 0 C--N 1.338 0.667 0 C-N-CA 125.588 1.566 . . . . 0.0 113.331 -172.77 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 28.4 m 38.84 29.44 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 C-N-CA 127.356 2.262 . . . . 0.0 116.053 -170.805 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 69.4 m -68.44 -89.43 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 127.872 2.469 . . . . 0.0 113.489 176.166 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -142.93 144.63 30.02 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 126.622 1.969 . . . . 0.0 110.72 -172.935 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -63.24 135.31 49.8 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 123.081 2.521 . . . . 0.0 111.162 -174.107 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.64 -3.13 56.44 Favored Glycine 0 CA--C 1.534 1.224 0 CA-C-O 118.628 -1.095 . . . . 0.0 114.589 -175.211 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.7 pp0? -70.17 -17.85 63.18 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.773 1.787 . . . . 0.0 112.841 176.198 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.8 mt -50.68 -22.02 1.87 Allowed 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.5 0.591 . . . . 0.0 111.525 171.227 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.39 -32.32 73.89 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.685 0.994 . . . . 0.0 113.685 178.468 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.8 -44.43 27.48 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.105 0.562 . . . . 0.0 110.448 169.118 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -63.65 -30.78 71.84 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.743 1.217 . . . . 0.0 114.081 -176.139 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 27.6 mt -101.41 -14.09 17.7 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.008 1.723 . . . . 0.0 113.71 176.223 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.57 0.39 31.32 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.43 1.014 . . . . 0.0 114.241 -170.612 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 88.8 mt -89.62 136.68 32.89 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.062 1.345 . . . . 0.0 109.732 -179.488 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.1 p -59.07 159.14 7.64 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -168.405 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 71.6 mtp85 -54.37 -30.4 51.65 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.836 176.634 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.4 m -69.09 -57.62 5.17 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.467 1.031 . . . . 0.0 111.225 169.56 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -54.9 -41.37 70.84 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.388 -0.82 . . . . 0.0 112.995 -178.797 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.4 t -71.95 -32.65 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 O-C-N 121.486 -0.759 . . . . 0.0 111.962 176.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 68.8 m -69.55 -33.75 73.22 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.364 0.984 . . . . 0.0 112.19 178.477 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -54.9 -48.81 72.56 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.729 0.695 . . . . 0.0 111.788 169.649 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 32.0 m80 -62.6 -40.28 96.43 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 177.538 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 84.1 mt -75.9 -17.86 59.62 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.54 1.536 . . . . 0.0 114.218 179.769 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 t -66.31 -41.84 89.16 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.858 1.208 . . . . 0.0 111.895 179.479 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 46.4 t -67.57 -48.28 67.36 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-O 122.8 1.286 . . . . 0.0 110.884 168.839 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.407 ' HB3' ' CG2' ' A' ' 64' ' ' VAL . 1.1 tp -62.45 -37.75 87.12 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.591 1.557 . . . . 0.0 114.362 -169.241 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.2 mtt85 -89.76 8.65 30.72 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 114.679 1.362 . . . . 0.0 114.679 173.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.414 ' C ' ' H ' ' A' ' 62' ' ' GLY . . . -108.38 -55.77 0.58 Allowed Glycine 0 N--CA 1.474 1.224 0 C-N-CA 124.959 1.266 . . . . 0.0 111.138 171.879 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 56.0 m -74.76 15.31 0.39 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 128.262 2.625 . . . . 0.0 112.863 179.409 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 60' ' ' GLY . . . 73.97 -5.68 24.09 Favored Glycine 0 C--N 1.34 0.799 0 C-N-CA 128.415 2.912 . . . . 0.0 116.296 169.497 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.4 mt -60.93 -30.42 70.19 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.57 1.685 . . . . 0.0 114.106 -173.059 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.407 ' CG2' ' HB3' ' A' ' 58' ' ' LEU . 1.5 m -138.87 151.21 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 125.854 1.662 . . . . 0.0 111.115 169.395 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.2 t -149.86 144.7 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 123.234 0.614 . . . . 0.0 112.559 176.059 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -78.89 140.43 38.11 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.108 1.363 . . . . 0.0 113.092 178.527 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.5 m -143.07 134.07 25.6 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 126.062 1.745 . . . . 0.0 106.956 -168.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -61.78 127.04 29.54 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 121.18 1.809 . . . . 0.0 111.191 172.851 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.409 ' CD ' ' H ' ' A' ' 70' ' ' GLY 0.313 2.8 pp20? -85.34 -134.15 0.06 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 118.147 -0.93 . . . . 0.0 110.314 174.344 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.409 ' H ' ' CD ' ' A' ' 69' ' ' GLU . . . -72.77 -37.77 57.12 Favored Glycine 0 CA--C 1.531 1.068 0 CA-C-N 120.892 1.678 . . . . 0.0 113.408 176.27 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.0 ttp85 -154.9 -9.38 0.13 Allowed 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -179.524 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -111.8 -173.08 2.17 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.618 2.367 . . . . 0.0 107.707 171.37 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 4.3 m -104.8 146.42 12.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 124.017 0.927 . . . . 0.0 108.916 166.768 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -111.27 -162.66 0.81 Allowed 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 127.279 2.231 . . . . 0.0 109.713 172.752 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.45 ' CE2' HD22 ' A' ' 30' ' ' LEU . 1.1 p90 -159.24 96.87 1.33 Allowed 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 127.107 2.163 . . . . 0.0 106.557 -172.092 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -94.23 156.16 16.68 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.701 1.6 . . . . 0.0 111.233 -177.466 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.1 mt -62.7 160.13 14.84 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 165.471 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -42.44 -47.04 4.94 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.545 1.138 . . . . 0.0 114.056 -177.932 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -169.02 172.37 7.59 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 126.309 1.843 . . . . 0.0 108.63 176.728 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -34.33 -36.67 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 128.762 2.825 . . . . 0.0 111.226 162.836 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -38.96 -67.83 0.19 Allowed 'General case' 0 C--N 1.344 0.35 0 C-N-CA 128.552 2.741 . . . . 0.0 113.542 168.662 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 17.4 mt -79.07 -36.01 41.56 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 118.673 -0.679 . . . . 0.0 109.757 -173.16 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.77 -34.19 62.29 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.924 0.784 . . . . 0.0 112.597 170.096 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 -83.14 -59.73 2.38 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.738 178.738 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.35 -32.36 73.76 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -176.232 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.77 -35.98 59.96 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 121.417 -0.802 . . . . 0.0 110.656 169.846 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.58 -42.87 62.29 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 125.403 1.478 . . . . 0.0 114.44 -173.76 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -77.83 -23.61 48.95 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.734 1.267 . . . . 0.0 111.96 169.352 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 22.1 tp 80.74 146.38 0.09 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 129.583 3.153 . . . . 0.0 113.859 166.19 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.9 m -48.9 -7.39 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 129.142 2.977 . . . . 0.0 117.14 -178.387 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 74.89 -44.01 0.53 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 128.147 2.579 . . . . 0.0 113.008 172.893 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.8 p -50.94 44.68 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.34 1 C-N-CA 133.793 4.837 . . . . 0.0 118.435 -169.804 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 59.25 10.35 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 128.896 2.878 . . . . 0.0 112.756 -172.622 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.2 tt 75.28 113.9 0.06 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.821 2.448 . . . . 0.0 106.056 -165.503 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.51 77.94 0.11 Allowed 'General case' 0 CA--C 1.551 1.013 0 O-C-N 121.137 -0.977 . . . . 0.0 112.477 -177.274 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.0 m -57.98 140.81 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 125.743 1.617 . . . . 0.0 114.468 -174.948 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.79 104.0 0.07 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.94 2.496 . . . . 0.0 110.216 171.544 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 11.9 p -153.18 -72.3 0.14 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.458 1.103 . . . . 0.0 111.041 -169.157 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . 0.251 30.9 m-20 64.21 43.49 4.88 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 127.377 2.271 . . . . 0.0 112.996 171.591 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -66.39 158.12 79.29 Favored Pre-proline 0 CA--C 1.544 0.735 0 CA-C-N 113.769 -1.56 . . . . 0.0 110.413 168.028 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -59.8 161.8 17.47 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.463 2.776 . . . . 0.0 111.357 169.412 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.812 0 CA-C-O 121.29 0.566 . . . . 0.0 111.004 -178.408 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 27.2 tp . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 116.708 2.114 . . . . 0.0 116.708 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.09 -33.67 63.71 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 119.217 0.917 . . . . 0.0 111.041 -169.339 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 7.0 ttm105 -55.23 -46.81 76.0 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 118.521 -0.752 . . . . 0.0 110.719 169.267 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.34 -50.0 74.34 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.906 1.282 . . . . 0.0 111.063 -179.666 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -59.07 -31.3 68.52 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-N 119.323 0.965 . . . . 0.0 112.831 177.624 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.6 3.08 55.09 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 174.436 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.09 -17.49 14.31 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 127.587 2.355 . . . . 0.0 111.706 172.701 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 4.3 mp -93.8 -44.91 7.89 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.416 0.687 . . . . 0.0 110.853 168.151 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.71 70.55 7.49 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.734 0.778 . . . . 0.0 110.807 172.675 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -127.12 132.97 24.57 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 128.066 2.546 . . . . 0.0 106.105 176.404 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -52.89 -94.01 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.862 1 C-N-CA 126.603 4.868 . . . . 0.0 115.806 -165.936 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 5.3 m -58.19 -25.37 61.49 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.623 1.569 . . . . 0.0 111.214 178.517 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 13.4 ttp180 -73.91 -34.69 64.47 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 179.635 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 52.8 t -63.03 -36.97 85.35 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.573 1.533 . . . . 0.0 109.572 167.605 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.1 mtm180 -61.78 -41.41 97.68 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.949 0.9 . . . . 0.0 112.354 169.823 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mm -61.41 -47.47 93.3 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 CA-C-N 120.235 1.38 . . . . 0.0 111.48 170.284 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 52.8 mt -62.47 -40.9 98.13 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.814 0.845 . . . . 0.0 112.101 -179.301 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 3.7 p -77.59 -28.2 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 177.462 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.17 -12.23 59.67 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 121.138 -0.976 . . . . 0.0 113.183 170.208 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.08 -54.07 16.97 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.292 1.037 . . . . 0.0 108.806 169.263 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 2.6 mt -41.3 -66.7 0.31 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 128.164 2.586 . . . . 0.0 111.201 173.273 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -79.75 32.05 0.25 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.667 1.987 . . . . 0.0 112.403 177.836 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -143.74 -80.91 0.05 OUTLIER Glycine 0 C--N 1.338 0.693 0 C-N-CA 125.002 1.287 . . . . 0.0 113.832 -173.867 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 23.6 m 37.43 22.83 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 N-CA-C 118.447 2.758 . . . . 0.0 118.447 -175.289 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 91.3 m -76.11 -69.66 0.49 Allowed 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.979 1.718 . . . . 0.0 113.274 179.87 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -144.14 159.12 53.75 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 123.684 0.794 . . . . 0.0 112.785 -168.629 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -60.79 138.18 77.67 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 123.748 2.965 . . . . 0.0 111.757 173.892 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 66.39 0.0 7.27 Favored Glycine 0 CA--C 1.533 1.204 0 CA-C-O 119.099 -0.834 . . . . 0.0 114.578 177.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -67.51 -29.16 68.5 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 119.077 1.439 . . . . 0.0 111.217 -178.154 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.7 mp -56.07 -15.16 3.24 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 124.23 1.012 . . . . 0.0 112.892 177.591 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.0 -46.04 78.85 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.635 0.774 . . . . 0.0 111.739 170.75 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.25 -42.24 75.88 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.096 0.862 . . . . 0.0 111.417 174.494 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -63.57 -31.05 72.1 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.103 1.361 . . . . 0.0 113.751 -177.48 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 29.9 mt -99.18 -10.38 22.54 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.55 1.54 . . . . 0.0 113.485 175.391 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.63 8.11 55.72 Favored Glycine 0 CA--C 1.537 1.428 0 CA-C-N 118.984 0.811 . . . . 0.0 113.737 -169.303 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 91.3 mt -88.83 162.82 15.96 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 118.615 1.208 . . . . 0.0 111.742 -177.232 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.5 p -70.67 154.81 41.5 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.634 -1.291 . . . . 0.0 110.287 175.26 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 68.0 mtp85 -54.03 -40.47 67.09 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.096 172.019 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 5.6 m -59.2 -49.39 78.04 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.172 0.989 . . . . 0.0 112.877 173.163 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -61.6 -46.62 89.05 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.595 -0.691 . . . . 0.0 110.934 178.657 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 19.3 t -67.18 -37.1 78.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.047 -179.204 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 56.6 m -58.86 -42.91 90.52 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 119.825 1.193 . . . . 0.0 112.855 170.984 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 34.9 m-20 -56.52 -46.57 80.5 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.05 0.841 . . . . 0.0 111.269 176.374 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -66.26 -40.65 90.3 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 121.719 -0.613 . . . . 0.0 112.32 176.759 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 88.2 mt -68.5 -18.49 64.4 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.908 0.883 . . . . 0.0 113.054 175.24 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.03 -53.74 54.28 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.229 1.377 . . . . 0.0 112.225 -179.16 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 17.5 t -65.99 -44.51 84.64 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.244 0.545 . . . . 0.0 110.326 173.86 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 2.5 tp -55.54 -40.53 71.99 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.092 1.757 . . . . 0.0 113.796 -172.816 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 64.5 mtm180 -83.53 -11.86 56.9 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.057 1.343 . . . . 0.0 113.367 176.447 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -85.62 -54.34 2.82 Favored Glycine 0 N--CA 1.47 0.949 0 C-N-CA 124.466 1.031 . . . . 0.0 110.673 170.828 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 31.2 m -58.45 -6.06 0.63 Allowed 'General case' 0 CA--C 1.56 1.356 0 C-N-CA 126.583 1.953 . . . . 0.0 114.519 174.708 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.87 -2.18 42.88 Favored Glycine 0 CA--C 1.531 1.08 0 C-N-CA 124.65 1.119 . . . . 0.0 114.065 -175.396 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 79.6 mt -57.24 -26.4 60.69 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.387 1.875 . . . . 0.0 113.386 -177.281 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -132.43 143.75 38.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 127.276 2.23 . . . . 0.0 110.177 168.508 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 22.1 t -143.3 139.09 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 125.726 1.61 . . . . 0.0 109.624 -172.54 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.7 153.59 40.01 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 178.108 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 93.7 m -162.01 139.67 8.69 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.36 1.464 . . . . 0.0 108.639 -178.828 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -71.12 123.39 22.04 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 119.946 1.248 . . . . 0.0 109.489 169.037 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.296 0.0 OUTLIER -69.97 -76.35 0.1 Allowed 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.711 1.141 . . . . 0.0 110.351 179.251 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -142.29 -29.98 0.14 Allowed Glycine 0 CA--C 1.534 1.277 0 C-N-CA 127.408 2.432 . . . . 0.0 113.282 169.714 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 6.4 ttp85 -145.93 -10.21 0.52 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.703 1.601 . . . . 0.0 113.914 179.067 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -117.56 172.07 7.59 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 127.0 2.12 . . . . 0.0 109.413 170.012 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 27.8 m -97.88 145.88 8.79 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 164.439 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -126.51 175.49 7.87 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 126.864 2.066 . . . . 0.0 109.718 -176.008 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -120.65 117.03 26.47 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 164.349 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -93.03 166.05 12.55 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.488 1.515 . . . . 0.0 109.123 169.525 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -66.93 166.67 13.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.857 0.863 . . . . 0.0 109.428 167.363 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -47.68 -47.52 29.56 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.538 1.135 . . . . 0.0 113.649 174.77 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -176.72 170.36 2.39 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 126.638 1.975 . . . . 0.0 109.427 -179.442 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -34.65 -36.96 0.05 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 129.373 3.069 . . . . 0.0 111.491 162.723 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -43.25 -69.39 0.14 Allowed 'General case' 0 C--N 1.341 0.205 0 C-N-CA 128.698 2.799 . . . . 0.0 113.295 169.626 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 19.0 mt -70.55 -28.76 65.16 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.22 0.918 . . . . 0.0 111.237 177.528 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -66.49 -34.54 78.14 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.001 0.818 . . . . 0.0 111.388 -176.81 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -79.57 -55.51 4.98 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 117.273 -1.346 . . . . 0.0 110.134 171.611 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.92 -32.17 67.51 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -176.019 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.63 -43.89 15.15 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.386 -0.822 . . . . 0.0 110.939 169.796 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.47 -29.51 71.58 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 125.106 1.336 . . . . 0.0 114.776 -170.134 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -82.88 -25.0 32.94 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.827 1.251 . . . . 0.0 112.451 168.556 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . 0.486 ' C ' ' H ' ' B' ' 91' ' ' GLN . 21.4 tp 71.22 142.71 0.06 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 129.962 3.305 . . . . 0.0 112.238 -177.754 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 12.1 m -42.62 -4.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 C-N-CA 129.487 3.115 . . . . 0.0 117.187 168.606 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.486 ' H ' ' C ' ' B' ' 89' ' ' LEU . 2.5 mm-40 71.68 -29.55 0.2 Allowed 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 128.969 2.908 . . . . 0.0 114.565 173.29 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 4.5 p -58.8 39.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 131.619 3.968 . . . . 0.0 116.488 -175.736 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 60.83 11.63 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 128.779 2.832 . . . . 0.0 113.259 -177.13 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.0 tt 78.85 113.68 0.07 Allowed 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 128.74 2.816 . . . . 0.0 106.35 -166.905 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.887 0 O-C-N 121.045 -1.035 . . . . 0.0 111.868 175.721 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 mm? . . . . . 0 CA--C 1.545 0.762 0 N-CA-C 110.624 -0.139 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.11 -42.29 96.92 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 120.661 -1.274 . . . . 0.0 113.363 168.962 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.5 mmt180 -59.93 -43.93 94.64 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 121.461 -0.774 . . . . 0.0 110.367 173.129 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -58.93 -42.26 89.3 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.421 1.888 . . . . 0.0 112.551 176.25 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.7 -30.11 76.59 Favored Glycine 0 N--CA 1.47 0.904 0 O-C-N 120.689 -1.257 . . . . 0.0 112.999 177.199 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.7 ttt-85 -73.44 -41.3 63.39 Favored 'General case' 0 C--O 1.221 -0.395 0 O-C-N 121.725 -0.867 . . . . 0.0 110.817 169.991 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.83 -32.65 65.97 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 176.554 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.5 mt -75.15 -44.93 44.15 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.344 1.058 . . . . 0.0 112.772 172.122 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -84.28 -14.24 50.35 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 116.56 2.059 . . . . 0.0 116.56 -175.507 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -50.94 148.7 7.21 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 126.74 2.016 . . . . 0.0 115.082 -170.843 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.44 ' HG2' ' H ' ' A' ' 22' ' ' THR . 47.8 Cg_endo -49.41 -64.97 0.18 Allowed 'Trans proline' 0 C--N 1.351 0.666 1 C-N-CA 125.889 4.393 . . . . 0.0 112.652 -173.538 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.44 ' H ' ' HG2' ' A' ' 21' ' ' PRO . 52.8 m -82.39 -31.58 29.61 Favored 'General case' 0 C--O 1.226 -0.145 0 CA-C-O 118.452 -0.785 . . . . 0.0 111.756 175.054 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.89 -32.06 65.12 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 120.313 1.415 . . . . 0.0 114.406 -171.304 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.8 t -61.46 -50.38 73.02 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.0 0.818 . . . . 0.0 110.39 170.438 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -57.63 -45.48 85.36 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.812 1.245 . . . . 0.0 113.044 174.363 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 mm -51.6 -53.39 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.388 1.075 . . . . 0.0 110.607 169.515 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.6 mt -56.28 -51.91 66.43 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 117.617 -1.183 . . . . 0.0 111.74 178.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -61.21 -38.18 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 CA-C-N 119.532 1.06 . . . . 0.0 112.404 -178.645 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.83 -15.41 61.17 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 176.327 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.0 tp -74.12 -40.16 62.85 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 120.778 1.626 . . . . 0.0 112.806 175.487 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.4 mt -51.56 -46.61 63.47 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.596 1.559 . . . . 0.0 110.978 175.116 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -86.12 11.98 10.64 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 126.533 1.933 . . . . 0.0 113.277 176.305 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.41 -92.79 0.92 Allowed Glycine 0 N--CA 1.468 0.794 0 C-N-CA 126.848 2.166 . . . . 0.0 114.447 -174.345 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 30.4 m 36.04 41.12 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 127.182 2.193 . . . . 0.0 114.75 -167.326 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 98.9 m -87.38 -102.99 0.07 Allowed 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 124.14 0.976 . . . . 0.0 110.679 175.761 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -112.52 168.87 7.03 Favored Pre-proline 0 CA--C 1.55 0.976 0 O-C-N 120.034 -1.666 . . . . 0.0 114.356 -170.17 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.25 111.4 2.26 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.14 1.893 . . . . 0.0 109.899 -176.002 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.54 7.21 76.05 Favored Glycine 0 CA--C 1.532 1.096 0 CA-C-O 119.166 -0.797 . . . . 0.0 114.354 -175.974 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.01 -21.79 23.4 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 119.45 1.625 . . . . 0.0 115.076 177.97 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.7 mp -63.72 -17.04 62.6 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 123.384 0.674 . . . . 0.0 111.845 175.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.33 -25.2 67.76 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.915 0.78 . . . . 0.0 112.992 173.607 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.55 -50.17 14.58 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.656 0.662 . . . . 0.0 110.146 168.706 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -56.29 -38.78 71.68 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 179.752 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.4 mt -99.36 -19.83 16.81 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.42 1.088 . . . . 0.0 113.438 -172.515 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.64 -11.03 3.51 Favored Glycine 0 CA--C 1.539 1.544 0 C-N-CA 124.525 1.059 . . . . 0.0 113.254 -168.303 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.38 128.15 34.81 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 125.147 1.379 . . . . 0.0 108.051 175.461 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.2 t -56.33 154.99 7.42 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 122.29 1.043 . . . . 0.0 112.019 -176.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.6 ptt-85 -54.93 -16.53 2.78 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.129 0.971 . . . . 0.0 113.316 175.02 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.6 t -65.32 -67.79 0.41 Allowed 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.404 1.002 . . . . 0.0 109.48 167.766 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -54.5 -42.81 71.22 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.604 1.093 . . . . 0.0 112.836 176.947 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.3 t -63.4 -45.48 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-O 118.389 -0.815 . . . . 0.0 111.41 177.005 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 26.0 m -71.57 -35.4 70.56 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.793 1.633 . . . . 0.0 112.837 178.311 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -56.15 -56.79 16.56 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.595 1.558 . . . . 0.0 110.094 173.746 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -73.0 -28.65 62.5 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -179.87 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 44.0 mt -64.3 -33.9 76.89 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.895 1.225 . . . . 0.0 111.72 169.671 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 66.7 m -62.04 -45.31 94.13 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.368 1.44 . . . . 0.0 113.683 -170.795 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 17.6 t -72.14 -21.07 61.52 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 119.432 1.015 . . . . 0.0 112.293 170.816 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.2 tp -67.31 -38.12 84.45 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 120.525 1.511 . . . . 0.0 110.439 171.528 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 90.9 mtm-85 -73.78 -15.24 61.2 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.078 1.351 . . . . 0.0 112.305 172.889 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.446 ' C ' ' H ' ' A' ' 62' ' ' GLY . . . -90.18 -58.51 1.56 Allowed Glycine 0 C--N 1.338 0.69 0 N-CA-C 109.323 -1.511 . . . . 0.0 109.323 179.499 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 69.7 m -60.89 10.82 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 128.113 2.565 . . . . 0.0 114.375 173.191 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.446 ' H ' ' C ' ' A' ' 60' ' ' GLY . . . 62.87 16.12 56.3 Favored Glycine 0 N--CA 1.469 0.864 0 C-N-CA 127.229 2.347 . . . . 0.0 115.631 173.668 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 82.6 mt -78.45 -26.91 46.3 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.532 1.166 . . . . 0.0 112.941 -179.566 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.8 m -132.54 142.81 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.771 1.228 . . . . 0.0 113.686 178.249 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 20.5 t -129.78 139.88 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.979 2.112 . . . . 0.0 109.893 -177.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.03 138.16 43.88 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.272 0.629 . . . . 0.0 112.272 170.726 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.98 161.51 35.47 Favored 'General case' 0 CA--C 1.509 -0.604 0 CA-C-O 121.706 0.765 . . . . 0.0 110.191 170.503 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -73.69 122.66 22.7 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 105.893 -1.892 . . . . 0.0 105.893 165.152 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -75.39 -22.99 57.02 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.773 1.169 . . . . 0.0 112.542 169.804 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 118.69 105.32 2.21 Favored Glycine 0 C--N 1.337 0.584 0 N-CA-C 106.798 -2.521 . . . . 0.0 106.798 -168.344 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 13.8 ttt85 76.01 -57.33 0.57 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.615 1.966 . . . . 0.0 111.621 -169.209 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -98.14 -166.95 1.44 Allowed 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 119.13 0.877 . . . . 0.0 111.249 -179.426 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 10.4 p -128.67 149.63 33.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 126.255 1.822 . . . . 0.0 108.649 -176.797 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.5 ptt180 -136.0 169.73 17.14 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 126.268 1.827 . . . . 0.0 110.998 -177.732 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -112.34 139.5 47.85 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 164.012 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -139.81 150.86 45.21 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.533 1.133 . . . . 0.0 110.394 -178.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.05 129.41 20.72 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.28 1.032 . . . . 0.0 108.302 170.031 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.9 -24.34 66.83 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -170.533 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -161.09 156.61 24.76 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 123.217 1.484 . . . . 0.0 112.9 -179.817 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 91.2 p -43.04 -36.48 1.61 Allowed 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 128.809 2.844 . . . . 0.0 114.87 168.519 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 -58.5 -42.88 88.62 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.08 -1.012 . . . . 0.0 112.559 175.904 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.3 mt -73.06 -38.3 66.51 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 118.685 0.675 . . . . 0.0 109.389 179.062 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.55 89.05 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.469 0.708 . . . . 0.0 109.23 -179.53 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -70.98 -51.97 22.47 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.951 1.7 . . . . 0.0 113.495 175.581 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.2 -45.19 95.62 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.734 1.152 . . . . 0.0 112.736 -179.654 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.0 tt -56.49 -55.59 31.88 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.836 0.855 . . . . 0.0 108.99 169.468 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.78 -17.54 78.32 Favored Glycine 0 CA--C 1.543 1.835 0 C-N-CA 125.601 1.572 . . . . 0.0 115.603 -167.93 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -73.58 -23.25 59.92 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 119.36 1.58 . . . . 0.0 110.361 166.998 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 52.7 tp 72.81 117.83 0.05 OUTLIER 'General case' 0 C--N 1.343 0.314 0 C-N-CA 129.261 3.024 . . . . 0.0 107.68 -171.872 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 21.7 t -69.1 18.78 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 125.902 1.681 . . . . 0.0 113.591 -169.078 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.402 ' C ' ' H ' ' A' ' 93' ' ' VAL . 1.7 tp-100 91.19 -21.64 0.1 Allowed 'General case' 0 C--O 1.221 -0.446 0 O-C-N 119.494 -2.004 . . . . 0.0 110.349 126.319 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.461 ' C ' ' H ' ' A' ' 94' ' ' LEU . 7.7 p -72.44 41.61 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 127.628 2.371 . . . . 0.0 111.43 165.376 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.402 ' H ' ' C ' ' A' ' 91' ' ' GLN . 0.7 OUTLIER 68.6 -27.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 C-N-CA 129.608 3.163 . . . . 0.0 113.57 -173.162 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.461 ' H ' ' C ' ' A' ' 92' ' ' VAL . 45.8 tp 138.28 112.67 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.35 1 C-N-CA 133.116 4.566 . . . . 0.0 106.032 -169.644 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.41 106.84 0.27 Allowed 'General case' 0 CA--C 1.546 0.813 0 O-C-N 121.603 -0.686 . . . . 0.0 111.356 169.432 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.2 t -58.87 158.8 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 127.494 2.317 . . . . 0.0 110.916 169.89 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -85.85 18.83 2.76 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.261 1.824 . . . . 0.0 115.015 -179.568 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.4 p -75.36 96.99 3.5 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.198 0.999 . . . . 0.0 111.906 -178.347 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.79 49.34 1.77 Allowed 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 126.662 1.985 . . . . 0.0 110.534 170.503 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 66.6 mm-40 -103.1 -174.41 0.34 Allowed Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 127.674 2.389 . . . . 0.0 112.43 -169.738 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.28 149.7 88.2 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.988 2.459 . . . . 0.0 110.495 164.207 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.9 t . . . . . 0 CA--C 1.535 0.39 0 CA-C-O 124.303 2.002 . . . . 0.0 114.994 -170.339 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? . . . . . 0 CA--C 1.545 0.75 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.62 -29.08 69.82 Favored 'General case' 0 CA--C 1.546 0.793 0 O-C-N 119.605 -1.934 . . . . 0.0 112.45 170.44 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 11.8 mmt-85 -66.04 -39.52 90.24 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.94 0.896 . . . . 0.0 111.691 170.39 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -57.32 -41.29 79.67 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.146 1.378 . . . . 0.0 111.879 -178.55 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -61.77 -37.24 93.97 Favored Glycine 0 N--CA 1.476 1.305 0 CA-C-N 120.339 1.427 . . . . 0.0 113.535 -178.391 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 9.2 ttt-85 -80.58 -24.11 39.41 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 118.054 0.927 . . . . 0.0 111.937 170.611 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.39 -33.94 74.51 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.138 -1.601 . . . . 0.0 112.498 170.289 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 17.5 mt -83.62 -42.14 17.04 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.163 0.985 . . . . 0.0 111.242 174.409 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -100.08 65.23 1.26 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.833 1.253 . . . . 0.0 112.746 173.307 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -120.81 149.56 50.96 Favored Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 126.082 1.753 . . . . 0.0 108.974 176.881 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -59.74 -63.73 0.12 Allowed 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 124.601 3.534 . . . . 0.0 112.725 -171.839 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.3 m -77.99 -37.75 46.49 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-O 118.709 -0.662 . . . . 0.0 110.066 174.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -67.0 -37.2 83.77 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -169.6 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 22.2 t -62.7 -49.53 74.74 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.644 1.111 . . . . 0.0 111.139 171.811 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 64.5 mtt180 -53.81 -46.67 71.18 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.243 1.017 . . . . 0.0 112.982 172.841 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 11.3 mm -51.9 -53.27 18.36 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 C-N-CA 124.63 1.172 . . . . 0.0 110.787 170.47 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 78.2 mt -57.85 -47.38 82.86 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 117.837 -1.077 . . . . 0.0 111.667 179.131 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.5 m -64.29 -39.52 85.81 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 119.914 1.233 . . . . 0.0 112.813 -179.995 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.32 -8.64 59.78 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -179.274 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 13.2 mt -69.42 -45.17 69.8 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 118.279 -0.867 . . . . 0.0 112.907 169.207 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -44.48 -63.29 0.92 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.27 2.628 . . . . 0.0 112.569 -176.525 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -95.63 8.31 43.76 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 126.53 1.932 . . . . 0.0 112.788 -177.365 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.14 -85.88 1.83 Allowed Glycine 0 C--N 1.338 0.66 0 C-N-CA 127.818 2.628 . . . . 0.0 110.435 173.185 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 34.11 44.53 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.754 1.621 . . . . 0.0 113.552 -167.728 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 88.6 m -105.18 -145.54 0.38 Allowed 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 123.571 1.653 . . . . 0.0 109.655 170.038 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.79 166.03 13.42 Favored Pre-proline 0 C--N 1.317 -0.847 0 N-CA-C 117.609 2.448 . . . . 0.0 117.609 -160.47 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -72.32 110.9 3.07 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 122.25 1.966 . . . . 0.0 107.797 -175.996 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.81 13.27 75.61 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-O 118.227 -1.319 . . . . 0.0 114.908 -171.676 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.59 -36.82 64.83 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.603 1.701 . . . . 0.0 111.297 171.013 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.5 mp -56.14 -15.8 4.26 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 124.634 1.174 . . . . 0.0 113.926 -179.756 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.16 -43.74 92.09 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 119.233 0.924 . . . . 0.0 111.507 172.933 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.43 -25.04 54.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.764 0.826 . . . . 0.0 113.125 175.347 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -70.26 -32.71 70.67 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.422 -0.799 . . . . 0.0 112.813 172.288 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 12.8 mt -111.0 -20.18 12.51 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -169.426 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.88 4.83 78.12 Favored Glycine 0 CA--C 1.535 1.285 0 CA-C-N 119.926 1.239 . . . . 0.0 113.75 -169.731 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -100.24 135.67 41.32 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 125.065 1.346 . . . . 0.0 110.82 178.503 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 6.2 t -55.9 154.47 7.24 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.385 -0.822 . . . . 0.0 112.544 177.796 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 32.9 ptt-85 -51.57 -23.76 4.57 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.251 1.42 . . . . 0.0 113.539 174.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 25.7 t -63.66 -67.08 0.46 Allowed 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 118.526 0.603 . . . . 0.0 110.751 169.484 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -58.07 -35.73 71.79 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.209 1.003 . . . . 0.0 113.455 -179.892 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 15.4 t -59.43 -47.96 88.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 118.767 0.712 . . . . 0.0 111.793 169.899 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 35.7 m -78.31 -32.54 49.36 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -175.638 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -60.15 -49.85 76.01 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.053 0.941 . . . . 0.0 110.176 176.477 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -72.95 -34.36 66.47 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 117.981 -1.009 . . . . 0.0 113.68 175.363 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 28.3 mt -56.38 -30.72 63.06 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 120.643 1.565 . . . . 0.0 112.526 169.571 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 67.7 m -69.54 -49.8 51.0 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 120.144 1.338 . . . . 0.0 114.571 -170.79 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 16.6 t -63.19 -27.55 69.44 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 119.708 1.14 . . . . 0.0 111.678 171.599 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 11.8 tp -66.36 -39.98 89.47 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.108 2.163 . . . . 0.0 112.35 177.271 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 82.2 mtm-85 -67.65 -33.52 75.11 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 119.145 0.884 . . . . 0.0 110.327 173.228 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -71.46 -53.64 9.87 Favored Glycine 0 N--CA 1.466 0.634 0 N-CA-C 110.251 -1.14 . . . . 0.0 110.251 179.226 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 57.1 m -55.98 -4.6 0.13 Allowed 'General case' 0 CA--C 1.56 1.332 0 C-N-CA 128.112 2.565 . . . . 0.0 113.961 173.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.78 16.66 67.47 Favored Glycine 0 C--N 1.343 0.953 0 C-N-CA 127.347 2.403 . . . . 0.0 113.645 170.083 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 90.7 mt -94.52 -21.11 19.08 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 -169.648 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 4.5 m -140.44 156.17 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -173.77 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 96.2 t -147.21 149.48 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 125.702 1.601 . . . . 0.0 111.019 -173.144 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.4 125.2 41.89 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.012 0.925 . . . . 0.0 111.906 169.168 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.15 165.85 16.84 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.254 1.021 . . . . 0.0 110.313 -176.154 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -76.04 122.57 24.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.817 168.675 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -85.78 -24.97 26.63 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 118.316 0.507 . . . . 0.0 111.357 167.067 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 125.96 105.33 1.47 Allowed Glycine 0 C--N 1.34 0.778 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -174.191 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 71.15 -52.1 0.69 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.999 2.12 . . . . 0.0 111.403 -169.639 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -91.45 -178.04 4.99 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.643 1.177 . . . . 0.0 110.444 177.568 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 11.2 p -125.61 138.24 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 125.976 1.71 . . . . 0.0 108.884 179.896 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 38.1 ptt180 -115.17 166.28 12.0 Favored 'General case' 0 CA--C 1.509 -0.628 0 C-N-CA 124.708 1.203 . . . . 0.0 109.415 -176.78 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -115.75 135.94 53.54 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 168.979 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -141.77 160.91 39.22 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.88 1.672 . . . . 0.0 112.055 -169.098 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 49.7 mt -68.19 152.67 45.13 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.803 0.841 . . . . 0.0 109.271 167.421 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.22 -22.35 38.86 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 -169.5 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -167.07 158.14 12.0 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.383 1.473 . . . . 0.0 112.76 179.068 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 89.5 p -40.01 -39.84 0.94 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 128.811 2.845 . . . . 0.0 114.949 168.221 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -55.97 -43.81 77.92 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.701 0.8 . . . . 0.0 111.571 175.9 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 1.9 mt -78.0 -42.14 33.61 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.408 1.004 . . . . 0.0 110.194 -176.471 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.12 -38.9 63.06 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.852 0.861 . . . . 0.0 111.043 171.777 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . 0.45 HH22 ' CD ' ' B' ' 88' ' ' GLU . 18.5 tpt180 -70.95 -52.72 18.15 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.574 1.55 . . . . 0.0 113.659 177.041 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.94 -40.38 88.73 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 118.89 0.768 . . . . 0.0 112.43 177.622 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.88 -49.32 77.13 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.971 1.308 . . . . 0.0 109.883 169.564 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.05 -29.95 63.94 Favored Glycine 0 CA--C 1.536 1.384 0 C-N-CA 125.636 1.588 . . . . 0.0 114.768 -169.552 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . 0.45 ' CD ' HH22 ' B' ' 84' ' ' ARG . 4.4 tp10 -73.75 -14.63 61.15 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 118.971 1.385 . . . . 0.0 111.128 167.197 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . 0.409 ' C ' ' H ' ' B' ' 91' ' ' GLN . 28.2 tp 70.78 157.08 0.16 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 129.001 2.921 . . . . 0.0 107.922 -166.861 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . 0.467 HG23 ' H ' ' B' ' 95' ' ' ALA . 27.8 m -53.91 -11.84 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 O-C-N 121.055 -1.028 . . . . 0.0 112.654 167.397 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.421 ' C ' ' H ' ' B' ' 93' ' ' VAL . 3.6 tp-100 76.5 -20.04 0.39 Allowed 'General case' 0 C--N 1.345 0.376 0 C-N-CA 127.742 2.417 . . . . 0.0 112.287 161.487 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 3.9 p -68.05 38.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 128.593 2.757 . . . . 0.0 113.903 169.515 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . 0.421 ' H ' ' C ' ' B' ' 91' ' ' GLN . 2.3 t 74.72 -34.42 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 C-N-CA 130.039 3.336 . . . . 0.0 112.301 -178.718 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 38.3 tp 155.3 111.12 0.0 OUTLIER 'General case' 0 C--N 1.341 0.236 0 C-N-CA 131.664 3.986 . . . . 0.0 108.123 178.073 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . 0.467 ' H ' HG23 ' B' ' 90' ' ' VAL . . . . . . . . 0 CA--C 1.546 0.82 0 O-C-N 121.638 -0.664 . . . . 0.0 109.557 165.943 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . 0.258 4.0 pp . . . . . 0 N--CA 1.469 0.49 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.53 -46.75 89.01 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.465 1.03 . . . . 0.0 111.004 168.613 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -59.11 -38.31 79.26 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 120.452 1.478 . . . . 0.0 112.679 174.705 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -63.36 -57.47 10.23 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.036 0.834 . . . . 0.0 110.853 177.366 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -61.15 -32.34 80.12 Favored Glycine 0 CA--C 1.533 1.178 0 O-C-N 121.335 -0.853 . . . . 0.0 113.007 178.267 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -68.15 -4.04 12.47 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.295 1.548 . . . . 0.0 114.144 -178.807 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -128.31 -15.87 4.54 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 167.898 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.6 mp -101.39 -15.76 17.1 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 178.641 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.23 75.09 4.62 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.571 1.548 . . . . 0.0 107.329 167.281 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -164.46 147.92 7.69 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 123.757 0.823 . . . . 0.0 113.125 -168.441 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -63.63 -96.87 0.0 OUTLIER 'Trans proline' 0 CA--C 1.547 1.145 1 C-N-CA 125.45 4.1 . . . . 0.0 111.512 174.065 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.422 ' HG1' ' CD2' ' A' ' 54' ' ' HIS . 41.3 p -47.98 -35.6 11.17 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 128.12 2.568 . . . . 0.0 112.912 169.677 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -75.96 -46.71 28.33 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 121.532 1.969 . . . . 0.0 113.94 -169.17 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 37.3 t -59.17 -42.42 90.76 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.93 0.786 . . . . 0.0 109.514 169.943 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -54.66 -43.37 72.34 Favored 'General case' 0 CA--C 1.555 1.163 0 CA-C-O 117.93 -1.033 . . . . 0.0 112.641 171.251 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.1 mt -56.28 -51.7 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 CA-C-N 121.858 2.117 . . . . 0.0 110.338 172.338 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.17 -40.05 88.56 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 118.486 -0.769 . . . . 0.0 112.796 -177.165 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.6 p -81.67 -24.62 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 CA-C-N 119.637 1.108 . . . . 0.0 113.067 178.324 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.75 -31.03 63.14 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.638 1.175 . . . . 0.0 111.972 172.844 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 tp -64.64 -39.68 94.12 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 120.787 -1.196 . . . . 0.0 113.513 170.441 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -44.6 -44.41 8.87 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.626 2.37 . . . . 0.0 114.283 -174.753 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -103.56 -19.31 14.41 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.36 1.064 . . . . 0.0 112.978 169.089 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.71 -2.28 57.41 Favored Glycine 0 C--O 1.218 -0.871 0 CA-C-O 114.992 -3.115 . . . . 0.0 117.257 -165.076 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 19.7 m -32.99 54.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 N-CA-C 119.668 3.21 . . . . 0.0 119.668 169.418 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.9 m -109.42 -67.47 0.98 Allowed 'General case' 0 C--O 1.224 -0.287 0 O-C-N 119.828 -1.795 . . . . 0.0 110.728 -174.167 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -148.78 157.14 41.13 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-O 117.901 -1.047 . . . . 0.0 110.976 -174.456 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -55.98 -31.93 83.94 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.166 2.578 . . . . 0.0 113.827 179.121 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -81.33 -8.26 87.36 Favored Glycine 0 CA--C 1.532 1.135 0 CA-C-O 118.352 -1.249 . . . . 0.0 114.851 176.338 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.85 -37.58 84.73 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 119.554 1.677 . . . . 0.0 111.531 -170.881 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.5 mt -58.5 -24.58 60.84 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 123.699 0.8 . . . . 0.0 111.33 178.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.59 -36.67 67.14 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 119.265 0.938 . . . . 0.0 111.427 -175.366 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.39 -51.94 10.88 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.933 0.893 . . . . 0.0 112.529 172.756 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -53.57 -32.92 52.89 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 178.239 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 55.6 mt -97.33 -11.31 24.19 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 126.442 1.897 . . . . 0.0 112.617 -179.104 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 61.69 18.42 56.41 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-O 118.598 -1.112 . . . . 0.0 113.867 -170.812 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.8 mt -122.19 148.17 45.28 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 119.277 1.539 . . . . 0.0 113.733 -169.661 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.3 t -58.79 138.12 57.35 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.074 178.572 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.4 -24.82 65.44 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -171.325 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.7 m -63.8 -47.89 79.06 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.4 1.08 . . . . 0.0 112.687 170.196 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -75.2 -32.83 61.31 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 118.76 0.709 . . . . 0.0 111.712 178.341 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.9 t -58.89 -41.52 83.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 120.982 -1.074 . . . . 0.0 110.343 167.848 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 57.8 m -63.1 -40.29 97.19 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 177.844 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -51.07 -50.52 58.53 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.488 1.115 . . . . 0.0 111.572 173.405 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.422 ' CD2' ' HG1' ' A' ' 22' ' ' THR . 9.3 m-70 -69.87 -37.23 76.01 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 115.4 -2.238 . . . . 0.0 113.598 176.205 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 37.7 mt -61.25 -34.09 74.58 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 121.437 1.926 . . . . 0.0 113.279 175.464 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.4 m -53.12 -39.26 63.34 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.184 -0.947 . . . . 0.0 113.441 -177.797 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 3.2 t -66.99 -51.08 59.45 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 118.878 0.763 . . . . 0.0 111.085 176.603 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.431 ' CD1' ' H ' ' A' ' 58' ' ' LEU . 2.6 mp -59.64 -36.2 75.9 Favored 'General case' 0 N--CA 1.484 1.259 0 O-C-N 120.792 -1.192 . . . . 0.0 111.885 -175.394 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 90.4 mtm180 -76.17 -21.7 56.22 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.336 1.055 . . . . 0.0 112.71 -176.721 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.3 -36.11 4.5 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.893 1.235 . . . . 0.0 114.49 176.991 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 59.9 m -70.63 -17.03 62.88 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 125.003 1.321 . . . . 0.0 112.441 173.396 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 95.17 20.14 28.7 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 128.137 2.78 . . . . 0.0 115.782 172.295 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.1 mt -83.4 -20.38 34.27 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 119.333 1.567 . . . . 0.0 114.499 177.091 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.9 t -134.33 140.74 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 124.637 1.175 . . . . 0.0 110.612 -179.057 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.6 t -135.31 135.93 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 126.273 1.829 . . . . 0.0 108.672 -170.977 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.09 157.57 37.52 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 122.628 1.204 . . . . 0.0 112.214 172.399 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 30.3 m -153.54 154.34 34.11 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.842 1.657 . . . . 0.0 106.587 175.301 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -74.23 162.44 28.93 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.936 0.789 . . . . 0.0 112.379 169.758 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -139.91 171.32 14.38 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 126.309 1.844 . . . . 0.0 111.911 178.246 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -68.14 75.42 0.26 Allowed Glycine 0 CA--C 1.527 0.834 0 C-N-CA 125.837 1.684 . . . . 0.0 112.525 179.366 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 95.9 18.96 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 129.945 3.298 . . . . 0.0 111.987 179.7 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -158.06 -178.63 7.44 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 120.972 -1.08 . . . . 0.0 110.551 -175.17 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 32.5 m -121.76 156.48 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 124.148 0.979 . . . . 0.0 109.198 167.257 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -132.51 178.3 6.95 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 124.767 1.227 . . . . 0.0 110.452 -170.23 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -129.54 134.92 48.01 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.525 168.862 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -130.09 151.64 50.4 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 126.414 1.886 . . . . 0.0 108.834 179.596 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.12 157.76 15.22 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.257 0.48 . . . . 0.0 110.708 175.536 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -43.04 -54.61 4.23 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.748 1.619 . . . . 0.0 113.544 -178.201 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -165.7 165.66 18.47 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.834 1.653 . . . . 0.0 110.137 -173.843 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.16 -35.72 0.08 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 129.687 3.195 . . . . 0.0 111.642 165.803 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -46.53 -69.2 0.14 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.307 1.843 . . . . 0.0 113.145 169.172 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.4 mt -71.57 -34.01 69.57 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.083 0.856 . . . . 0.0 110.771 -174.487 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.65 -45.91 90.61 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 118.673 -0.68 . . . . 0.0 111.923 175.612 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.03 -43.28 71.63 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 117.318 -1.325 . . . . 0.0 111.651 176.416 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.37 -47.86 80.53 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.785 1.175 . . . . 0.0 113.238 177.063 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.25 -39.62 74.92 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.763 -0.585 . . . . 0.0 111.136 178.472 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.69 -36.79 61.83 Favored Glycine 0 CA--C 1.531 1.059 0 C-N-CA 125.311 1.434 . . . . 0.0 114.565 -176.7 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -72.68 -5.96 41.15 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.651 1.226 . . . . 0.0 112.521 172.655 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 52.0 tp 75.01 107.62 0.07 Allowed 'General case' 0 C--N 1.345 0.392 0 C-N-CA 129.764 3.226 . . . . 0.0 112.459 166.349 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.81 32.67 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 125.81 1.644 . . . . 0.0 112.328 -169.756 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 79.93 -10.8 1.25 Allowed 'General case' 0 C--O 1.221 -0.433 0 O-C-N 120.387 -1.445 . . . . 0.0 113.824 122.123 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 12.3 p -71.94 54.08 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 C-N-CA 130.218 3.407 . . . . 0.0 109.963 166.647 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 71.92 -10.87 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 126.632 1.973 . . . . 0.0 114.355 178.268 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.3 tt 117.47 103.67 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 131.291 3.836 . . . . 0.0 106.755 -169.355 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.81 76.72 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.173 0 C-N-CA 125.115 1.366 . . . . 0.0 114.383 174.269 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.1 t -82.08 145.4 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 125.686 1.594 . . . . 0.0 107.728 167.269 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -69.82 13.99 0.12 Allowed 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 178.137 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.82 34.48 0.12 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.966 1.306 . . . . 0.0 109.771 166.74 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -57.83 130.54 46.92 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 125.254 1.422 . . . . 0.0 109.245 -166.742 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -132.31 132.78 23.1 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.958 -160.693 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -53.39 150.71 25.56 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 125.142 3.894 . . . . 0.0 117.968 -163.499 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 41.5 t . . . . . 0 CA--C 1.551 1.016 0 C-N-CA 127.066 2.146 . . . . 0.0 112.727 177.171 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 pp . . . . . 0 N--CA 1.472 0.63 0 N-CA-C 116.827 2.158 . . . . 0.0 116.827 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.01 -30.21 62.33 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 121.048 1.749 . . . . 0.0 112.404 174.0 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -57.57 -51.23 70.34 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.369 0.986 . . . . 0.0 109.69 171.305 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -58.9 -63.36 1.32 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.827 0.851 . . . . 0.0 109.563 175.797 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -59.98 -40.84 97.49 Favored Glycine 0 C--O 1.219 -0.825 0 CA-C-O 117.64 -1.644 . . . . 0.0 112.831 -169.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -87.07 -12.31 47.59 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.212 2.006 . . . . 0.0 114.085 -179.428 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -86.95 -31.56 20.59 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.773 1.17 . . . . 0.0 111.467 168.103 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.6 mp -83.77 -19.12 35.64 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.616 0.766 . . . . 0.0 111.207 171.899 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.16 63.73 1.89 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.29 1.836 . . . . 0.0 110.597 167.713 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -144.22 137.39 13.96 Favored Pre-proline 0 CA--C 1.547 0.841 0 N-CA-C 104.19 -2.522 . . . . 0.0 104.19 167.831 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . 0.523 ' HG2' ' H ' ' B' ' 22' ' ' THR . 57.1 Cg_endo -52.13 -77.42 0.02 OUTLIER 'Trans proline' 0 CA--C 1.548 1.183 1 C-N-CA 125.816 4.344 . . . . 0.0 112.703 -175.853 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.759 ' HG1' ' CD2' ' B' ' 54' ' ' HIS . 2.0 p -41.19 -49.89 3.56 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 129.605 3.162 . . . . 0.0 112.586 168.251 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 37.6 ttt180 -72.95 -34.83 66.77 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.12 0.968 . . . . 0.0 111.979 -168.076 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 46.8 t -63.09 -51.48 66.46 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.19 0.905 . . . . 0.0 109.802 167.595 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -57.99 -35.01 70.61 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.034 1.334 . . . . 0.0 112.364 178.729 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 5.3 mm -56.1 -61.87 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 125.629 1.571 . . . . 0.0 108.644 169.085 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 82.1 mt -64.36 -40.2 95.37 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.585 0.754 . . . . 0.0 111.997 -169.366 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 8.6 p -70.96 -23.97 24.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 177.311 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.38 -21.0 20.47 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 175.32 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.6 mt -58.2 -46.37 85.95 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.112 -0.993 . . . . 0.0 110.021 168.664 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.7 mt -44.66 -36.62 3.19 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 129.355 3.062 . . . . 0.0 114.484 175.193 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -100.01 -18.79 16.86 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.276 1.831 . . . . 0.0 112.751 -177.963 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -108.32 -66.97 0.6 Allowed Glycine 0 C--N 1.341 0.861 0 C-N-CA 125.203 1.382 . . . . 0.0 115.033 -170.509 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 15.7 m 34.3 36.1 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 C-N-CA 127.069 2.147 . . . . 0.0 115.815 -169.182 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 72.7 m -85.02 -72.63 0.47 Allowed 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.066 0.947 . . . . 0.0 112.68 -176.587 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -148.29 153.08 40.41 Favored Pre-proline 0 N--CA 1.474 0.769 0 CA-C-O 117.767 -1.111 . . . . 0.0 112.306 -169.932 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -54.39 -31.31 67.44 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 123.127 2.551 . . . . 0.0 113.783 -178.063 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -84.46 -7.04 85.25 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-O 117.868 -1.518 . . . . 0.0 115.301 175.53 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -30.4 70.9 Favored 'General case' 0 C--N 1.347 0.498 0 CA-C-N 120.534 2.167 . . . . 0.0 112.224 -170.704 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.4 mt -67.09 -13.33 61.83 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 119.082 -0.485 . . . . 0.0 111.567 -175.444 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.63 -31.71 66.53 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.286 0.948 . . . . 0.0 112.358 171.473 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.84 -48.91 13.83 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.312 0.645 . . . . 0.0 111.422 171.533 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -55.05 -32.38 61.84 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 179.94 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 67.0 mt -104.16 -23.43 13.27 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.751 1.62 . . . . 0.0 112.095 -176.077 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.65 8.63 72.6 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 124.271 0.938 . . . . 0.0 113.402 -169.073 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 92.0 mt -111.1 148.95 31.56 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 125.48 1.512 . . . . 0.0 110.674 -170.554 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.3 t -59.57 150.79 26.18 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -177.862 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -21.77 64.72 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -174.993 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 9.4 m -73.7 -41.26 62.85 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 120.952 -1.093 . . . . 0.0 112.526 169.164 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -68.82 -39.72 79.89 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.599 0.76 . . . . 0.0 110.955 174.781 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 43.7 t -54.3 -50.46 56.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.896 0.878 . . . . 0.0 109.725 167.09 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 68.6 m -60.56 -40.38 91.44 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -178.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -53.99 -50.56 66.29 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.265 1.026 . . . . 0.0 112.217 -178.788 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . 0.759 ' CD2' ' HG1' ' B' ' 22' ' ' THR . 73.1 m-70 -79.04 -10.91 59.96 Favored 'General case' 0 CA--C 1.552 1.025 0 O-C-N 120.847 -1.158 . . . . 0.0 114.044 175.865 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 81.2 mt -80.26 -28.84 38.35 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.592 1.542 . . . . 0.0 111.651 167.422 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 68.9 m -53.74 -46.1 70.76 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 117.754 -1.117 . . . . 0.0 113.064 -176.65 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 4.0 t -72.16 -44.5 62.98 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.803 1.183 . . . . 0.0 109.579 176.91 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 3.6 tp -50.82 -38.23 47.52 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.873 2.469 . . . . 0.0 114.572 -173.26 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 47.3 mtp180 -80.74 -9.93 59.77 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.318 1.847 . . . . 0.0 112.604 -179.785 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -105.68 -32.93 3.71 Favored Glycine 0 CA--C 1.539 1.592 0 C-N-CA 127.166 2.317 . . . . 0.0 113.825 169.212 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 86.9 m -55.72 -27.68 51.76 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 126.389 1.876 . . . . 0.0 112.052 169.387 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.95 25.17 58.47 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 126.089 1.804 . . . . 0.0 112.488 -173.398 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 91.4 mt -86.83 -25.32 24.61 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.19 1.495 . . . . 0.0 113.279 175.562 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.1 m -127.61 131.85 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 124.772 1.229 . . . . 0.0 112.544 179.074 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 49.6 t -121.0 136.48 57.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.493 1.517 . . . . 0.0 109.83 -179.863 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.06 155.73 28.67 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.13 1.372 . . . . 0.0 113.35 170.571 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 87.3 m -155.15 151.55 28.38 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.853 1.661 . . . . 0.0 107.435 178.728 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -76.84 150.58 36.08 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.792 0.723 . . . . 0.0 112.25 173.886 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -125.12 170.76 10.89 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 127.001 2.12 . . . . 0.0 112.377 178.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -67.46 78.86 0.17 Allowed Glycine 0 CA--C 1.528 0.846 0 C-N-CA 125.221 1.391 . . . . 0.0 112.209 177.16 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 93.62 17.43 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 129.418 3.087 . . . . 0.0 112.359 178.802 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -157.07 -179.67 8.43 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.806 1.242 . . . . 0.0 109.974 -176.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 27.2 m -117.68 158.61 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.122 0.969 . . . . 0.0 109.328 166.608 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -131.83 176.93 7.93 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 124.851 1.26 . . . . 0.0 110.653 -175.082 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -136.34 153.88 51.01 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 125.193 1.397 . . . . 0.0 109.236 170.607 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -157.3 154.91 29.81 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 124.278 1.031 . . . . 0.0 110.871 -172.742 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -50.71 129.47 22.87 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.02 1.328 . . . . 0.0 107.581 168.362 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.18 -38.89 74.28 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 -169.563 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -151.13 163.68 38.25 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 123.1 1.428 . . . . 0.0 111.775 174.892 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.53 -36.79 0.11 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 129.761 3.225 . . . . 0.0 111.603 165.867 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -47.75 -63.94 0.92 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.198 1.799 . . . . 0.0 112.468 169.835 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 9.4 mt -71.59 -38.74 70.85 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.201 0.91 . . . . 0.0 110.369 -177.828 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.73 -47.13 77.45 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.307 0.643 . . . . 0.0 112.198 177.538 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 4.8 ppt_? -71.58 -47.54 54.14 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 117.868 -1.063 . . . . 0.0 111.589 178.706 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.62 -44.23 72.95 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.484 1.038 . . . . 0.0 113.387 176.776 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.82 -40.05 66.13 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.451 -0.781 . . . . 0.0 111.804 177.003 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.34 -36.38 50.22 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 124.935 1.255 . . . . 0.0 114.348 -174.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -74.01 -5.38 41.04 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 118.632 1.216 . . . . 0.0 112.548 169.855 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . 0.441 ' C ' ' H ' ' B' ' 91' ' ' GLN . 50.3 tp 72.27 112.56 0.06 Allowed 'General case' 0 C--N 1.343 0.303 0 C-N-CA 129.582 3.153 . . . . 0.0 112.751 166.891 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.6 t -70.93 23.8 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 127.272 2.229 . . . . 0.0 113.186 -175.38 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.441 ' H ' ' C ' ' B' ' 89' ' ' LEU . 1.4 tp-100 84.78 -14.89 0.58 Allowed 'General case' 0 N--CA 1.472 0.656 0 O-C-N 119.726 -1.859 . . . . 0.0 114.314 121.697 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 8.1 p -64.34 49.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 130.492 3.517 . . . . 0.0 112.058 167.741 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 63.38 13.41 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 126.682 1.993 . . . . 0.0 114.306 -176.388 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt 100.73 108.35 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 130.004 3.322 . . . . 0.0 107.686 -169.519 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.08 0 C-N-CA 125.226 1.41 . . . . 0.0 113.022 171.181 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.8 mt . . . . . 0 CA--C 1.542 0.663 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.23 9.94 4.11 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -178.472 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.42 -35.26 6.82 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.378 0.671 . . . . 0.0 111.781 167.339 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -61.05 -51.92 67.16 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.213 1.405 . . . . 0.0 110.254 176.921 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.67 -23.83 69.2 Favored Glycine 0 CA--C 1.534 1.255 0 O-C-N 121.136 -0.977 . . . . 0.0 113.058 173.489 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.18 -33.62 65.52 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 118.872 1.336 . . . . 0.0 110.761 172.714 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -79.99 -34.46 38.54 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.637 1.175 . . . . 0.0 113.542 177.846 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 mt -63.82 -41.88 97.76 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.705 0.802 . . . . 0.0 112.486 174.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -94.28 -10.01 34.2 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -173.474 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -51.76 147.22 12.14 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.006 1.722 . . . . 0.0 111.344 -178.845 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.412 ' HG2' ' H ' ' A' ' 22' ' ' THR . 55.8 Cg_endo -35.57 -79.13 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.709 1 C-N-CA 127.864 5.71 . . . . 0.0 113.112 -166.804 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.412 ' H ' ' HG2' ' A' ' 21' ' ' PRO . 2.9 p -81.24 -22.26 38.89 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 116.42 -1.752 . . . . 0.0 113.23 178.385 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.4 mtm-85 -63.33 -45.6 90.55 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 121.531 1.968 . . . . 0.0 111.67 175.98 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 25.1 t -50.8 -48.63 59.51 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.611 1.096 . . . . 0.0 110.749 169.545 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.1 mtm-85 -62.41 -47.75 82.72 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.467 1.107 . . . . 0.0 113.521 176.997 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.1 mm -53.13 -47.11 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.613 1.565 . . . . 0.0 110.863 170.319 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 48.8 mt -70.15 -43.02 71.74 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 117.746 -1.121 . . . . 0.0 112.769 -177.711 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.4 p -73.0 -25.99 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 119.95 1.25 . . . . 0.0 111.195 179.21 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.49 -12.95 59.48 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.743 1.217 . . . . 0.0 113.014 169.473 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.1 tp -82.42 -36.49 26.61 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 116.948 -1.501 . . . . 0.0 112.139 169.223 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -43.48 -58.17 2.73 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.005 2.122 . . . . 0.0 112.881 -175.463 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -98.22 9.28 43.33 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.662 1.585 . . . . 0.0 112.403 172.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -108.54 -33.89 2.79 Favored Glycine 0 C--N 1.342 0.865 0 CA-C-O 114.585 -3.342 . . . . 0.0 117.92 -168.344 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 33.9 m -15.59 43.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.069 2 C-N-CA 132.251 4.22 . . . . 0.0 122.122 175.801 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.8 m -95.78 -60.39 1.66 Allowed 'General case' 0 C--N 1.327 -0.386 0 O-C-N 118.763 -2.461 . . . . 0.0 111.514 178.205 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -146.41 151.55 43.9 Favored Pre-proline 0 N--CA 1.476 0.845 0 N-CA-C 116.633 2.086 . . . . 0.0 116.633 -169.214 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -63.83 133.1 37.45 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 123.479 2.786 . . . . 0.0 110.744 178.321 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.5 -2.62 52.52 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-O 118.753 -1.026 . . . . 0.0 114.444 -176.882 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -58.52 -28.91 65.88 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.344 1.572 . . . . 0.0 112.882 179.272 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mp -69.25 -2.52 10.81 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 122.481 0.312 . . . . 0.0 111.499 -172.067 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.99 -38.16 90.05 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.13 0.572 . . . . 0.0 110.541 169.091 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.94 -36.06 64.63 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.441 0.697 . . . . 0.0 111.999 170.708 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -66.73 -36.52 82.67 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 177.301 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.1 mt -105.03 -20.72 13.44 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -172.563 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.79 11.22 83.49 Favored Glycine 0 CA--C 1.537 1.416 0 CA-C-N 119.46 1.027 . . . . 0.0 113.091 -168.451 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.5 mt -100.75 148.18 25.19 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.697 1.199 . . . . 0.0 111.46 -176.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.2 t -61.15 144.04 54.38 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 122.16 0.981 . . . . 0.0 111.891 -172.84 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.78 -20.15 54.91 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.222 1.009 . . . . 0.0 113.589 179.468 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.5 p -70.78 -60.12 2.42 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.442 1.019 . . . . 0.0 109.414 167.083 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -54.32 -42.08 69.76 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.71 1.604 . . . . 0.0 114.684 178.481 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 5.0 t -64.32 -41.21 91.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 O-C-N 119.876 -1.765 . . . . 0.0 111.813 171.898 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 55.0 m -62.45 -43.36 99.01 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 119.159 0.89 . . . . 0.0 112.071 173.612 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -55.74 -45.36 78.02 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 127.004 2.121 . . . . 0.0 112.261 175.678 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 23.6 m170 -64.33 -40.51 96.04 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.149 -0.969 . . . . 0.0 112.863 171.693 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.6 mt -67.36 -25.32 65.92 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 118.691 0.678 . . . . 0.0 112.349 178.068 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.3 m -62.08 -44.76 95.97 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.213 1.37 . . . . 0.0 114.364 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 42.8 t -60.37 -54.0 50.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.975 1.31 . . . . 0.0 110.482 169.508 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -51.22 -42.59 61.06 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 128.535 2.734 . . . . 0.0 113.677 -177.668 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 9.1 mtm-85 -83.26 -4.4 58.39 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.538 1.535 . . . . 0.0 113.143 178.802 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -110.05 -26.31 5.0 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 126.236 1.874 . . . . 0.0 114.107 174.092 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 2.6 m -74.51 -1.46 21.44 Favored 'General case' 0 CA--C 1.564 1.504 0 C-N-CA 129.928 3.291 . . . . 0.0 111.724 168.86 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.82 14.45 37.37 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 126.184 1.849 . . . . 0.0 113.571 -175.122 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.9 mt -69.07 -30.23 68.51 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.458 -1.025 . . . . 0.0 111.676 172.777 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.8 t -134.43 132.44 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.902 0.881 . . . . 0.0 112.814 -167.472 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 89.0 t -126.61 141.13 46.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 126.058 1.743 . . . . 0.0 111.098 -168.074 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -93.68 148.7 21.86 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.202 1.401 . . . . 0.0 113.045 173.99 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.8 m -169.61 152.77 4.78 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.649 1.98 . . . . 0.0 107.119 -175.713 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -79.91 141.42 36.1 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 119.853 1.206 . . . . 0.0 112.895 174.788 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.263 0.0 OUTLIER -89.47 -17.94 27.7 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 122.603 0.361 . . . . 0.0 111.444 166.588 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 123.0 -30.26 5.1 Favored Glycine 0 N--CA 1.474 1.208 0 C-N-CA 126.592 2.044 . . . . 0.0 114.24 169.444 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.38 -15.96 14.88 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 128.226 2.611 . . . . 0.0 112.08 172.919 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -158.6 167.0 30.75 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 129.397 3.079 . . . . 0.0 109.469 -176.256 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 6.0 p -91.96 150.62 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.221 1.009 . . . . 0.0 109.908 168.543 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 12.3 ptt85 -126.49 163.93 22.28 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.95 0.881 . . . . 0.0 111.405 -176.422 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -111.28 156.41 21.55 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 114.294 -1.321 . . . . 0.0 107.584 164.519 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -163.19 151.22 13.57 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.143 0.977 . . . . 0.0 109.902 -176.413 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 14.5 mt -57.44 152.14 15.11 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 119.009 0.822 . . . . 0.0 109.02 167.314 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.14 -33.11 73.87 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -170.065 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -169.85 163.21 9.66 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.396 1.478 . . . . 0.0 112.684 -174.243 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 98.3 p -42.69 -33.81 0.79 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 128.491 2.717 . . . . 0.0 114.34 166.931 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -52.98 -52.09 59.42 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.864 1.666 . . . . 0.0 112.25 170.494 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 35.2 mt -73.0 -39.66 65.85 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 118.934 -0.555 . . . . 0.0 109.794 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.46 -44.52 72.61 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.441 1.096 . . . . 0.0 113.295 178.905 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -65.71 -49.8 67.18 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 120.007 1.276 . . . . 0.0 112.615 178.865 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.81 -44.99 83.98 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.46 1.027 . . . . 0.0 112.471 -179.46 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -64.84 -37.88 89.09 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.879 0.872 . . . . 0.0 110.714 176.605 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.9 -22.06 64.11 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 126.118 1.818 . . . . 0.0 114.102 176.996 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -115.75 23.5 12.25 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.129 1.372 . . . . 0.0 112.659 170.098 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 30.6 tp 76.53 -38.85 0.33 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 128.969 2.908 . . . . 0.0 112.92 171.205 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.6 m 160.96 -19.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.262 1 C-N-CA 132.312 4.245 . . . . 0.0 111.207 -170.389 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 93.59 -8.18 0.14 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 129.486 3.115 . . . . 0.0 113.533 175.96 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.1 p -66.85 41.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 C-N-CA 128.105 2.562 . . . . 0.0 116.646 -172.339 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER 71.09 13.5 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 C-N-CA 126.56 1.944 . . . . 0.0 112.371 174.138 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 88.91 95.13 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 130.111 3.364 . . . . 0.0 108.883 179.521 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.4 139.8 49.88 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.155 179.156 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.4 m -85.34 152.87 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 122.378 1.085 . . . . 0.0 111.492 179.239 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -79.84 12.35 2.72 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.472 1.509 . . . . 0.0 114.925 -168.749 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.9 m -104.29 47.35 0.88 Allowed 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.587 1.555 . . . . 0.0 109.863 -176.243 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -49.93 88.57 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 129.123 2.969 . . . . 0.0 113.14 -167.734 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -106.96 152.88 41.11 Favored Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 113.998 1.111 . . . . 0.0 113.998 -164.985 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -88.58 117.94 0.98 Allowed 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 122.087 1.858 . . . . 0.0 113.746 -175.24 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . 0.558 3.3 t . . . . . 0 N--CA 1.438 -1.045 0 CA-C-N 111.344 -2.662 . . . . 0.0 113.854 -161.302 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 87.8 mt . . . . . 0 CA--C 1.536 0.43 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.28 -4.24 13.59 Favored 'General case' 0 CA--C 1.549 0.904 0 O-C-N 120.71 -1.244 . . . . 0.0 114.104 172.525 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.74 -43.74 13.11 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 120.597 -1.314 . . . . 0.0 109.038 163.078 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.12 -49.1 73.51 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.148 1.779 . . . . 0.0 111.21 -174.539 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.56 -7.27 46.34 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 123.866 0.746 . . . . 0.0 114.443 172.618 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.38 -45.22 9.63 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.158 1.383 . . . . 0.0 108.75 168.143 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.16 -42.35 76.03 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.187 1.795 . . . . 0.0 114.446 -176.867 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -39.54 94.49 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.147 0.979 . . . . 0.0 111.29 178.59 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -98.37 -2.99 37.97 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.929 1.291 . . . . 0.0 114.449 -173.415 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.435 ' CG ' ' HD2' ' B' ' 21' ' ' PRO . 0.3 OUTLIER -55.12 147.72 33.45 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 125.623 1.569 . . . . 0.0 112.525 177.882 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . 0.468 ' HG2' ' H ' ' B' ' 22' ' ' THR . 41.0 Cg_endo -37.66 -69.89 0.07 OUTLIER 'Trans proline' 0 C--N 1.354 0.824 1 C-N-CA 127.416 5.411 . . . . 0.0 113.407 -167.629 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.468 ' H ' ' HG2' ' B' ' 21' ' ' PRO . 2.2 p -90.65 -20.7 22.22 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 125.863 1.665 . . . . 0.0 112.95 179.731 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 9.3 mtm-85 -66.34 -42.85 87.56 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 121.493 1.951 . . . . 0.0 111.848 177.266 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 40.5 t -54.61 -49.67 69.91 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.36 0.982 . . . . 0.0 110.97 169.88 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -58.05 -54.23 49.34 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.157 0.983 . . . . 0.0 112.65 177.178 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 4.4 mm -45.76 -54.02 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 126.221 1.808 . . . . 0.0 111.175 169.87 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 42.5 mt -68.3 -37.44 80.61 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 117.806 -1.093 . . . . 0.0 113.434 -173.72 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.1 p -76.2 -27.4 17.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 CA-C-N 119.731 1.151 . . . . 0.0 111.434 176.961 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.97 -23.06 52.34 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.107 0.963 . . . . 0.0 112.858 173.075 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 5.5 tp -73.5 -33.51 64.83 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 119.807 1.185 . . . . 0.0 113.76 171.187 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -45.52 -54.51 7.4 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.03 2.132 . . . . 0.0 113.299 -168.781 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -97.2 -11.42 24.26 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.415 1.486 . . . . 0.0 112.138 169.507 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -97.61 2.51 60.61 Favored Glycine 0 C--N 1.342 0.889 0 CA-C-O 116.64 -2.2 . . . . 0.0 118.235 -167.907 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 29.7 m -38.49 40.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.059 1 C-N-CA 131.81 4.044 . . . . 0.0 119.014 167.537 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 51.2 m -83.78 -74.5 0.37 Allowed 'General case' 0 C--O 1.223 -0.318 0 O-C-N 119.713 -1.867 . . . . 0.0 111.309 179.173 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.51 163.39 50.21 Favored Pre-proline 0 CA--C 1.547 0.829 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -169.889 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -63.1 130.18 28.12 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.158 1.906 . . . . 0.0 110.104 178.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.35 5.62 67.59 Favored Glycine 0 CA--C 1.538 1.49 0 CA-C-O 118.133 -1.371 . . . . 0.0 115.708 -178.304 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -25.2 64.43 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 120.124 1.962 . . . . 0.0 113.24 -177.457 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.8 mt -52.96 -20.1 3.13 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 125.946 1.698 . . . . 0.0 112.01 176.712 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.36 -30.44 70.53 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.312 0.645 . . . . 0.0 112.532 177.738 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.99 -50.82 11.38 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.39 0.676 . . . . 0.0 110.791 169.43 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -55.37 -38.38 68.76 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 -177.798 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.2 mt -96.83 -19.65 18.73 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.707 1.603 . . . . 0.0 112.756 -177.125 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.07 11.66 67.32 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-N 119.205 0.911 . . . . 0.0 113.2 -168.997 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 97.0 mt -102.13 141.11 35.5 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.115 1.366 . . . . 0.0 110.973 -174.276 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.0 t -57.69 143.09 42.94 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.158 0.98 . . . . 0.0 112.186 -171.23 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.94 -19.13 39.96 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.755 1.222 . . . . 0.0 113.634 -179.463 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 7.5 p -72.29 -62.8 1.31 Allowed 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.656 1.116 . . . . 0.0 109.255 166.904 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -46.99 -46.84 21.95 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.433 1.493 . . . . 0.0 113.658 176.091 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.87 -40.52 89.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 O-C-N 120.474 -1.391 . . . . 0.0 112.661 175.507 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.0 m -66.74 -37.81 85.38 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 118.588 0.631 . . . . 0.0 111.645 176.156 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 9.5 m-20 -58.96 -45.03 91.51 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.0 1.72 . . . . 0.0 112.19 173.322 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -64.63 -40.93 96.33 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 120.403 -1.435 . . . . 0.0 112.967 172.129 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 49.6 mt -67.3 -31.32 71.53 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 179.291 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 37.6 m -61.22 -28.11 68.92 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -178.569 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 47.8 t -71.36 -51.31 24.89 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.075 0.95 . . . . 0.0 110.747 169.379 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 4.5 mp -63.43 -40.3 96.81 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.389 2.275 . . . . 0.0 112.746 -171.957 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 60.7 mtm-85 -75.06 -5.7 45.53 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.593 1.157 . . . . 0.0 112.965 174.321 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -104.53 -38.07 2.68 Favored Glycine 0 N--CA 1.472 1.07 0 C-N-CA 124.718 1.151 . . . . 0.0 112.146 171.809 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 7.3 m -61.51 -6.94 2.69 Favored 'General case' 0 CA--C 1.56 1.353 0 C-N-CA 128.349 2.66 . . . . 0.0 113.409 169.471 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.02 13.66 62.21 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 125.217 1.389 . . . . 0.0 113.716 -175.561 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 83.6 mt -70.94 -26.12 63.04 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.593 1.196 . . . . 0.0 112.632 178.003 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.6 m -141.41 142.8 28.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.353 1.461 . . . . 0.0 111.558 -174.595 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 68.9 t -122.83 140.19 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 127.433 2.293 . . . . 0.0 109.253 -174.335 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -92.97 146.5 23.57 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.343 1.057 . . . . 0.0 112.425 170.126 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 2.4 m -167.47 168.42 12.97 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.079 2.151 . . . . 0.0 107.534 -172.888 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -81.19 155.35 26.2 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 174.746 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.04 -26.58 14.19 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.629 0.772 . . . . 0.0 109.144 162.28 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 141.19 -31.74 2.14 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 127.575 2.512 . . . . 0.0 113.738 171.412 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.58 -18.9 11.82 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 129.518 3.127 . . . . 0.0 112.503 178.604 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -150.72 167.71 26.55 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 129.696 3.198 . . . . 0.0 109.026 -179.576 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 14.3 m -85.1 165.31 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 O-C-N 121.666 -0.646 . . . . 0.0 111.087 167.544 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 21.6 ptt85 -138.11 167.91 20.82 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 127.07 2.148 . . . . 0.0 109.872 -179.438 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -119.02 133.03 56.07 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.738 1.215 . . . . 0.0 108.326 168.167 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -136.25 151.25 49.47 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.479 1.112 . . . . 0.0 109.82 179.097 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 13.0 mt -55.5 149.0 14.32 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 168.735 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.43 -36.59 82.89 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -169.903 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -162.34 163.37 27.95 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.624 1.57 . . . . 0.0 112.23 178.366 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 95.6 p -44.22 -32.47 1.27 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.109 2.564 . . . . 0.0 113.546 167.643 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -52.89 -49.71 65.34 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 125.245 1.418 . . . . 0.0 112.507 170.512 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 21.4 mt -72.47 -46.94 52.48 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.964 0.802 . . . . 0.0 109.636 179.11 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.17 -40.2 64.18 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 117.776 -1.107 . . . . 0.0 113.738 -177.041 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -69.48 -47.35 64.18 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 120.408 1.458 . . . . 0.0 113.385 178.248 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.1 -43.26 95.89 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 118.928 0.785 . . . . 0.0 111.192 -179.267 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.54 -52.3 64.18 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.776 1.63 . . . . 0.0 110.374 170.919 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.94 -14.03 58.1 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.812 1.196 . . . . 0.0 114.567 -176.048 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . 0.257 20.7 pt-20 -114.91 18.48 16.42 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 169.876 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 21.4 tp 63.66 2.12 1.2 Allowed 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 128.522 2.729 . . . . 0.0 115.361 167.269 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 1.7 t 74.31 33.47 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 126.586 1.954 . . . . 0.0 110.37 -171.511 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.419 ' C ' ' H ' ' B' ' 93' ' ' VAL . 0.8 OUTLIER 81.68 -14.07 0.83 Allowed 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 115.241 1.571 . . . . 0.0 115.241 118.417 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 13.1 p -67.46 39.09 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 129.558 3.143 . . . . 0.0 113.415 174.103 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . 0.419 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.2 OUTLIER 72.44 26.67 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 128.063 2.545 . . . . 0.0 113.182 177.001 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 84.36 90.15 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.77 2.028 . . . . 0.0 109.368 -177.724 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.613 0 CA-C-N 114.521 -1.218 . . . . 0.0 113.421 178.517 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.684 0 CA-C-O 120.376 0.131 . . . . 0.0 111.317 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.79 -18.22 60.5 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.281 1.832 . . . . 0.0 113.946 179.504 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.31 -57.23 3.46 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.464 1.105 . . . . 0.0 109.195 167.402 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -55.25 -63.53 1.13 Allowed 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 126.645 1.978 . . . . 0.0 110.331 -174.225 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -60.81 -36.21 91.5 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.641 -0.583 . . . . 0.0 111.641 -172.281 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 16.3 ttt85 -67.33 -50.97 57.88 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.839 0.856 . . . . 0.0 111.226 179.761 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.85 -27.02 67.79 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 176.641 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.4 mp -90.98 -12.47 35.81 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.447 1.099 . . . . 0.0 113.567 174.282 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.56 -20.15 40.52 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.7 1.2 . . . . 0.0 114.058 169.888 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -72.63 140.41 81.57 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 126.835 2.054 . . . . 0.0 109.424 174.261 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.4 ' HG2' ' H ' ' A' ' 22' ' ' THR . 71.7 Cg_endo -53.03 -84.89 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.647 1 C-N-CA 126.696 4.931 . . . . 0.0 113.738 -166.621 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.4 ' H ' ' HG2' ' A' ' 21' ' ' PRO . 52.1 m -70.3 -15.43 62.89 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 124.551 1.141 . . . . 0.0 111.134 -179.701 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -68.63 -40.2 80.42 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 120.378 -1.452 . . . . 0.0 113.312 -177.854 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 13.2 t -59.28 -40.21 85.38 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 121.806 0.812 . . . . 0.0 110.806 169.432 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.4 mmp_? -66.64 -41.27 88.54 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 172.879 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 5.1 mm -50.63 -44.38 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 120.077 -1.639 . . . . 0.0 111.412 171.328 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.26 -24.95 67.46 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 175.28 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -78.66 -29.51 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 124.77 1.228 . . . . 0.0 112.729 171.25 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.89 -32.46 63.6 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.494 0.717 . . . . 0.0 112.717 178.855 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -85.92 -10.42 55.26 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 173.226 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.07 -23.52 63.83 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-O 119.505 -0.283 . . . . 0.0 111.401 165.622 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -124.19 -59.52 1.48 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 127.768 2.427 . . . . 0.0 114.564 -171.92 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.05 -74.77 0.63 Allowed Glycine 0 N--CA 1.468 0.818 0 C-N-CA 125.354 1.455 . . . . 0.0 113.226 -165.86 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.9 m 45.88 33.66 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 C-N-CA 125.851 1.66 . . . . 0.0 113.815 -179.001 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.2 m -82.61 -51.63 7.57 Favored 'General case' 0 C--O 1.226 -0.157 0 O-C-N 120.932 -1.105 . . . . 0.0 112.046 -175.56 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 50.3 p90 -165.69 157.2 12.42 Favored Pre-proline 0 N--CA 1.477 0.894 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -169.78 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -61.73 104.43 0.32 Allowed 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 123.868 3.045 . . . . 0.0 110.128 173.937 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 113.86 -11.5 22.87 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-O 118.021 -1.433 . . . . 0.0 114.651 -175.01 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.72 -34.08 69.11 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.651 2.226 . . . . 0.0 111.349 175.079 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.579 HD13 ' H ' ' A' ' 40' ' ' LEU . 0.5 OUTLIER -62.8 -21.06 65.61 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 126.22 1.808 . . . . 0.0 111.985 -178.317 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.19 -30.02 69.02 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.431 0.692 . . . . 0.0 111.786 -179.581 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.37 -44.85 61.97 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.527 0.331 . . . . 0.0 110.344 169.87 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -62.59 -35.53 79.82 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -179.174 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.0 mt -103.27 -16.38 15.69 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -174.363 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.56 -2.08 54.99 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-O 118.072 -1.404 . . . . 0.0 114.341 -175.409 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 mp -105.6 148.43 27.32 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.561 1.68 . . . . 0.0 110.947 177.23 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.458 HG22 ' H ' ' A' ' 50' ' ' ASN . 13.5 t -54.83 151.24 8.77 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.356 1.063 . . . . 0.0 113.005 -173.252 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -50.13 -23.25 2.04 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.054 1.741 . . . . 0.0 113.839 169.498 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 14.7 m -69.22 -56.99 5.96 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.461 1.028 . . . . 0.0 111.85 170.395 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.458 ' H ' HG22 ' A' ' 47' ' ' THR . 16.0 t-20 -61.9 -42.85 99.56 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.461 1.028 . . . . 0.0 112.074 176.113 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.5 t -53.26 -48.16 55.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 123.834 0.854 . . . . 0.0 111.166 172.01 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 51.1 m -66.26 -35.96 81.75 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 177.559 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -60.4 -52.46 65.13 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.006 0.922 . . . . 0.0 110.097 176.579 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -68.36 -27.38 66.2 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 120.332 -1.48 . . . . 0.0 113.777 176.648 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 36.4 mt -70.42 -20.86 62.89 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 120.378 1.444 . . . . 0.0 113.311 167.862 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.2 t -63.19 -51.81 64.86 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 120.189 1.359 . . . . 0.0 112.973 -169.175 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 42.0 t -54.74 -51.25 66.25 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 123.956 1.836 . . . . 0.0 110.018 174.822 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -48.36 -41.48 28.8 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 130.797 3.639 . . . . 0.0 113.628 -177.081 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 80.1 mtm-85 -78.86 -24.14 44.52 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 179.423 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.12 -54.69 2.1 Favored Glycine 0 N--CA 1.471 0.974 0 CA-C-N 119.181 0.9 . . . . 0.0 111.271 177.78 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 73.0 m -67.29 -3.69 8.69 Favored 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 127.119 2.168 . . . . 0.0 112.135 -178.853 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 86.01 10.57 74.99 Favored Glycine 0 C--N 1.34 0.792 0 C-N-CA 127.293 2.378 . . . . 0.0 116.304 164.791 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.8 mt -70.56 -22.75 62.56 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 119.6 1.7 . . . . 0.0 113.127 178.024 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.8 m -133.53 156.13 41.2 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 126.952 2.101 . . . . 0.0 113.088 171.454 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.3 t -133.47 153.44 37.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 127.744 2.418 . . . . 0.0 109.748 -179.57 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.52 145.65 26.02 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.822 1.649 . . . . 0.0 112.512 175.224 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.413 ' HB ' ' HG2' ' A' ' 74' ' ' ARG . 9.6 m -140.86 144.66 35.43 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.677 1.191 . . . . 0.0 109.285 -177.836 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -80.75 115.86 20.46 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.985 0.421 . . . . 0.0 110.803 167.89 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -88.54 166.08 14.41 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.25 1.42 . . . . 0.0 110.531 168.854 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -66.69 15.28 0.32 Allowed Glycine 0 N--CA 1.481 1.677 0 N-CA-C 117.035 1.574 . . . . 0.0 117.035 -169.59 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.61 -1.13 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.831 2.053 . . . . 0.0 114.185 178.229 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -168.55 164.8 12.49 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 126.172 1.789 . . . . 0.0 108.783 -168.959 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 34.5 m -94.68 156.42 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 CA-C-N 119.856 1.207 . . . . 0.0 110.626 168.834 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.413 ' HG2' ' HB ' ' A' ' 67' ' ' THR . 9.8 ptt180 -127.26 178.34 6.11 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.379 1.071 . . . . 0.0 112.65 -179.424 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -124.7 128.82 49.4 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.367 1.467 . . . . 0.0 108.384 165.236 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.02 157.43 41.73 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.291 1.037 . . . . 0.0 109.946 173.83 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.61 153.6 42.65 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.339 0.518 . . . . 0.0 109.813 170.968 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.02 -36.18 79.52 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -168.584 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -158.71 158.81 34.42 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 123.378 1.561 . . . . 0.0 113.244 176.641 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -35.21 -39.23 0.11 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 130.25 3.42 . . . . 0.0 112.701 165.724 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -44.29 -66.12 0.43 Allowed 'General case' 0 C--N 1.342 0.275 0 C-N-CA 127.862 2.465 . . . . 0.0 112.647 169.519 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.2 pp -79.39 -25.39 42.15 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 118.576 -0.726 . . . . 0.0 112.626 -172.502 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.48 -45.77 89.23 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 122.71 0.404 . . . . 0.0 110.428 167.855 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 24.7 ttp85 -62.87 -54.0 45.54 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.618 1.167 . . . . 0.0 111.968 178.063 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.48 -35.97 79.14 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -175.707 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.25 -42.02 66.12 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.567 -0.708 . . . . 0.0 111.009 172.894 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.05 -43.88 98.16 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.824 1.678 . . . . 0.0 114.585 -178.409 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -76.06 -2.02 28.75 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.556 1.142 . . . . 0.0 113.482 174.263 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.422 ' C ' ' H ' ' A' ' 91' ' ' GLN . 34.2 tp 76.08 124.8 0.04 OUTLIER 'General case' 0 C--N 1.345 0.378 0 C-N-CA 130.136 3.374 . . . . 0.0 110.914 168.473 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 46.4 t -75.62 21.69 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 CA-C-O 123.465 1.602 . . . . 0.0 112.233 -169.521 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.422 ' H ' ' C ' ' A' ' 89' ' ' LEU . 1.2 tp-100 84.99 -12.63 0.71 Allowed 'General case' 0 C--O 1.219 -0.534 0 O-C-N 120.038 -1.664 . . . . 0.0 111.467 130.662 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 12.7 p -68.35 46.81 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 C-N-CA 129.75 3.22 . . . . 0.0 111.14 164.672 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 69.71 -42.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 C-N-CA 130.486 3.514 . . . . 0.0 112.806 -169.893 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.1 tt 168.14 104.69 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 130.674 3.59 . . . . 0.0 106.03 -169.486 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.98 82.57 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.122 0 O-C-N 121.285 -0.885 . . . . 0.0 112.147 169.163 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 18.0 m -45.21 163.41 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 130.302 3.441 . . . . 0.0 116.788 -178.482 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -90.62 73.12 6.79 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.311 1.444 . . . . 0.0 109.263 166.444 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . 0.261 0.3 OUTLIER 172.8 138.83 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 128.477 2.711 . . . . 0.0 112.836 168.454 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -88.34 26.56 1.4 Allowed 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 130.526 3.53 . . . . 0.0 113.34 -171.244 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -33.43 134.82 0.32 Allowed Pre-proline 0 N--CA 1.483 1.176 0 C-N-CA 126.529 1.932 . . . . 0.0 112.821 -174.801 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -60.24 149.14 87.08 Favored 'Trans proline' 0 C--N 1.355 0.9 1 C-N-CA 126.12 4.546 . . . . 0.0 118.997 -164.94 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.809 0 C-N-CA 125.286 1.434 . . . . 0.0 109.551 170.135 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 pt? . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.26 -17.06 63.1 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.451 1.501 . . . . 0.0 112.967 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.43 -55.33 4.21 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.928 0.891 . . . . 0.0 110.216 167.439 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -54.93 -61.72 2.13 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.47 1.508 . . . . 0.0 110.716 -176.136 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.61 -38.63 95.93 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 111.781 -0.528 . . . . 0.0 111.781 -170.68 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 14.2 ttm105 -60.49 -48.51 81.46 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.704 1.602 . . . . 0.0 111.108 176.547 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.16 -29.94 69.78 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 177.51 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.0 mp -88.84 -8.0 55.11 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 113.858 1.058 . . . . 0.0 113.858 175.614 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -88.22 -15.64 35.39 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.637 1.575 . . . . 0.0 114.362 172.803 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -78.0 146.0 70.81 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 126.301 1.84 . . . . 0.0 110.825 174.33 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -59.13 -82.03 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.67 1 C-N-CA 126.474 4.783 . . . . 0.0 112.55 -168.974 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 5.7 m -59.42 -29.58 67.86 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.155 0.982 . . . . 0.0 111.114 176.48 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 11.0 ttm180 -66.74 -41.03 88.5 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -171.444 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 5.3 t -57.78 -47.24 83.12 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-O 122.238 1.018 . . . . 0.0 110.152 169.565 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 11.2 mmp_? -63.05 -36.43 83.55 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.561 1.689 . . . . 0.0 115.561 175.911 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 4.8 mm -49.64 -41.4 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 120.319 -1.488 . . . . 0.0 111.91 173.283 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 83.0 mt -72.67 -29.62 63.57 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 112.808 0.669 . . . . 0.0 112.808 176.434 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -78.19 -25.59 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 O-C-N 120.585 -1.322 . . . . 0.0 112.096 176.46 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.77 -57.61 4.9 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.495 1.518 . . . . 0.0 108.822 168.337 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 10.4 mt -61.24 -23.38 65.6 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 117.163 2.282 . . . . 0.0 117.163 -176.126 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -42.5 -32.74 0.58 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 125.951 1.701 . . . . 0.0 112.109 168.427 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -120.05 -30.24 4.73 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 128.278 2.631 . . . . 0.0 112.324 168.563 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.8 21.55 1.58 Allowed Glycine 0 N--CA 1.465 0.633 0 C-N-CA 128.819 3.104 . . . . 0.0 115.39 -164.66 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 13.3 m -64.87 29.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 C-N-CA 127.371 2.268 . . . . 0.0 114.613 173.818 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -85.17 -64.16 1.2 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.382 1.073 . . . . 0.0 111.457 -176.753 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 55.4 p90 -165.84 154.71 10.47 Favored Pre-proline 0 CA--C 1.545 0.751 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 -170.007 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -58.45 118.74 5.68 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 123.207 2.605 . . . . 0.0 109.894 175.971 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 94.22 -8.94 72.55 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-O 117.619 -1.656 . . . . 0.0 114.899 -174.64 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . 0.407 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -56.67 -36.73 69.92 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 120.918 2.359 . . . . 0.0 110.545 172.855 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.577 HD13 ' H ' ' B' ' 40' ' ' LEU . 0.4 OUTLIER -61.6 -19.09 61.84 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 126.14 1.776 . . . . 0.0 112.361 -175.688 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.87 -31.27 71.76 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.145 0.578 . . . . 0.0 111.826 176.447 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.37 -43.81 59.9 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.661 0.384 . . . . 0.0 110.824 170.585 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . 0.407 ' CD2' HE22 ' B' ' 39' ' ' GLN . 2.7 m-70 -63.44 -33.41 75.51 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 179.909 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 36.1 mt -104.35 -18.37 14.46 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.558 1.143 . . . . 0.0 113.725 -174.761 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.94 -0.72 61.48 Favored Glycine 0 CA--C 1.526 0.747 0 CA-C-O 118.156 -1.358 . . . . 0.0 113.756 -174.216 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 8.3 mp -107.2 143.32 35.59 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.031 1.415 . . . . 0.0 110.834 177.213 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 47' ' ' THR . . . . . 0.468 HG22 ' H ' ' B' ' 50' ' ' ASN . 9.8 t -51.35 149.97 3.78 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 126.189 1.796 . . . . 0.0 113.461 -173.295 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -49.12 -22.33 0.93 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.397 1.879 . . . . 0.0 113.458 169.372 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.4 m -67.22 -63.64 1.02 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.59 1.156 . . . . 0.0 112.374 169.516 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . 0.468 ' H ' HG22 ' B' ' 47' ' ' THR . 28.4 t-20 -65.04 -36.65 85.03 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.75 -1.219 . . . . 0.0 112.404 178.211 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.3 t -54.58 -48.79 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 122.963 0.505 . . . . 0.0 110.422 168.71 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.9 m -66.61 -38.81 87.76 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 117.809 -1.091 . . . . 0.0 113.926 177.508 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -54.36 -54.52 39.37 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.107 0.867 . . . . 0.0 109.692 174.57 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -70.9 -25.18 62.66 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.792 -1.193 . . . . 0.0 113.439 -178.872 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 32.0 mt -68.61 -25.52 64.89 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.436 1.471 . . . . 0.0 112.954 167.424 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.0 t -58.99 -55.79 30.65 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 119.983 1.265 . . . . 0.0 112.976 -169.44 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 40.5 t -53.46 -52.64 58.84 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 122.387 1.089 . . . . 0.0 109.476 172.655 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.4 tp -47.63 -38.16 14.14 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 128.293 2.637 . . . . 0.0 113.886 -174.291 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 25.2 mtm-85 -83.99 -32.62 24.88 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 119.684 1.129 . . . . 0.0 113.73 -179.211 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -83.3 -45.88 6.37 Favored Glycine 0 N--CA 1.467 0.755 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 -179.82 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 80.3 m -74.5 5.91 4.26 Favored 'General case' 0 CA--C 1.563 1.46 0 C-N-CA 127.484 2.313 . . . . 0.0 111.628 177.746 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.56 -6.46 83.38 Favored Glycine 0 C--N 1.344 1.01 0 C-N-CA 128.301 2.858 . . . . 0.0 119.078 165.594 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 59.9 mt -66.99 -26.93 67.05 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 119.366 1.583 . . . . 0.0 113.785 -172.713 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 11.1 m -132.01 161.09 41.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 126.767 2.027 . . . . 0.0 113.238 177.26 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 76.4 t -139.93 146.73 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 128.232 2.613 . . . . 0.0 109.877 -169.202 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -96.37 138.08 34.49 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.994 1.318 . . . . 0.0 111.605 170.493 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 9.5 m -146.88 147.19 30.56 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.097 1.359 . . . . 0.0 108.522 -174.465 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -77.11 138.03 39.28 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 175.778 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -112.17 164.71 12.88 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.385 1.874 . . . . 0.0 111.436 169.181 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.9 14.16 0.3 Allowed Glycine 0 N--CA 1.48 1.627 0 N-CA-C 117.271 1.669 . . . . 0.0 117.271 -168.952 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.92 -0.77 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.95 2.1 . . . . 0.0 113.849 178.907 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -168.79 167.08 11.3 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 126.561 1.945 . . . . 0.0 108.949 -168.225 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 35.2 m -93.74 159.34 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 119.818 1.19 . . . . 0.0 110.605 168.246 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 5.2 ptt180 -121.9 171.4 8.95 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 122.363 1.078 . . . . 0.0 112.508 178.154 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -119.94 112.62 19.41 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.469 -2.049 . . . . 0.0 105.469 165.227 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -110.14 167.58 10.07 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.599 1.16 . . . . 0.0 110.147 174.458 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -85.82 150.9 24.23 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 169.678 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.21 -50.47 69.31 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -168.411 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -153.34 160.35 42.66 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 123.275 1.512 . . . . 0.0 112.921 -178.822 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -35.34 -40.5 0.15 Allowed 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 129.657 3.183 . . . . 0.0 111.671 165.521 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -42.75 -68.22 0.21 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.469 2.308 . . . . 0.0 112.397 169.184 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 2.3 pp -79.04 -22.98 44.61 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -172.418 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.22 -44.51 91.69 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 122.892 0.477 . . . . 0.0 110.606 166.937 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 28.6 ttp85 -64.44 -51.61 62.23 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.132 1.773 . . . . 0.0 112.6 178.835 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.31 -41.61 80.23 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.983 0.81 . . . . 0.0 112.691 -179.857 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.6 -41.53 72.17 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 118.79 -0.624 . . . . 0.0 111.038 176.263 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.87 -44.65 95.8 Favored Glycine 0 CA--C 1.533 1.189 0 C-N-CA 125.42 1.486 . . . . 0.0 114.389 179.571 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -76.93 -2.3 33.0 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.82 1.248 . . . . 0.0 113.129 172.982 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . 0.472 ' C ' ' H ' ' B' ' 91' ' ' GLN . 44.7 tp 70.65 112.09 0.05 Allowed 'General case' 0 C--N 1.341 0.224 0 C-N-CA 129.679 3.192 . . . . 0.0 111.992 168.409 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.4 t -69.97 26.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 C-N-CA 127.198 2.199 . . . . 0.0 113.232 -176.167 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.472 ' H ' ' C ' ' B' ' 89' ' ' LEU . 1.8 tp-100 89.02 -14.24 0.35 Allowed 'General case' 0 N--CA 1.468 0.47 0 O-C-N 119.623 -1.923 . . . . 0.0 113.226 119.046 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 11.5 p -63.95 39.69 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 130.306 3.443 . . . . 0.0 113.633 169.321 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 63.41 24.53 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 127.244 2.218 . . . . 0.0 112.823 -175.742 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 98.49 112.48 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 129.928 3.291 . . . . 0.0 107.947 -173.443 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.08 0 C-N-CA 123.866 0.866 . . . . 0.0 111.057 168.139 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 pp . . . . . 0 N--CA 1.473 0.707 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.84 -58.14 6.98 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 118.755 0.707 . . . . 0.0 111.724 175.639 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -62.28 -30.37 71.09 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 121.415 -0.803 . . . . 0.0 111.993 179.222 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -61.71 -43.41 98.91 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.798 1.639 . . . . 0.0 111.381 170.019 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -59.75 -29.25 66.93 Favored Glycine 0 N--CA 1.474 1.21 0 CA-C-N 119.548 1.067 . . . . 0.0 113.184 175.264 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.19 -27.37 64.45 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.085 0.954 . . . . 0.0 112.116 173.333 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.01 -26.13 62.1 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 120.104 1.32 . . . . 0.0 111.643 172.753 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.4 mp -83.21 -28.61 29.14 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.005 0.522 . . . . 0.0 111.389 172.71 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.7 -10.61 57.34 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 117.021 2.23 . . . . 0.0 117.021 -179.278 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.67 156.83 21.76 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 128.048 2.539 . . . . 0.0 114.098 -173.602 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.526 ' HG2' ' H ' ' A' ' 22' ' ' THR . 58.3 Cg_endo -53.65 -76.65 0.02 OUTLIER 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 124.532 3.488 . . . . 0.0 111.345 169.554 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.526 ' H ' ' HG2' ' A' ' 21' ' ' PRO . 57.9 m -87.37 -28.01 22.45 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 116.145 -1.883 . . . . 0.0 112.36 -172.528 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.432 ' HG3' ' HD1' ' A' ' 54' ' ' HIS . 44.3 mtt85 -64.15 -39.55 94.25 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 122.666 2.484 . . . . 0.0 111.589 172.668 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 15.2 t -57.66 -40.57 79.63 Favored 'General case' 0 CA--C 1.552 1.019 0 CA-C-N 121.466 1.939 . . . . 0.0 111.944 170.618 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -60.91 -55.82 28.49 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 121.129 -0.982 . . . . 0.0 112.081 173.688 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.4 mm -52.84 -42.82 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.96 1.704 . . . . 0.0 110.767 176.265 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 49.5 mt -68.21 -43.15 78.65 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.822 0.849 . . . . 0.0 112.869 178.714 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.2 p -68.37 -26.43 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 119.977 1.262 . . . . 0.0 111.806 177.471 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.66 1.67 9.73 Favored 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 127.242 2.217 . . . . 0.0 115.023 170.444 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.2 mt -99.23 -25.36 14.53 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.413 -1.429 . . . . 0.0 114.768 173.439 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.4 mt -59.4 -24.02 63.09 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.629 -1.169 . . . . 0.0 111.873 171.638 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 45.7 p-10 -132.25 -28.16 1.73 Allowed 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 116.036 1.865 . . . . 0.0 116.036 -175.179 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.86 -69.35 1.41 Allowed Glycine 0 C--N 1.343 0.945 0 CA-C-N 119.436 1.017 . . . . 0.0 113.221 -168.874 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 33.4 m 33.42 23.57 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 129.746 3.218 . . . . 0.0 119.14 174.88 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 69.2 m -86.08 -76.47 0.34 Allowed 'General case' 0 C--N 1.331 -0.204 0 O-C-N 121.01 -1.056 . . . . 0.0 109.764 177.608 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -137.04 157.1 75.24 Favored Pre-proline 0 N--CA 1.479 0.977 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -168.606 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -56.47 127.29 25.33 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.17 2.58 . . . . 0.0 110.535 173.327 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.05 -2.74 59.86 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-O 118.218 -1.324 . . . . 0.0 115.443 -178.292 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.79 -25.76 68.39 Favored 'General case' 0 N--CA 1.484 1.225 0 CA-C-N 120.46 2.13 . . . . 0.0 112.689 178.325 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.1 -12.27 3.31 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.507 1.123 . . . . 0.0 111.519 178.117 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.36 -38.56 91.62 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.988 1.315 . . . . 0.0 113.381 173.335 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.79 -37.98 70.33 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.586 0.63 . . . . 0.0 111.091 173.391 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -67.86 -47.73 68.09 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.209 1.004 . . . . 0.0 113.213 -178.987 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.2 mt -86.09 -11.92 51.46 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.539 1.136 . . . . 0.0 113.102 -178.659 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.31 -2.62 13.9 Favored Glycine 0 CA--C 1.537 1.444 0 C-N-CA 124.129 0.871 . . . . 0.0 113.728 -169.58 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.0 mt -81.9 153.52 26.29 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.618 1.167 . . . . 0.0 110.942 -176.712 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.3 t -61.23 142.38 56.84 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.362 -0.836 . . . . 0.0 110.62 171.499 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.9 ptp180 -56.78 -23.79 45.82 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 118.685 -0.674 . . . . 0.0 112.667 178.366 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.0 m -66.04 -48.03 72.41 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.27 1.028 . . . . 0.0 113.258 170.862 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -65.71 -41.21 92.58 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.041 1.336 . . . . 0.0 110.672 176.868 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 19.4 t -55.28 -49.9 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 123.654 0.781 . . . . 0.0 111.025 168.977 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 27.2 p -66.43 -36.15 82.1 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 120.31 1.414 . . . . 0.0 114.51 175.496 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -64.4 -45.28 88.3 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.31 1.444 . . . . 0.0 110.643 179.227 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . 0.432 ' HD1' ' HG3' ' A' ' 23' ' ' ARG . 26.2 m-70 -72.72 -35.35 67.55 Favored 'General case' 0 CA--C 1.558 1.281 0 CA-C-O 117.264 -1.35 . . . . 0.0 113.111 171.282 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.3 mt -63.11 -33.0 74.51 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 121.777 2.08 . . . . 0.0 113.719 173.259 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.3 m -55.42 -52.28 64.11 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.194 0.906 . . . . 0.0 113.405 -169.838 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 50.9 t -63.38 -40.29 96.86 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 122.933 0.493 . . . . 0.0 111.201 172.545 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.8 tp -58.86 -28.26 65.93 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.765 2.026 . . . . 0.0 112.908 -172.348 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 26.9 mtm180 -71.48 -38.9 71.18 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.9 0.88 . . . . 0.0 112.359 171.29 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -78.74 -36.12 29.98 Favored Glycine 0 N--CA 1.468 0.781 0 C-N-CA 125.883 1.706 . . . . 0.0 111.635 -176.721 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 36.3 m -61.86 -12.79 19.37 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 128.149 2.58 . . . . 0.0 112.865 167.28 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 81.87 -10.02 53.97 Favored Glycine 0 C--N 1.342 0.904 0 C-N-CA 126.957 2.218 . . . . 0.0 113.404 -179.033 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.0 mt -63.73 -33.03 74.73 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 127.496 2.318 . . . . 0.0 113.936 -169.902 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.22 133.3 59.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.599 1.56 . . . . 0.0 109.101 166.833 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.8 t -121.79 133.06 69.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 124.971 1.308 . . . . 0.0 109.574 172.324 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.03 142.56 50.91 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 114.746 -1.115 . . . . 0.0 111.979 170.121 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.1 m -162.92 158.96 23.09 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.098 1.759 . . . . 0.0 106.944 -174.303 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -91.46 145.61 24.48 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.73 1.15 . . . . 0.0 113.206 178.302 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -111.39 -166.79 1.11 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.284 1.834 . . . . 0.0 109.85 168.79 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -72.02 -8.1 68.32 Favored Glycine 0 CA--C 1.537 1.417 0 O-C-N 120.498 -1.376 . . . . 0.0 116.457 -169.39 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.03 -31.28 0.77 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.326 1.85 . . . . 0.0 113.091 177.667 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.25 -175.79 4.97 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.942 1.246 . . . . 0.0 112.929 -172.642 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 8.1 p -79.81 146.96 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 123.842 0.857 . . . . 0.0 110.792 168.858 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -128.79 162.7 26.83 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 127.657 2.383 . . . . 0.0 111.091 -179.202 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -110.59 120.42 42.35 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.409 1.084 . . . . 0.0 108.919 168.262 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -121.46 168.62 11.49 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.881 1.272 . . . . 0.0 110.461 174.985 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 17.6 mt -58.64 155.44 12.54 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 172.642 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -48.04 -40.7 23.69 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.155 1.782 . . . . 0.0 114.342 -178.457 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -174.52 169.42 3.69 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.578 1.951 . . . . 0.0 110.982 -174.387 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 88.0 p -46.57 -34.75 5.18 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 127.372 2.269 . . . . 0.0 113.605 169.271 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 62.1 m-70 -54.23 -53.47 53.16 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 125.525 1.53 . . . . 0.0 112.221 176.203 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 28.2 mt -73.15 -37.1 66.73 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 118.219 -0.895 . . . . 0.0 110.61 -179.968 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.2 -50.76 64.03 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 118.913 0.779 . . . . 0.0 111.495 179.089 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -75.64 -32.23 60.15 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.49 1.041 . . . . 0.0 113.611 -179.274 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.18 -44.72 83.2 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.764 1.166 . . . . 0.0 112.576 176.298 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.01 -38.43 75.93 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.931 0.892 . . . . 0.0 110.694 174.63 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.16 -35.43 91.96 Favored Glycine 0 CA--C 1.529 0.907 0 O-C-N 121.418 -0.801 . . . . 0.0 112.225 176.884 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -83.15 9.57 10.21 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.865 1.266 . . . . 0.0 114.093 170.148 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.7 tp 66.52 -18.48 0.11 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 130.785 3.634 . . . . 0.0 117.525 164.041 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.27 34.3 m 118.71 20.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.138 1 C-N-CA 134.938 5.295 . . . . 0.0 112.152 178.219 . . . . . . . . 3 2 . 1 . 026 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.4 ' HB3' ' CG ' ' B' ' 81' ' ' HIS . 25.4 mm-40 79.63 -33.43 0.14 Allowed 'General case' 0 CA--C 1.539 0.524 0 O-C-N 120.176 -1.578 . . . . 0.0 114.127 162.945 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.8 p -57.34 16.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 C-N-CA 129.835 3.254 . . . . 0.0 117.572 -175.206 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.4 t 69.54 27.37 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 C-N-CA 125.218 1.407 . . . . 0.0 111.446 169.036 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.6 tp 80.13 96.94 0.06 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 129.53 3.132 . . . . 0.0 111.855 -173.805 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -87.69 114.76 24.61 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 120.887 -1.133 . . . . 0.0 109.045 170.021 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.3 m -141.82 142.99 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 127.528 2.331 . . . . 0.0 108.891 170.397 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.79 127.45 32.27 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.729 1.612 . . . . 0.0 109.688 170.818 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 2.7 m -179.88 -57.96 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 126.867 2.067 . . . . 0.0 109.138 -168.824 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.1 t0 176.19 56.44 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 131.235 3.814 . . . . 0.0 108.065 175.322 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -111.12 -163.2 0.05 OUTLIER Pre-proline 0 CA--C 1.555 1.139 0 C-N-CA 127.912 2.485 . . . . 0.0 110.543 -168.282 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -73.56 -159.57 0.08 OUTLIER 'Trans proline' 0 CA--C 1.55 1.282 0 CA-C-N 122.664 1.987 . . . . 0.0 112.928 177.021 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . 0.449 0.5 OUTLIER . . . . . 0 CA--C 1.55 0.959 0 C-N-CA 130.84 3.656 . . . . 0.0 117.402 -169.451 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 pp . . . . . 0 N--CA 1.472 0.659 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.23 -43.27 95.47 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.61 0.641 . . . . 0.0 111.506 177.299 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 25.6 ttp85 -64.95 -20.26 66.38 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.471 -1.393 . . . . 0.0 112.532 174.885 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.2 -38.22 85.79 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.802 1.637 . . . . 0.0 111.078 169.016 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -60.82 -25.52 63.92 Favored Glycine 0 CA--C 1.533 1.178 0 O-C-N 121.005 -1.059 . . . . 0.0 112.989 174.534 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 29.0 ttt-85 -69.35 -44.66 71.14 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 118.871 1.336 . . . . 0.0 110.364 170.817 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.54 -22.05 66.16 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 118.268 -0.873 . . . . 0.0 112.549 -177.014 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mp -91.34 -19.46 22.91 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.231 0.923 . . . . 0.0 113.308 168.384 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.0 -24.29 38.07 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 174.274 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -55.53 136.63 70.35 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 125.686 1.594 . . . . 0.0 109.597 178.849 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -49.26 -81.34 0.02 OUTLIER 'Trans proline' 0 CA--C 1.535 0.532 1 C-N-CA 126.611 4.874 . . . . 0.0 112.712 -167.695 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 13.4 m -62.86 -27.75 69.55 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 125.226 1.41 . . . . 0.0 111.415 -179.855 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -67.84 -43.5 79.38 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 120.495 1.498 . . . . 0.0 111.244 178.903 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 2.7 t -58.6 -14.1 7.38 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.51 1.05 . . . . 0.0 113.069 168.531 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -93.28 -55.33 3.35 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 120.265 -1.522 . . . . 0.0 112.053 171.641 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mt -38.87 -56.56 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 125.223 1.409 . . . . 0.0 110.464 170.899 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 96.9 mt -62.92 -30.56 71.65 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -170.545 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.6 p -88.12 -10.71 10.77 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 124.546 1.139 . . . . 0.0 112.337 178.012 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.71 -6.42 25.07 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 128.28 2.632 . . . . 0.0 112.907 176.503 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 52.7 mt -77.72 -54.27 6.56 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 119.639 -1.913 . . . . 0.0 110.177 168.84 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -35.31 -48.32 0.46 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 131.614 3.966 . . . . 0.0 114.303 179.551 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -102.8 -21.5 14.03 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.959 2.104 . . . . 0.0 113.224 -179.317 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -83.99 -70.1 1.36 Allowed Glycine 0 C--N 1.336 0.542 0 C-N-CA 125.826 1.679 . . . . 0.0 110.562 -170.726 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 11.0 m 32.46 26.81 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 N-CA-C 117.551 2.426 . . . . 0.0 117.551 -170.9 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 54.1 m -81.36 -89.56 0.07 Allowed 'General case' 0 C--O 1.221 -0.427 0 O-C-N 120.846 -1.159 . . . . 0.0 111.634 -178.661 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -135.16 156.52 78.12 Favored Pre-proline 0 N--CA 1.472 0.653 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -169.166 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -57.24 125.4 18.76 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.266 1.978 . . . . 0.0 109.359 171.554 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.14 -6.83 80.45 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 117.313 -1.826 . . . . 0.0 114.935 -174.091 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -59.36 -38.16 79.73 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 120.764 2.282 . . . . 0.0 111.235 172.273 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 15.0 mt -53.71 -23.05 10.42 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.224 1.41 . . . . 0.0 112.454 179.384 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.88 -28.15 69.3 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 176.966 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.03 -55.26 5.77 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.774 0.83 . . . . 0.0 110.6 171.312 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -49.67 -40.42 39.82 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 177.426 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.4 mt -95.6 -15.3 22.87 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.03 0.932 . . . . 0.0 113.245 -175.999 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.95 -5.13 4.93 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 124.542 1.068 . . . . 0.0 114.188 -170.123 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 87.8 mt -89.58 136.08 33.24 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 125.279 1.431 . . . . 0.0 109.678 -177.903 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.0 t -61.23 150.54 34.28 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.294 -0.879 . . . . 0.0 112.316 -173.631 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -57.5 -32.01 66.59 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -169.863 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.7 m -64.29 -52.34 59.02 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.017 0.927 . . . . 0.0 112.551 173.822 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -64.24 -40.92 97.01 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.8 1.24 . . . . 0.0 111.827 179.127 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 78.6 t -61.34 -44.7 98.94 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 121.505 -0.747 . . . . 0.0 111.143 169.504 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 81.1 p -64.04 -31.51 72.73 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.0 1.273 . . . . 0.0 113.913 176.88 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -57.27 -40.64 78.12 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 122.345 1.069 . . . . 0.0 110.854 174.316 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -73.85 -34.67 64.6 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 116.925 -1.512 . . . . 0.0 114.121 170.135 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 90.7 mt -61.24 -32.83 72.63 Favored 'General case' 0 N--CA 1.483 1.175 0 CA-C-N 121.793 2.088 . . . . 0.0 113.443 173.274 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 70.4 m -52.53 -44.82 66.01 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -174.159 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.1 t -75.73 -36.67 59.87 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.548 0.613 . . . . 0.0 110.788 175.733 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 10.1 tp -62.51 -28.33 69.76 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 127.16 2.184 . . . . 0.0 113.737 -168.148 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 28.2 mtm105 -71.92 -40.72 68.58 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.007 0.523 . . . . 0.0 110.602 171.815 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.82 -39.95 85.32 Favored Glycine 0 C--O 1.222 -0.654 0 CA-C-O 118.439 -1.2 . . . . 0.0 111.147 178.5 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 96.6 m -58.31 -12.91 4.18 Favored 'General case' 0 CA--C 1.565 1.556 0 C-N-CA 127.255 2.222 . . . . 0.0 112.323 168.541 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 82.29 -9.82 56.55 Favored Glycine 0 C--N 1.344 1.02 0 C-N-CA 127.033 2.254 . . . . 0.0 113.412 -179.834 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 19.8 mt -71.08 -31.52 67.92 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.196 1.398 . . . . 0.0 114.643 -167.862 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -109.62 139.65 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.688 1.595 . . . . 0.0 111.125 169.874 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 71.6 t -132.66 133.7 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 C-N-CA 125.764 1.626 . . . . 0.0 109.241 -176.272 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.72 135.34 35.5 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.482 0.713 . . . . 0.0 110.126 168.965 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 2.1 m -162.49 163.5 27.47 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.764 1.625 . . . . 0.0 107.046 -171.31 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -91.73 151.77 20.48 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 120.89 -1.131 . . . . 0.0 113.673 178.518 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -119.22 -171.56 2.14 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.513 1.925 . . . . 0.0 108.834 166.396 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -69.99 -10.28 64.72 Favored Glycine 0 CA--C 1.536 1.378 0 N-CA-C 116.932 1.533 . . . . 0.0 116.932 -168.69 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 24.6 mtm180 -138.27 -21.94 1.04 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.153 1.781 . . . . 0.0 113.571 -177.4 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -154.83 -175.39 5.4 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.665 1.575 . . . . 0.0 112.755 -179.478 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 9.2 p -83.34 146.61 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.312 1.045 . . . . 0.0 110.453 169.073 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -134.72 162.48 32.22 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 126.436 1.894 . . . . 0.0 111.566 -170.962 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -106.59 127.0 52.98 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 165.723 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -128.62 172.11 11.51 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.385 1.874 . . . . 0.0 109.924 176.218 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 29.4 mt -76.03 158.96 31.3 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.116 0.566 . . . . 0.0 112.399 177.912 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -46.2 -34.92 4.68 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.712 2.005 . . . . 0.0 116.071 177.955 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 11.6 t70 171.59 158.63 0.09 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 128.922 2.889 . . . . 0.0 110.453 -169.988 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 91.9 p -40.98 -36.14 0.62 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 128.749 2.82 . . . . 0.0 113.501 168.57 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . 0.4 ' CG ' ' HB3' ' A' ' 91' ' ' GLN . 5.2 m-70 -49.47 -53.05 25.18 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 125.674 1.59 . . . . 0.0 113.039 173.854 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 14.2 mt -74.22 -40.11 62.66 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.075 0.852 . . . . 0.0 110.43 -179.395 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.01 -45.76 75.14 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.088 0.555 . . . . 0.0 110.99 179.376 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -77.01 -35.6 56.94 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 117.049 -1.453 . . . . 0.0 114.193 176.088 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -69.31 -33.45 73.18 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 121.143 1.792 . . . . 0.0 112.822 178.778 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.44 -44.5 51.46 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.587 0.755 . . . . 0.0 110.683 169.868 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.96 -32.67 73.58 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 123.972 0.796 . . . . 0.0 113.178 -176.022 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -71.68 -8.79 56.34 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.289 1.436 . . . . 0.0 112.548 169.421 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . 0.404 ' C ' ' H ' ' B' ' 91' ' ' GLN . 4.8 tp 66.95 11.01 8.1 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 128.453 2.701 . . . . 0.0 115.338 167.994 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER 75.28 -9.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 C-N-CA 129.973 3.309 . . . . 0.0 111.907 168.093 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.459 ' C ' ' H ' ' B' ' 93' ' ' VAL 0.482 5.2 pt20 73.93 12.46 4.31 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 115.306 1.595 . . . . 0.0 115.306 141.726 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 4.9 p -68.38 42.68 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 130.112 3.365 . . . . 0.0 109.368 163.141 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . 0.459 ' H ' ' C ' ' B' ' 91' ' ' GLN . 1.5 t 59.22 45.57 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 C-N-CA 127.741 2.416 . . . . 0.0 111.633 178.296 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 32.6 tp 60.26 60.37 2.07 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 122.096 0.951 . . . . 0.0 110.242 -179.92 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.877 0 O-C-N 121.156 -0.965 . . . . 0.0 110.658 179.682 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 pt? . . . . . 0 N--CA 1.476 0.864 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.47 -54.23 35.77 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.879 0.871 . . . . 0.0 110.532 178.591 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -34.57 76.78 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.335 0.97 . . . . 0.0 112.586 176.631 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -68.77 -56.5 7.84 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.306 0.957 . . . . 0.0 111.066 -179.179 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.86 -29.84 75.91 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-O 119.128 -0.818 . . . . 0.0 111.141 -179.783 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -65.36 -48.4 73.08 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 118.344 1.072 . . . . 0.0 110.649 169.878 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.1 -24.97 67.44 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 119.869 1.213 . . . . 0.0 112.977 -179.647 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 mp -94.14 -4.34 49.39 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 171.477 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -99.68 -15.37 18.55 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 126.489 1.916 . . . . 0.0 114.192 168.511 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.416 ' CG ' HH21 ' A' ' 23' ' ' ARG . 0.7 OUTLIER -62.66 152.18 82.17 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 127.257 2.223 . . . . 0.0 112.671 174.221 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.35 -101.1 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 0.978 1 C-N-CA 127.533 5.489 . . . . 0.0 112.317 -169.681 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -44.92 -35.43 2.84 Favored 'General case' 0 C--O 1.22 -0.494 0 C-N-CA 126.516 1.926 . . . . 0.0 111.346 168.807 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.416 HH21 ' CG ' ' A' ' 20' ' ' ASP . 11.9 ttm-85 -64.41 -50.54 67.22 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 120.277 1.399 . . . . 0.0 113.952 -179.462 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.23 -42.51 99.37 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 120.069 1.304 . . . . 0.0 110.063 174.384 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 18.6 mmt-85 -54.48 -44.05 72.3 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 174.679 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.5 mm -50.22 -54.15 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.236 0.614 . . . . 0.0 109.792 170.772 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 86.7 mt -59.91 -48.11 83.05 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.472 -0.775 . . . . 0.0 112.173 -177.239 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.7 m -65.55 -36.05 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 CA-C-N 118.776 0.716 . . . . 0.0 111.092 -176.716 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.02 -26.7 33.58 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.513 0.561 . . . . 0.0 112.513 -178.773 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.9 tp -68.79 -37.27 79.17 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 117.182 -1.389 . . . . 0.0 112.051 174.323 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.39 -50.83 12.0 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.182 2.193 . . . . 0.0 112.893 -173.135 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -104.05 8.72 36.6 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 126.454 1.902 . . . . 0.0 112.118 178.695 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -92.98 -73.85 1.25 Allowed Glycine 0 C--N 1.341 0.86 0 C-N-CA 127.365 2.412 . . . . 0.0 111.504 172.256 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 23.7 m 24.54 49.54 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 C-N-CA 128.399 2.68 . . . . 0.0 115.918 -172.792 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 80.3 m -96.61 -66.94 0.87 Allowed 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 125.523 1.529 . . . . 0.0 112.661 177.304 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -146.0 159.02 47.7 Favored Pre-proline 0 N--CA 1.486 1.364 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -168.382 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -55.45 126.27 21.92 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.214 2.609 . . . . 0.0 111.061 173.528 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.56 8.35 62.91 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 117.918 -1.49 . . . . 0.0 115.046 179.966 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.07 -24.74 26.71 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.353 2.076 . . . . 0.0 112.883 177.085 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.3 mt -63.2 -15.87 58.32 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 125.894 1.677 . . . . 0.0 111.643 -176.662 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.27 -29.75 70.04 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 170.308 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.0 -49.04 16.31 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.489 0.586 . . . . 0.0 110.711 169.959 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -59.05 -36.49 75.13 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -179.023 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 17.5 mt -101.45 -14.12 17.66 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.279 1.432 . . . . 0.0 112.468 -175.839 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.4 -1.83 12.19 Favored Glycine 0 CA--C 1.536 1.359 0 CA-C-N 119.416 1.007 . . . . 0.0 114.497 -171.981 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -85.54 150.97 24.29 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.879 1.272 . . . . 0.0 110.738 178.21 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.4 p -64.58 159.38 21.93 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.637 -1.289 . . . . 0.0 111.87 -177.506 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 23.7 ttm180 -53.24 -34.43 57.11 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.27 0.628 . . . . 0.0 111.385 175.186 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.2 m -66.28 -55.47 15.91 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.01 0.823 . . . . 0.0 111.378 172.988 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -57.73 -33.53 68.55 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.944 0.793 . . . . 0.0 112.902 179.323 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.8 t -72.26 -49.46 42.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.905 1.282 . . . . 0.0 112.329 172.54 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 39.5 m -64.52 -30.4 71.43 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.987 0.812 . . . . 0.0 112.297 -178.107 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -50.95 -35.57 34.14 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.252 1.421 . . . . 0.0 113.529 170.529 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -90.06 -29.45 18.36 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 117.534 -1.222 . . . . 0.0 113.997 174.214 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 66.8 mt -66.58 -27.77 67.98 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.142 1.337 . . . . 0.0 112.388 176.047 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.1 t -50.5 -51.2 49.58 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.168 0.587 . . . . 0.0 111.887 173.505 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 15.6 t -68.85 -45.72 70.33 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.79 1.236 . . . . 0.0 111.511 170.415 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.53 -32.64 73.62 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -169.021 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 25.5 mtp-105 -75.8 -37.69 58.92 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.758 0.708 . . . . 0.0 112.535 168.945 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.5 -45.56 84.35 Favored Glycine 0 N--CA 1.469 0.873 0 C-N-CA 124.024 0.821 . . . . 0.0 112.646 -178.484 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.8 m -66.53 -5.59 11.88 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 126.472 1.909 . . . . 0.0 112.336 168.151 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.54 -7.57 57.41 Favored Glycine 0 C--N 1.338 0.675 0 C-N-CA 125.712 1.625 . . . . 0.0 115.315 175.989 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 37.5 mt -65.56 -25.67 67.53 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.934 1.294 . . . . 0.0 113.168 -169.128 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.6 m -119.63 139.29 47.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.14 1.376 . . . . 0.0 112.448 167.249 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 24.6 t -130.08 145.73 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 127.046 2.138 . . . . 0.0 109.681 -177.214 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.61 146.85 28.06 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 175.68 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.4 165.42 28.55 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.42 1.488 . . . . 0.0 110.188 172.544 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -89.55 138.04 31.81 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 118.393 -0.813 . . . . 0.0 109.496 165.259 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -95.76 -32.8 12.54 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.273 0.942 . . . . 0.0 112.166 167.277 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 146.77 -32.95 1.42 Allowed Glycine 0 N--CA 1.477 1.37 0 C-N-CA 125.873 1.702 . . . . 0.0 114.549 169.43 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 49.5 ttm-85 -89.17 -34.13 16.8 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 128.075 2.55 . . . . 0.0 111.652 170.523 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.54 179.86 8.78 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 128.084 2.553 . . . . 0.0 109.797 -172.582 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 15.9 m -85.98 161.43 2.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.456 166.723 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.0 ptt180 -138.38 156.17 47.85 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.044 1.737 . . . . 0.0 109.411 -178.619 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -90.88 148.68 22.31 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 164.395 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -148.49 164.73 33.29 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 123.682 0.793 . . . . 0.0 109.154 172.816 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -58.87 156.81 10.72 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 122.632 0.373 . . . . 0.0 111.859 169.92 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.73 -30.23 31.34 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -175.023 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.3 t0 174.98 167.36 0.28 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 129.976 3.311 . . . . 0.0 109.426 179.608 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 20.2 m -51.37 -22.94 3.25 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.283 1.833 . . . . 0.0 113.182 169.166 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.43 -58.39 8.21 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.343 1.057 . . . . 0.0 111.748 170.776 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 22.7 mt -65.35 -32.71 74.5 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.408 1.458 . . . . 0.0 110.841 176.034 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.12 -29.05 69.54 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.862 0.755 . . . . 0.0 111.073 -177.046 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -70.46 -53.91 14.44 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.731 1.212 . . . . 0.0 112.532 171.281 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.38 -40.01 96.08 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 120.622 1.555 . . . . 0.0 112.582 -178.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.34 -40.52 97.52 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.899 2.08 . . . . 0.0 113.165 169.89 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.85 -45.01 5.56 Favored Glycine 0 N--CA 1.476 1.343 0 C-N-CA 127.236 2.35 . . . . 0.0 114.701 -168.943 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.419 ' CD ' HH21 ' B' ' 84' ' ' ARG . 41.5 tp10 -62.3 -25.6 67.95 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.144 0.972 . . . . 0.0 108.617 165.204 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 20.6 tp 73.4 170.25 0.31 Allowed 'General case' 0 C--N 1.344 0.349 0 C-N-CA 130.162 3.385 . . . . 0.0 109.422 175.261 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.1 m -58.27 -5.39 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 O-C-N 120.24 -1.538 . . . . 0.0 113.573 168.125 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.472 ' C ' ' H ' ' A' ' 93' ' ' VAL . 19.7 mm-40 76.81 -24.87 0.21 Allowed 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 127.038 2.135 . . . . 0.0 111.844 165.409 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 2.3 p -62.89 29.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 128.595 2.758 . . . . 0.0 114.844 172.216 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.472 ' H ' ' C ' ' A' ' 91' ' ' GLN . 2.4 t 79.36 -22.08 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 130.217 3.407 . . . . 0.0 112.935 168.401 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.6 tp 132.16 99.8 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.771 1 C-N-CA 132.928 4.491 . . . . 0.0 107.674 -176.503 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.05 139.02 58.16 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 174.792 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 35.1 t -72.52 146.2 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 C-N-CA 124.658 1.183 . . . . 0.0 113.713 -169.024 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -77.21 51.24 0.82 Allowed 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 126.07 1.748 . . . . 0.0 113.291 173.203 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.6 p -122.19 151.45 40.99 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 125.748 1.619 . . . . 0.0 113.434 -176.025 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -88.35 115.17 25.66 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 165.791 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -140.43 140.14 22.19 Favored Pre-proline 0 CA--C 1.536 0.429 0 C-N-CA 124.121 0.968 . . . . 0.0 109.738 171.114 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -72.55 145.47 42.18 Favored 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 123.728 2.952 . . . . 0.0 113.77 -168.288 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 14.3 t . . . . . 0 CA--C 1.553 1.079 0 C-N-CA 125.376 1.47 . . . . 0.0 111.308 171.08 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 pt? . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.61 -23.36 66.8 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 119.645 1.111 . . . . 0.0 113.285 178.841 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . 0.474 HH21 ' CB ' ' B' ' 61' ' ' CYS . 3.4 tpt85 -82.25 -58.3 3.01 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.879 1.671 . . . . 0.0 110.759 169.004 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -64.75 -50.86 65.2 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 128.226 2.61 . . . . 0.0 112.655 -173.141 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.9 -39.08 97.59 Favored Glycine 0 CA--C 1.526 0.721 0 O-C-N 121.216 -0.927 . . . . 0.0 111.512 177.384 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -65.57 -34.54 78.47 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.64 0.776 . . . . 0.0 111.812 174.426 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.15 -24.97 65.16 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.473 1.033 . . . . 0.0 112.651 173.43 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.0 mp -101.7 -9.27 21.03 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.862 0.865 . . . . 0.0 113.088 174.571 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.19 -19.86 31.08 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.756 1.623 . . . . 0.0 113.242 167.233 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.495 ' CG ' HH11 ' B' ' 23' ' ' ARG . 1.5 m-20 -54.08 151.17 13.24 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 127.381 2.272 . . . . 0.0 113.571 173.055 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -66.92 -100.84 0.0 OUTLIER 'Trans proline' 0 CA--C 1.547 1.161 1 C-N-CA 127.194 5.262 . . . . 0.0 112.663 -171.91 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -47.46 -28.01 1.97 Allowed 'General case' 0 C--N 1.342 0.241 0 C-N-CA 126.467 1.907 . . . . 0.0 112.936 169.973 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . 0.671 HH21 ' CB ' ' B' ' 57' ' ' CYS . 0.2 OUTLIER -68.93 -47.93 64.5 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 119.65 1.113 . . . . 0.0 113.66 177.85 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 43.3 t -60.41 -42.18 95.43 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.866 1.212 . . . . 0.0 110.728 172.757 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 19.3 mmt-85 -58.03 -43.14 86.59 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 174.437 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.1 mt -47.37 -57.7 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 CA-C-N 118.782 0.719 . . . . 0.0 109.185 169.155 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 63.6 mt -62.22 -44.72 95.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 117.365 -1.303 . . . . 0.0 112.608 -171.167 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.7 m -61.49 -33.3 56.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 CA-C-N 120.391 1.451 . . . . 0.0 111.698 176.34 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.01 -17.22 47.57 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.929 0.891 . . . . 0.0 113.37 177.617 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 tp -72.55 -42.12 65.02 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 117.366 -1.302 . . . . 0.0 111.446 169.115 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.03 -51.09 25.55 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.829 2.052 . . . . 0.0 112.475 -173.229 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -99.51 10.79 40.73 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.546 1.938 . . . . 0.0 112.581 -178.338 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -119.07 -80.44 0.68 Allowed Glycine 0 C--N 1.34 0.796 0 C-N-CA 126.46 1.981 . . . . 0.0 112.821 -173.388 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 9.1 m 35.58 37.68 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 126.559 1.944 . . . . 0.0 115.169 -169.995 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -82.33 -71.94 0.46 Allowed 'General case' 0 C--O 1.223 -0.327 0 O-C-N 120.842 -1.161 . . . . 0.0 112.357 -171.756 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -136.01 -176.18 0.55 Allowed Pre-proline 0 CA--C 1.553 1.096 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -168.547 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -79.51 95.92 1.05 Allowed 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 121.734 1.623 . . . . 0.0 108.964 -174.386 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 80.54 29.59 43.4 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-O 119.177 -0.79 . . . . 0.0 113.92 -177.648 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -60.73 -22.47 64.03 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.317 1.559 . . . . 0.0 112.0 169.889 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 8.1 mt -48.34 -20.87 0.44 Allowed 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 127.368 2.267 . . . . 0.0 113.455 171.018 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.28 -28.89 70.03 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.961 0.801 . . . . 0.0 112.055 176.958 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.01 -50.74 12.45 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.324 0.65 . . . . 0.0 110.55 168.904 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -56.91 -37.5 71.53 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -177.248 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.6 mt -97.58 -13.74 21.43 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.334 1.453 . . . . 0.0 112.28 -177.497 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.19 -6.58 4.0 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.691 1.139 . . . . 0.0 114.532 -171.349 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -84.12 147.65 27.23 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.91 1.355 . . . . 0.0 110.042 -179.532 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.7 p -59.93 155.29 16.9 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 121.677 -0.639 . . . . 0.0 111.311 -177.881 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -53.15 -35.77 60.11 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.099 178.054 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 11.6 m -64.26 -58.63 5.98 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.017 0.927 . . . . 0.0 111.514 172.139 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -55.16 -36.36 65.75 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.444 1.02 . . . . 0.0 113.262 -178.255 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 59.5 t -76.53 -43.4 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.465 0.706 . . . . 0.0 112.346 174.467 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.5 m -62.37 -30.67 71.36 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 119.763 1.165 . . . . 0.0 112.882 178.972 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -56.11 -28.97 59.88 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.879 1.271 . . . . 0.0 113.201 171.603 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 -90.46 -30.5 17.29 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-O 117.507 -1.235 . . . . 0.0 114.036 169.613 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 91.1 mt -64.79 -38.3 90.51 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 120.656 1.571 . . . . 0.0 113.035 177.808 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 1.2 m -60.3 -29.8 69.07 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 179.831 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . 0.671 ' CB ' HH21 ' B' ' 23' ' ' ARG . 40.0 t -75.86 -41.05 53.42 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.318 0.963 . . . . 0.0 110.682 169.017 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.5 tp -57.79 -38.68 75.93 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 125.54 1.536 . . . . 0.0 112.597 -174.819 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 58.5 mtm-85 -73.03 -35.33 66.74 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 118.47 0.577 . . . . 0.0 112.098 174.458 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . 0.413 ' C ' ' H ' ' B' ' 62' ' ' GLY . . . -81.82 -44.16 7.9 Favored Glycine 0 N--CA 1.468 0.774 0 C-N-CA 124.188 0.899 . . . . 0.0 112.855 -170.287 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . 0.474 ' CB ' HH21 ' B' ' 13' ' ' ARG . 94.4 m -74.18 16.21 0.26 Allowed 'General case' 0 CA--C 1.57 1.73 0 C-N-CA 125.837 1.655 . . . . 0.0 112.183 169.538 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . 0.413 ' H ' ' C ' ' B' ' 60' ' ' GLY . . . 69.36 28.13 72.88 Favored Glycine 0 C--N 1.343 0.938 0 C-N-CA 127.38 2.419 . . . . 0.0 117.383 167.783 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 56.1 mt -92.96 -32.64 14.47 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.183 0.992 . . . . 0.0 113.272 -177.782 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -134.56 138.57 49.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 C-N-CA 125.469 1.508 . . . . 0.0 113.598 -175.72 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 97.1 t -126.15 136.19 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 126.956 2.102 . . . . 0.0 108.83 179.856 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -77.64 141.13 39.61 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.782 0.833 . . . . 0.0 112.141 177.346 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -141.85 154.74 45.37 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.9 0.88 . . . . 0.0 108.828 171.817 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -73.83 132.62 42.75 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 167.715 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.53 -31.84 42.15 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.475 0.71 . . . . 0.0 110.887 166.86 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 145.61 -35.78 1.39 Allowed Glycine 0 CA--C 1.533 1.168 0 C-N-CA 126.51 2.005 . . . . 0.0 113.506 173.92 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 56.4 ttm-85 -96.06 -36.08 11.14 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 127.146 2.179 . . . . 0.0 111.886 169.921 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.38 -171.09 3.71 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.484 1.513 . . . . 0.0 110.768 -178.736 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 17.6 m -100.62 146.0 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.569 1.148 . . . . 0.0 111.106 176.459 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.0 ptt180 -116.39 172.26 7.31 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 126.537 1.935 . . . . 0.0 109.764 177.732 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -111.5 110.68 21.22 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 167.898 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -108.43 143.84 36.83 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.502 0.592 . . . . 0.0 109.49 176.06 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 8.5 mt -52.97 144.17 15.53 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 122.952 0.501 . . . . 0.0 110.864 169.385 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.28 -30.24 70.35 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 113.747 1.018 . . . . 0.0 113.747 -168.136 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -158.03 155.64 29.69 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 122.737 1.256 . . . . 0.0 111.622 167.387 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -39.95 -32.23 0.15 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 129.751 3.221 . . . . 0.0 113.264 167.185 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -52.95 -51.57 60.96 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.608 1.563 . . . . 0.0 112.844 169.532 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 11.8 mt -69.0 -44.35 72.98 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.225 0.921 . . . . 0.0 110.049 -178.881 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.59 -33.56 55.28 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.252 1.021 . . . . 0.0 112.617 173.52 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . 0.419 HH21 ' CD ' ' A' ' 88' ' ' GLU . 5.4 mmm180 -69.61 -54.09 15.67 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.7 1.2 . . . . 0.0 113.479 173.28 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.31 -38.4 91.01 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 120.249 1.386 . . . . 0.0 112.672 178.619 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 60.1 tp -60.86 -41.52 96.08 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.099 1.76 . . . . 0.0 112.872 169.222 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.36 -44.91 6.37 Favored Glycine 0 N--CA 1.474 1.18 0 C-N-CA 127.167 2.318 . . . . 0.0 115.198 -169.062 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -63.15 -27.07 69.12 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 118.297 1.048 . . . . 0.0 109.156 166.641 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . 0.436 ' C ' ' H ' ' B' ' 91' ' ' GLN . 30.6 tp 77.18 163.05 0.23 Allowed 'General case' 0 C--N 1.345 0.38 0 C-N-CA 129.971 3.308 . . . . 0.0 109.487 173.313 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 14.9 m -54.21 -5.77 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 O-C-N 120.203 -1.561 . . . . 0.0 114.564 168.05 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.436 ' H ' ' C ' ' B' ' 89' ' ' LEU . 27.7 mm-40 72.13 -20.32 0.26 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.739 2.015 . . . . 0.0 114.218 164.491 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.2 p -65.66 38.98 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 131.045 3.738 . . . . 0.0 114.275 -177.931 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.1 t 70.97 17.42 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 C-N-CA 126.387 1.875 . . . . 0.0 111.897 175.127 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 56.8 tp 73.95 108.17 0.07 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 129.596 3.158 . . . . 0.0 109.371 -168.507 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.695 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 175.79 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 pp . . . . . 0 N--CA 1.474 0.762 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.49 -26.31 67.83 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 174.221 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.6 mmt-85 -79.33 -43.09 24.24 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.33 -0.843 . . . . 0.0 110.911 168.967 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -56.18 -48.12 76.96 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.904 1.682 . . . . 0.0 112.622 -177.07 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.61 -26.59 71.23 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-O 119.539 -0.589 . . . . 0.0 112.56 -177.02 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.5 tmm_? -70.75 -45.44 64.82 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 118.322 1.061 . . . . 0.0 108.688 166.8 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.01 -22.55 66.97 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.019 1.328 . . . . 0.0 113.988 -176.964 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.7 mp -99.9 -3.45 32.4 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.894 1.225 . . . . 0.0 113.125 168.949 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -86.76 1.38 52.41 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.555 1.142 . . . . 0.0 113.165 167.926 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.82 160.78 71.65 Favored Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 127.177 2.191 . . . . 0.0 114.145 -172.003 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -72.4 -121.68 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.125 1 C-N-CA 126.061 4.508 . . . . 0.0 110.139 173.079 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.9 m -56.97 -21.07 27.51 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.014 1.326 . . . . 0.0 113.405 179.946 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.4 ' HE ' ' CD1' ' A' ' 58' ' ' LEU . 0.5 OUTLIER -69.04 -39.64 79.08 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.6 1.546 . . . . 0.0 112.254 173.547 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 5.7 t -71.28 -28.08 63.88 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.661 -1.274 . . . . 0.0 111.483 169.623 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.9 tpp180 -61.68 -40.25 94.31 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 120.742 -1.224 . . . . 0.0 111.769 170.766 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.9 mm -57.17 -43.49 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 124.873 1.269 . . . . 0.0 112.43 171.585 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 71.6 mt -60.11 -47.0 87.72 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 119.129 -0.462 . . . . 0.0 111.74 174.769 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.4 p -76.55 -26.59 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -171.869 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.84 -21.52 37.54 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 173.334 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.3 tp -77.63 -29.43 51.76 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 120.947 1.703 . . . . 0.0 112.117 170.602 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.42 -49.68 17.77 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.84 2.056 . . . . 0.0 112.51 170.129 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -101.31 29.84 4.53 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 128.538 2.735 . . . . 0.0 110.55 174.703 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -128.02 -84.45 0.45 Allowed Glycine 0 CA--C 1.527 0.791 0 C-N-CA 125.6 1.571 . . . . 0.0 113.256 -177.542 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 26.9 m 31.77 31.4 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 118.347 2.721 . . . . 0.0 118.347 -171.172 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 96.3 m -83.3 -87.33 0.1 Allowed 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 125.316 1.446 . . . . 0.0 110.861 175.821 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -136.37 153.23 76.18 Favored Pre-proline 0 N--CA 1.472 0.63 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -169.569 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -56.53 135.02 68.05 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.991 1.794 . . . . 0.0 109.096 171.882 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.72 -5.89 67.87 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 117.874 -1.515 . . . . 0.0 114.854 -174.961 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.88 -28.89 64.6 Favored 'General case' 0 C--N 1.348 0.539 0 CA-C-N 120.499 2.149 . . . . 0.0 112.38 177.284 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.0 mt -69.09 -16.1 63.6 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 124.262 1.025 . . . . 0.0 111.952 -175.762 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.58 -47.54 66.51 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 119.772 1.169 . . . . 0.0 110.36 174.315 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.48 -39.97 85.26 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.849 -0.532 . . . . 0.0 111.789 172.587 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -71.78 -27.85 63.22 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -175.796 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 37.6 mt -95.96 -22.79 17.19 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.316 1.046 . . . . 0.0 112.16 173.749 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.54 9.81 86.72 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.319 0.961 . . . . 0.0 112.003 -167.97 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 80.3 mt -108.26 167.57 9.93 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.954 1.302 . . . . 0.0 112.445 -169.358 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.7 p -69.15 143.26 54.14 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.526 0.679 . . . . 0.0 112.537 -167.882 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -56.71 -31.49 64.56 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.44 1.096 . . . . 0.0 111.157 172.024 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 12.4 m -66.0 -54.43 26.24 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.14 0.976 . . . . 0.0 111.445 171.096 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -70.43 -35.46 73.41 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.464 1.029 . . . . 0.0 112.239 -175.531 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.3 t -61.78 -34.69 63.61 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 O-C-N 119.57 -1.956 . . . . 0.0 111.865 169.779 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 56.0 m -67.53 -41.93 83.57 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 120.134 1.334 . . . . 0.0 112.523 172.753 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -50.7 -45.98 58.63 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.66 0.784 . . . . 0.0 110.735 171.973 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -68.93 -33.9 74.5 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 -179.189 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 23.8 mt -88.89 -7.32 56.31 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.807 1.243 . . . . 0.0 113.988 -178.172 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.7 t -67.05 -51.18 57.82 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 120.194 1.361 . . . . 0.0 110.886 177.217 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 5.2 t -73.8 -39.84 63.83 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 122.893 0.477 . . . . 0.0 111.76 179.767 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.4 ' CD1' ' HE ' ' A' ' 23' ' ' ARG . 3.3 tp -55.25 -38.19 68.21 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.778 2.031 . . . . 0.0 113.556 -174.036 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.7 mtm180 -78.51 -23.11 46.49 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.46 1.104 . . . . 0.0 112.178 -179.741 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -80.49 -55.51 3.41 Favored Glycine 0 C--N 1.342 0.908 0 C-N-CA 125.861 1.696 . . . . 0.0 110.78 172.766 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 66.6 m -51.08 -16.12 0.42 Allowed 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 127.413 2.285 . . . . 0.0 113.164 173.184 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.35 -3.24 67.92 Favored Glycine 0 C--N 1.338 0.677 0 C-N-CA 125.91 1.719 . . . . 0.0 113.716 179.468 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 34.5 mt -57.17 -26.57 60.83 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 118.495 1.148 . . . . 0.0 112.323 -179.044 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 6.1 m -133.21 156.88 42.49 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.102 0 C-N-CA 126.488 1.915 . . . . 0.0 111.384 169.204 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.5 m -148.92 151.5 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 126.043 1.737 . . . . 0.0 111.349 -171.907 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -88.4 140.27 29.63 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.355 1.462 . . . . 0.0 112.416 176.94 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 90.2 m -160.84 158.83 29.04 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.774 1.63 . . . . 0.0 107.777 -179.892 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -84.97 138.15 32.66 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 121.57 1.986 . . . . 0.0 112.011 169.6 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.0 -10.2 57.26 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 169.866 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 131.29 -22.5 4.43 Favored Glycine 0 N--CA 1.474 1.205 0 C-N-CA 125.96 1.743 . . . . 0.0 114.751 174.697 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.94 5.71 0.3 Allowed 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.056 2.142 . . . . 0.0 113.886 -179.909 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -152.67 157.64 41.23 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 128.62 2.768 . . . . 0.0 108.043 168.641 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 5.6 p -79.78 145.85 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 168.642 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.9 ptt85 -124.7 148.2 48.16 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 125.535 1.534 . . . . 0.0 109.837 -177.494 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -100.42 135.08 42.41 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 105.443 -2.058 . . . . 0.0 105.443 164.902 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -145.87 158.3 43.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 118.19 -0.909 . . . . 0.0 111.541 -176.003 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 tp -56.53 154.86 8.0 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.064 0.945 . . . . 0.0 112.688 176.342 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.14 -11.08 3.27 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 117.83 2.53 . . . . 0.0 117.83 -175.898 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.0 t70 152.1 161.62 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 131.165 3.786 . . . . 0.0 109.549 -177.371 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -41.33 -22.51 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 129.372 3.069 . . . . 0.0 112.099 163.579 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -64.12 0.96 Allowed 'General case' 0 C--N 1.349 0.563 0 C-N-CA 126.621 1.968 . . . . 0.0 111.485 175.21 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 25.3 mt -56.27 -43.77 79.09 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.701 1.137 . . . . 0.0 108.741 173.928 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.53 -44.65 69.35 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.512 1.125 . . . . 0.0 112.148 -172.884 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -79.67 -15.09 58.22 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 115.706 1.743 . . . . 0.0 115.706 -175.887 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -92.78 -48.45 6.56 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.695 1.134 . . . . 0.0 110.956 170.278 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.5 tp -49.62 -45.83 48.62 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.641 1.976 . . . . 0.0 110.824 169.679 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.81 -19.33 79.31 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 126.796 2.141 . . . . 0.0 116.433 -170.925 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -101.54 -0.88 34.21 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 118.928 1.364 . . . . 0.0 113.047 170.208 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.6 tp 93.7 23.57 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 129.19 2.996 . . . . 0.0 113.68 169.219 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.285 3.9 t 71.34 37.98 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 125.47 1.508 . . . . 0.0 110.04 169.436 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 86.61 -21.98 0.18 Allowed 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.309 -0.869 . . . . 0.0 112.329 130.021 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.9 p -72.66 39.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 129.428 3.091 . . . . 0.0 112.566 171.94 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.6 m 52.44 10.61 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 128.627 2.771 . . . . 0.0 116.425 -179.903 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.8 tt 100.35 101.37 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 130.857 3.663 . . . . 0.0 108.829 -169.719 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -103.1 155.66 18.24 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.258 0.623 . . . . 0.0 111.035 170.255 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 31.3 m -98.24 150.25 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -171.681 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 59.7 p30 -99.57 -4.07 31.92 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 -179.713 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -75.71 40.0 0.18 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 127.708 2.403 . . . . 0.0 115.701 -167.015 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 45.8 t0 62.88 69.56 0.59 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.812 2.045 . . . . 0.0 110.081 170.66 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.97 164.57 33.23 Favored Pre-proline 0 CA--C 1.549 0.925 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.531 -169.879 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -83.21 172.75 10.41 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 124.292 3.328 . . . . 0.0 111.819 177.663 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 31.0 p . . . . . 0 CA--C 1.55 0.946 0 CA-C-O 123.073 1.416 . . . . 0.0 107.26 165.532 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 pp . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.67 -27.85 68.97 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 118.624 0.647 . . . . 0.0 112.49 175.548 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 1.3 mmt-85 -77.16 -26.36 52.92 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 116.854 -1.546 . . . . 0.0 113.413 176.979 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.71 -63.97 1.03 Allowed 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.785 1.175 . . . . 0.0 109.5 170.928 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.27 -37.71 95.31 Favored Glycine 0 N--CA 1.471 0.972 0 CA-C-N 118.22 0.464 . . . . 0.0 112.704 -172.764 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -46.58 88.98 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.698 0.799 . . . . 0.0 111.292 173.799 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.55 -14.72 61.7 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 118.239 -0.886 . . . . 0.0 112.893 -179.625 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 10.6 mp -93.39 -24.21 18.15 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.169 0.895 . . . . 0.0 112.607 170.624 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.18 -16.64 57.71 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.894 1.678 . . . . 0.0 113.776 169.443 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -59.36 130.64 87.5 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 126.423 1.889 . . . . 0.0 109.511 176.643 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -48.92 -72.3 0.05 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.554 1 C-N-CA 125.869 4.379 . . . . 0.0 111.918 -168.59 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 70.8 m -91.56 -15.43 28.69 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 117.914 -1.041 . . . . 0.0 112.082 -173.739 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 48.4 mtt180 -66.1 -33.97 76.99 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 121.415 1.916 . . . . 0.0 110.779 167.997 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 42.4 t -56.75 -46.03 81.64 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 120.024 1.284 . . . . 0.0 111.15 167.309 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -60.88 -46.71 89.55 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.56 0.744 . . . . 0.0 111.866 176.539 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.6 mm -57.85 -49.93 79.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.953 1.301 . . . . 0.0 112.06 174.706 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 85.8 mt -62.11 -45.34 93.89 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.092 0.957 . . . . 0.0 111.496 -178.767 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 5.7 p -74.81 -32.5 28.37 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 CA-C-N 118.868 0.758 . . . . 0.0 112.979 -179.501 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.95 -28.83 64.77 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.494 -0.754 . . . . 0.0 111.875 173.857 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.7 tp -65.3 -36.27 83.54 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-N 119.973 1.26 . . . . 0.0 113.507 175.509 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.96 -40.57 30.93 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.999 2.52 . . . . 0.0 113.077 171.414 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -98.24 9.14 43.68 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 127.023 2.129 . . . . 0.0 112.307 179.499 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -126.0 -82.61 0.46 Allowed Glycine 0 CA--C 1.527 0.815 0 C-N-CA 124.746 1.165 . . . . 0.0 115.147 -169.725 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 34.6 m 36.93 32.13 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 127.884 2.474 . . . . 0.0 116.707 -168.57 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 68.2 m -79.75 -90.65 0.05 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.662 0.785 . . . . 0.0 111.019 179.716 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -136.72 154.65 76.64 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -169.174 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -55.89 125.69 19.94 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.316 2.011 . . . . 0.0 109.696 175.55 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 90.03 -7.27 81.96 Favored Glycine 0 CA--C 1.533 1.178 0 CA-C-O 117.6 -1.667 . . . . 0.0 115.348 -174.409 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -27.05 63.17 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.666 2.233 . . . . 0.0 112.137 178.938 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 2.1 mp -71.35 -18.88 62.36 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-O 117.913 -1.042 . . . . 0.0 113.075 -177.653 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.09 -40.9 97.24 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.88 1.218 . . . . 0.0 111.206 172.443 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.04 -44.13 66.43 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.652 -0.655 . . . . 0.0 111.714 170.122 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.96 -29.23 70.65 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -177.714 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 45.9 mt -103.76 -14.06 16.21 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.336 1.454 . . . . 0.0 113.824 179.18 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.98 -0.51 45.59 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 119.004 0.82 . . . . 0.0 113.797 -169.153 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 43.3 mt -92.37 157.96 16.33 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.757 1.279 . . . . 0.0 111.653 -171.38 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 13.3 p -62.25 147.43 48.02 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.134 0.492 . . . . 0.0 110.91 -174.594 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 ptp180 -57.94 -33.6 68.98 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 122.148 -0.345 . . . . 0.0 111.834 175.883 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 15.9 m -65.68 -49.29 69.11 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.649 0.779 . . . . 0.0 111.532 171.345 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -66.07 -43.03 88.57 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 118.897 0.771 . . . . 0.0 111.246 -178.612 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 4.2 t -59.88 -32.04 48.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 O-C-N 119.303 -2.123 . . . . 0.0 112.55 170.371 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 54.8 m -67.66 -39.93 84.5 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.922 1.237 . . . . 0.0 113.204 172.468 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -50.15 -46.79 54.3 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.976 0.911 . . . . 0.0 110.715 171.215 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -67.18 -45.42 77.0 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 118.523 -0.751 . . . . 0.0 112.162 -179.311 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 32.2 mt -73.49 -22.55 60.11 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.963 1.098 . . . . 0.0 113.963 -177.828 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -56.49 -53.11 61.27 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.137 1.335 . . . . 0.0 113.685 -176.758 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 2.3 t -70.64 -40.17 73.24 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 118.654 0.661 . . . . 0.0 110.727 177.507 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 2.0 tp -56.23 -38.39 70.99 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 127.796 2.439 . . . . 0.0 114.743 -173.32 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 46.9 mtm105 -78.76 -16.05 57.68 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.276 1.03 . . . . 0.0 112.757 177.43 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -85.4 -54.39 2.84 Favored Glycine 0 C--N 1.341 0.847 0 C-N-CA 125.82 1.676 . . . . 0.0 111.025 169.715 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 99.4 m -50.94 -16.26 0.41 Allowed 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 127.549 2.34 . . . . 0.0 113.296 175.162 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.11 -4.18 59.19 Favored Glycine 0 C--N 1.338 0.684 0 C-N-CA 125.99 1.757 . . . . 0.0 113.526 -178.394 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 68.3 mt -56.11 -28.65 58.65 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.633 1.217 . . . . 0.0 112.286 178.707 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 8.1 m -132.22 155.64 41.68 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 C-N-CA 126.025 1.73 . . . . 0.0 111.451 169.642 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 1.7 m -147.63 151.63 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.73 1.612 . . . . 0.0 111.443 -170.213 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -94.13 140.25 29.98 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.442 1.497 . . . . 0.0 111.544 178.006 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 47.7 m -163.15 171.97 15.54 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.547 1.539 . . . . 0.0 108.375 -174.442 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -88.15 145.04 26.13 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 121.04 1.746 . . . . 0.0 111.878 167.807 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.19 -44.71 13.68 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.461 -0.774 . . . . 0.0 111.328 170.533 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.25 -25.55 0.03 OUTLIER Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.553 1.549 . . . . 0.0 114.266 171.368 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.76 -29.73 0.78 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.042 1.737 . . . . 0.0 112.751 176.952 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -117.38 166.55 12.18 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.326 2.25 . . . . 0.0 110.255 176.982 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 8.7 p -79.78 147.93 6.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.641 172.255 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 14.0 ptt85 -130.65 160.93 32.77 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 127.983 2.513 . . . . 0.0 109.646 -177.306 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 21.2 m-30 -104.59 146.56 28.73 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 161.924 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -148.72 157.97 43.82 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 124.376 1.07 . . . . 0.0 110.299 178.807 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 58.3 mt -62.56 155.28 26.34 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.604 0.638 . . . . 0.0 111.529 172.279 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -50.49 -21.5 1.52 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 128.155 2.582 . . . . 0.0 117.3 -176.128 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 8.3 t70 167.4 168.2 0.03 OUTLIER 'General case' 0 C--O 1.24 0.558 0 C-N-CA 130.669 3.588 . . . . 0.0 108.282 177.167 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -42.02 -20.25 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.782 2.433 . . . . 0.0 111.778 162.087 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -63.18 1.3 Allowed 'General case' 0 C--N 1.346 0.415 0 C-N-CA 127.885 2.474 . . . . 0.0 111.742 175.5 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 34.1 mt -65.1 -35.86 82.46 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.384 0.993 . . . . 0.0 109.683 176.25 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.65 -41.72 82.05 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 177.238 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -81.76 -21.59 37.73 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -176.678 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -85.84 -44.31 12.55 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.024 0.829 . . . . 0.0 111.567 171.204 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.74 -39.93 88.13 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 122.762 0.425 . . . . 0.0 111.042 175.564 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.15 -18.96 58.75 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.686 1.612 . . . . 0.0 115.638 -176.698 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.6 -2.23 25.38 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 169.877 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 17.6 tp 106.17 2.26 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 130.596 3.559 . . . . 0.0 114.476 167.542 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . 0.306 2.9 t 80.58 40.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 125.939 1.696 . . . . 0.0 110.068 -177.871 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 86.81 -26.41 0.09 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.367 -0.833 . . . . 0.0 113.049 127.046 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 13.7 p -68.58 31.1 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.918 1 C-N-CA 131.787 4.035 . . . . 0.0 113.595 175.955 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 31.1 m 47.08 25.62 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 127.334 2.254 . . . . 0.0 115.84 -177.107 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt 97.74 98.78 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 130.502 3.521 . . . . 0.0 110.506 -179.348 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.651 0 O-C-N 121.872 -0.517 . . . . 0.0 110.691 169.567 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 pp . . . . . 0 N--CA 1.468 0.436 0 CA-C-O 120.658 0.266 . . . . 0.0 111.588 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.29 -11.2 60.61 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.167 0.987 . . . . 0.0 113.27 -179.176 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.0 mmp_? -108.5 -25.62 10.84 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.731 -1.231 . . . . 0.0 113.354 171.215 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -53.82 -45.78 70.95 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.408 1.083 . . . . 0.0 109.464 169.267 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.03 -36.6 93.24 Favored Glycine 0 CA--C 1.535 1.287 0 CA-C-O 119.349 -0.695 . . . . 0.0 113.365 175.148 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -45.65 92.09 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 118.975 1.388 . . . . 0.0 110.311 177.602 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.46 98.09 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.565 1.146 . . . . 0.0 111.94 176.756 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.6 mt -78.61 -15.11 58.91 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 117.918 -1.039 . . . . 0.0 113.271 177.612 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.86 -26.8 25.46 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 169.74 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -47.83 143.37 6.24 Favored Pre-proline 0 CA--C 1.543 0.689 0 C-N-CA 126.069 1.747 . . . . 0.0 113.571 -173.865 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -61.15 -74.62 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.607 1 C-N-CA 125.604 4.202 . . . . 0.0 111.956 -169.762 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 46.7 m -59.1 -37.94 78.35 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 121.834 -0.541 . . . . 0.0 110.429 172.092 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.55 -32.38 68.04 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -169.019 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.7 t -64.88 -46.89 79.89 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 121.369 1.895 . . . . 0.0 108.273 167.28 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 32.9 ttm-85 -62.55 -15.83 52.87 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.157 1.383 . . . . 0.0 114.661 175.28 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.3 mt -71.71 -55.93 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 CA-C-N 121.46 1.937 . . . . 0.0 108.886 167.571 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.02 -33.24 70.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 117.889 -1.053 . . . . 0.0 113.685 -172.269 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.4 m -60.48 -27.25 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 CA-C-N 119.658 1.117 . . . . 0.0 112.072 173.974 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -104.17 8.05 36.24 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.616 1.966 . . . . 0.0 112.398 -179.038 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -104.94 -22.12 13.19 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.016 1.726 . . . . 0.0 113.061 172.013 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.14 -59.14 5.75 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.411 1.885 . . . . 0.0 107.007 166.298 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -96.77 35.52 1.52 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 128.213 2.605 . . . . 0.0 112.202 173.716 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -110.61 -98.89 2.51 Favored Glycine 0 N--CA 1.472 1.049 0 O-C-N 120.889 -1.132 . . . . 0.0 113.721 -172.152 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.4 m 43.35 14.67 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 N-CA-C 120.268 3.433 . . . . 0.0 120.268 173.07 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 72.6 m -80.7 -89.88 0.06 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.347 0.976 . . . . 0.0 111.058 175.699 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -133.02 158.14 76.6 Favored Pre-proline 0 CA--C 1.55 0.977 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -168.077 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -59.57 131.22 39.15 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.438 2.759 . . . . 0.0 110.717 177.867 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.09 -2.47 18.6 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-O 117.783 -1.565 . . . . 0.0 115.079 -179.072 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.6 pp0? -60.21 -30.32 69.3 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 120.468 2.134 . . . . 0.0 111.71 -178.637 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 mt -46.87 -26.95 1.08 Allowed 'General case' 0 C--O 1.219 -0.535 0 C-N-CA 126.141 1.777 . . . . 0.0 112.992 174.555 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.74 -39.71 71.53 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 175.096 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.68 -42.77 57.83 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.139 0.881 . . . . 0.0 111.467 172.361 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -31.2 70.38 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 125.689 1.596 . . . . 0.0 113.698 -178.502 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 25.7 mt -103.18 -13.98 16.56 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.814 2.046 . . . . 0.0 113.521 178.854 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.33 3.92 67.35 Favored Glycine 0 CA--C 1.538 1.512 0 C-N-CA 125.164 1.364 . . . . 0.0 114.569 -171.084 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.5 mt -93.04 169.06 10.71 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.758 1.223 . . . . 0.0 112.142 -171.258 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.419 HG21 ' H ' ' A' ' 50' ' ' ASN . 1.3 t -70.65 141.72 51.65 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 120.915 -1.116 . . . . 0.0 110.857 169.339 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -62.78 -11.67 19.3 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.06 0.944 . . . . 0.0 112.949 169.695 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 41.0 t -71.0 -58.44 3.57 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.555 1.142 . . . . 0.0 111.157 167.811 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.419 ' H ' HG21 ' A' ' 47' ' ' THR . 41.6 t-20 -55.08 -49.33 71.93 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.851 1.66 . . . . 0.0 110.811 173.394 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 5.0 t -60.08 -44.59 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-O 117.91 -1.043 . . . . 0.0 112.302 175.326 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 60.0 m -69.76 -35.66 75.12 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 121.335 1.88 . . . . 0.0 113.705 -179.686 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -50.54 -46.58 57.54 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.536 0.734 . . . . 0.0 110.887 172.14 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -82.2 -13.04 57.71 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 175.82 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 92.3 mt -78.78 -26.72 44.46 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 122.117 2.235 . . . . 0.0 110.906 168.637 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.0 m -45.51 -55.93 5.65 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.662 1.119 . . . . 0.0 113.08 172.917 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 1.7 t -93.2 4.64 53.66 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 179.388 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.7 tp -83.72 -40.68 18.56 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.871 -1.143 . . . . 0.0 108.657 167.159 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.2 mtm105 -76.86 -28.76 55.56 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.618 1.567 . . . . 0.0 110.585 173.552 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.71 -64.25 3.55 Favored Glycine 0 C--N 1.345 1.05 0 C-N-CA 125.431 1.491 . . . . 0.0 110.909 174.744 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 49.5 m -65.89 5.72 0.45 Allowed 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 125.7 1.6 . . . . 0.0 114.6 176.202 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.62 -2.4 31.59 Favored Glycine 0 N--CA 1.471 0.974 0 C-N-CA 126.03 1.776 . . . . 0.0 114.973 176.031 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 72.1 mt -59.85 -25.67 65.22 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.718 1.259 . . . . 0.0 113.51 -175.689 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.7 m -123.83 140.77 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.755 1.622 . . . . 0.0 111.815 169.002 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 51.6 t -118.61 138.64 48.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 127.18 2.192 . . . . 0.0 110.025 -175.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.436 ' C ' ' HG1' ' A' ' 67' ' ' THR . . . -76.49 143.05 40.7 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.605 1.162 . . . . 0.0 111.254 172.574 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.436 ' HG1' ' C ' ' A' ' 66' ' ' ALA . 2.8 m -164.72 150.04 9.89 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 120.256 -1.528 . . . . 0.0 109.644 -176.788 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -84.16 126.34 33.02 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.166 1.348 . . . . 0.0 110.061 165.557 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.282 0.0 OUTLIER -74.34 -41.47 61.03 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.477 0.581 . . . . 0.0 111.844 174.817 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 162.08 -30.36 0.3 Allowed Glycine 0 CA--C 1.531 1.073 0 C-N-CA 125.476 1.512 . . . . 0.0 114.116 169.724 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -112.58 -17.82 12.53 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 127.055 2.142 . . . . 0.0 112.61 172.116 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -151.21 164.27 36.95 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.81 2.444 . . . . 0.0 110.415 -171.913 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 4.2 p -82.55 152.89 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 123.559 0.743 . . . . 0.0 110.51 168.833 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.2 ptt180 -136.96 162.34 33.54 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 126.316 1.846 . . . . 0.0 111.3 -172.755 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -116.68 123.46 47.3 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.142 0.977 . . . . 0.0 108.466 166.463 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -125.3 149.11 48.38 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 117.011 -1.471 . . . . 0.0 110.989 -178.531 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.7 mp -61.0 151.28 31.03 Favored 'General case' 0 C--N 1.348 0.508 0 C-N-CA 118.697 -1.201 . . . . 0.0 108.562 170.291 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.04 -28.78 69.31 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 114.534 -1.212 . . . . 0.0 113.924 -168.912 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -171.7 161.66 6.09 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.644 2.378 . . . . 0.0 111.169 169.604 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.1 m -34.99 -32.73 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 131.024 3.729 . . . . 0.0 113.434 165.505 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -59.8 -56.0 27.3 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.895 1.678 . . . . 0.0 111.078 175.471 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -39.49 89.99 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 120.462 1.483 . . . . 0.0 110.977 176.827 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.7 -37.49 73.58 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-O 119.023 -0.513 . . . . 0.0 112.299 176.779 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -67.17 -45.79 75.96 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 119.433 1.015 . . . . 0.0 113.173 176.929 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.82 -42.94 80.74 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.44 1.018 . . . . 0.0 110.423 -177.229 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -61.83 -28.64 69.63 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 170.854 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.6 -30.18 76.86 Favored Glycine 0 CA--C 1.538 1.528 0 O-C-N 121.0 -1.062 . . . . 0.0 113.917 169.585 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.431 ' C ' ' H ' ' A' ' 90' ' ' VAL . 10.8 pt-20 -101.43 22.62 12.3 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 119.089 1.445 . . . . 0.0 111.698 166.551 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 19.4 tp 63.9 -40.88 0.23 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 131.005 3.722 . . . . 0.0 114.254 -171.694 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.431 ' H ' ' C ' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -170.8 -61.84 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 128.975 2.91 . . . . 0.0 108.481 -172.431 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 174.06 -35.06 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 126.347 1.859 . . . . 0.0 111.126 -173.371 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.1 p -73.48 26.33 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -171.39 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 62.87 25.27 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 125.107 1.363 . . . . 0.0 111.985 172.811 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.5 mp 90.95 95.44 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 131.573 3.949 . . . . 0.0 112.457 175.573 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.93 152.93 44.77 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 166.278 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.4 t -79.33 139.29 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.612 1.565 . . . . 0.0 112.504 -167.718 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -71.29 4.2 3.07 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 125.48 1.512 . . . . 0.0 114.514 174.55 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 26.0 p -72.14 111.62 7.52 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 120.88 -1.138 . . . . 0.0 108.218 168.872 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -76.16 113.11 13.33 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 174.35 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -129.97 154.61 81.22 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-O 117.606 -1.188 . . . . 0.0 107.817 179.773 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -67.37 -18.93 49.99 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.505 2.137 . . . . 0.0 114.19 179.365 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . 0.394 1.8 t . . . . . 0 CA--C 1.545 0.773 1 C-N-CA 134.117 4.967 . . . . 0.0 112.373 167.221 . . . . . . . . 2 1 . 1 . 029 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 pp . . . . . 0 N--CA 1.47 0.543 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.97 -14.29 62.64 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.213 1.005 . . . . 0.0 112.975 175.905 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 15.7 mmp_? -93.14 -33.56 13.99 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 120.764 -1.21 . . . . 0.0 112.22 169.473 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -57.3 -55.44 34.79 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.527 1.058 . . . . 0.0 109.317 169.725 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.56 -33.83 88.27 Favored Glycine 0 CA--C 1.53 0.996 0 CA-C-N 118.715 0.689 . . . . 0.0 112.311 -178.447 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -46.99 87.53 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 118.347 1.074 . . . . 0.0 110.207 171.33 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.67 -15.83 63.17 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.42 1.488 . . . . 0.0 113.506 -178.177 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.3 mp -102.71 -12.73 17.44 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.972 0.909 . . . . 0.0 112.586 169.272 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.45 -7.93 59.65 Favored 'General case' 0 CA--C 1.554 1.134 0 N-CA-C 116.985 2.217 . . . . 0.0 116.985 174.573 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.423 ' CG ' HH21 ' B' ' 23' ' ' ARG . 20.0 m-20 -73.0 161.72 78.04 Favored Pre-proline 0 CA--C 1.543 0.707 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -168.822 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -58.82 -70.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.868 1 C-N-CA 125.455 4.103 . . . . 0.0 111.518 168.465 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 24.6 m -75.68 -43.03 49.47 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 117.902 -1.047 . . . . 0.0 111.939 -179.506 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . 0.423 HH21 ' CG ' ' B' ' 20' ' ' ASP . 0.3 OUTLIER -64.29 -40.27 95.61 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 121.006 1.73 . . . . 0.0 115.211 -169.643 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 14.6 t -60.85 -45.06 96.0 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 120.153 1.342 . . . . 0.0 110.351 170.867 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 33.0 ttm-85 -62.49 -23.67 67.05 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.464 1.106 . . . . 0.0 113.556 175.364 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 mt -67.99 -57.13 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 120.156 1.344 . . . . 0.0 107.837 166.928 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 61.8 mt -55.6 -41.83 73.99 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 117.715 -1.136 . . . . 0.0 112.743 -174.367 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.1 m -61.35 -30.72 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-N 119.896 1.225 . . . . 0.0 112.65 176.652 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -95.62 -3.81 45.6 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.302 1.441 . . . . 0.0 112.525 -176.291 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.67 -23.01 20.88 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 175.945 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.14 -61.21 2.37 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 128.806 2.842 . . . . 0.0 110.167 170.574 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -91.66 7.83 39.71 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 126.593 1.957 . . . . 0.0 113.078 175.655 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.87 -85.9 1.17 Allowed Glycine 0 N--CA 1.47 0.909 0 C-N-CA 125.02 1.295 . . . . 0.0 114.179 -168.376 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 20.9 m 39.14 15.83 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 N-CA-C 120.95 3.685 . . . . 0.0 120.95 179.793 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 69.6 m -79.39 -91.45 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.465 1.03 . . . . 0.0 111.791 -178.12 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -137.88 161.56 59.27 Favored Pre-proline 0 CA--C 1.555 1.161 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -168.216 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -55.61 132.41 51.95 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 123.285 2.657 . . . . 0.0 110.396 174.943 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.05 -6.57 26.92 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 117.686 -1.619 . . . . 0.0 114.827 -179.341 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 2.6 pp0? -56.67 -36.14 69.23 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.686 1.743 . . . . 0.0 111.292 -179.689 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 8.7 mt -50.17 -32.84 17.24 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 125.103 1.361 . . . . 0.0 112.235 176.42 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.8 -53.16 58.85 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.496 0.589 . . . . 0.0 111.334 -177.751 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.5 -39.07 88.5 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.078 0.551 . . . . 0.0 112.083 175.797 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -63.23 -27.23 69.21 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.835 1.654 . . . . 0.0 113.708 179.175 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 18.0 mt -99.15 -21.48 16.12 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 126.144 1.778 . . . . 0.0 112.818 175.385 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.7 10.84 83.73 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 124.957 1.265 . . . . 0.0 113.737 -170.411 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 69.6 mt -105.87 168.87 8.83 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.381 1.473 . . . . 0.0 112.53 -170.727 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 47' ' ' THR . . . . . 0.498 HG21 ' H ' ' B' ' 50' ' ' ASN . 3.3 t -71.96 138.34 47.97 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 120.798 -1.188 . . . . 0.0 111.748 170.276 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 23.2 ptt180 -59.72 -17.39 34.35 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.165 1.386 . . . . 0.0 112.587 169.628 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 39.2 t -66.79 -58.13 5.66 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 119.91 1.232 . . . . 0.0 112.142 168.882 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . 0.498 ' H ' HG21 ' B' ' 47' ' ' THR . 35.0 t-20 -56.84 -51.71 67.95 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.501 1.521 . . . . 0.0 110.548 173.285 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 94.0 t -62.01 -37.65 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-O 118.305 -0.855 . . . . 0.0 112.02 -178.647 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 24.5 m -74.91 -35.49 62.22 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 120.89 1.677 . . . . 0.0 113.857 175.648 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -50.88 -45.28 59.95 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.127 0.876 . . . . 0.0 111.64 170.628 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -75.64 -19.82 58.92 Favored 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 174.673 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 28.5 mt -80.02 -20.68 44.79 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.501 1.5 . . . . 0.0 113.192 171.586 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 43.4 m -44.09 -55.86 4.44 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 120.161 1.346 . . . . 0.0 112.323 172.416 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.8 t -93.44 -10.79 33.88 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 179.28 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.4 tp -69.34 -34.62 74.9 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.446 -1.408 . . . . 0.0 109.621 168.645 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 74.7 mtm180 -80.77 -22.26 40.3 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.798 1.239 . . . . 0.0 112.683 169.72 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -69.79 -65.44 2.56 Favored Glycine 0 N--CA 1.472 1.092 0 C-N-CA 125.21 1.386 . . . . 0.0 111.571 175.7 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 56.3 m -67.23 5.12 0.77 Allowed 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 125.796 1.639 . . . . 0.0 114.338 175.23 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.07 6.53 79.64 Favored Glycine 0 C--N 1.343 0.961 0 O-C-N 120.85 -1.157 . . . . 0.0 114.188 172.57 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 98.4 mt -62.12 -31.41 71.86 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.748 1.219 . . . . 0.0 112.929 179.605 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 1.6 m -125.18 136.02 62.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 126.214 1.805 . . . . 0.0 112.333 170.99 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 47.3 t -119.11 137.98 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 127.357 2.263 . . . . 0.0 111.35 -171.242 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . 0.457 ' C ' ' HG1' ' B' ' 67' ' ' THR . . . -80.22 142.75 34.36 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.831 1.252 . . . . 0.0 112.613 173.463 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 67' ' ' THR . . . . . 0.457 ' HG1' ' C ' ' B' ' 66' ' ' ALA . 1.9 m -167.4 142.49 3.93 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 117.034 -1.46 . . . . 0.0 111.768 -173.993 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -74.72 121.03 21.07 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 121.31 1.868 . . . . 0.0 109.276 165.658 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.305 0.0 OUTLIER -68.24 -55.72 11.22 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 118.234 -0.888 . . . . 0.0 109.858 175.185 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -173.55 -32.7 0.03 OUTLIER Glycine 0 CA--C 1.535 1.287 0 C-N-CA 125.769 1.652 . . . . 0.0 113.984 169.171 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 29.2 tpt180 -114.0 -19.45 11.41 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.601 2.36 . . . . 0.0 113.413 176.729 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -149.55 164.9 33.8 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 128.468 2.707 . . . . 0.0 109.926 -170.821 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 4.2 p -79.32 147.15 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 121.22 -0.925 . . . . 0.0 109.845 168.672 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -128.68 160.96 30.83 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 127.043 2.137 . . . . 0.0 110.674 -176.18 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -111.39 121.4 45.13 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 106.873 -1.529 . . . . 0.0 106.873 167.069 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -123.42 154.65 38.75 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 117.156 -1.402 . . . . 0.0 111.243 174.741 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 mp -66.87 152.8 44.94 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 117.771 -1.572 . . . . 0.0 106.886 166.602 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.8 -24.05 67.56 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -170.401 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -173.66 161.34 3.91 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.931 1.692 . . . . 0.0 112.157 171.197 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -36.92 -34.55 0.08 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 130.504 3.521 . . . . 0.0 113.523 166.251 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 22.1 t60 -62.82 -52.44 63.14 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.707 1.203 . . . . 0.0 110.425 177.854 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -41.65 93.64 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 120.471 1.487 . . . . 0.0 111.076 175.206 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.26 -35.04 69.25 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 178.104 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 3.2 ptm85 -74.21 -39.1 63.36 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 177.566 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.15 -44.41 84.22 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.452 1.024 . . . . 0.0 110.058 176.144 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -54.33 -42.27 70.01 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.248 0.619 . . . . 0.0 111.597 169.76 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -60.83 -19.84 56.3 Favored Glycine 0 CA--C 1.541 1.683 0 C-N-CA 124.858 1.218 . . . . 0.0 115.184 177.037 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . 0.253 9.7 pt-20 -121.14 25.49 9.53 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.343 1.571 . . . . 0.0 112.626 165.961 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 58.0 tp 66.54 -49.3 0.45 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 131.229 3.812 . . . . 0.0 113.058 -173.363 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 33.5 t -153.48 -51.76 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 C-N-CA 128.649 2.78 . . . . 0.0 107.87 169.502 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 175.54 -22.06 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.992 1.317 . . . . 0.0 114.452 -160.619 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 8.4 p -74.49 26.64 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 O-C-N 120.247 -1.533 . . . . 0.0 113.508 -178.283 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 61.18 28.05 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.919 0 C-N-CA 124.346 1.058 . . . . 0.0 111.319 176.137 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.8 mp 75.13 111.35 0.07 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 130.247 3.419 . . . . 0.0 113.435 -171.902 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.075 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 163.307 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.0 tp . . . . . 0 CA--C 1.542 0.666 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -49.05 -39.09 26.14 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.17 1.788 . . . . 0.0 112.354 169.888 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -14.76 56.16 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 126.109 1.764 . . . . 0.0 112.845 -176.862 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -72.01 -58.01 3.8 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.782 0.833 . . . . 0.0 108.954 167.006 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -57.65 -32.46 65.28 Favored Glycine 0 C--N 1.337 0.622 0 CA-C-O 118.681 -1.066 . . . . 0.0 112.263 -169.789 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.42 -22.26 65.54 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.044 1.422 . . . . 0.0 111.552 177.267 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -80.78 -17.14 51.87 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.324 -1.485 . . . . 0.0 113.699 172.325 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.7 mp -103.34 -18.14 14.98 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.527 0.731 . . . . 0.0 112.224 172.425 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.77 15.63 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 129.366 3.066 . . . . 0.0 116.355 177.071 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.97 145.38 30.39 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 126.554 1.942 . . . . 0.0 109.418 -177.168 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -62.48 -84.96 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.68 1 C-N-CA 126.059 4.506 . . . . 0.0 112.309 -169.298 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 85.8 m -44.45 -40.72 5.73 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 126.203 1.801 . . . . 0.0 111.282 170.857 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.8 ttp180 -74.6 -32.65 62.42 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 116.249 1.944 . . . . 0.0 116.249 -168.667 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 50.5 t -63.37 -39.79 95.49 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 120.377 1.444 . . . . 0.0 109.616 168.287 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 39.2 mtt180 -65.17 -40.1 93.83 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.429 1.092 . . . . 0.0 111.459 176.63 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 8.7 mt -47.6 -56.45 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-N 119.623 1.101 . . . . 0.0 110.981 167.541 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 74.6 mt -60.04 -44.65 94.51 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.263 -1.335 . . . . 0.0 112.695 -178.222 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -66.09 -31.38 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 120.18 1.355 . . . . 0.0 113.251 174.456 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.78 7.34 21.01 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.789 2.035 . . . . 0.0 114.433 173.611 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.1 mt -101.44 -28.91 12.31 Favored 'General case' 0 N--CA 1.435 -1.177 0 C-N-CA 126.917 2.087 . . . . 0.0 113.054 167.374 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 mt -62.41 -42.14 99.21 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 124.435 1.085 . . . . 0.0 109.169 168.588 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -124.59 86.96 2.64 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.9 2.08 . . . . 0.0 110.91 169.91 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -171.34 -86.21 0.06 OUTLIER Glycine 0 N--CA 1.474 1.216 0 C-N-CA 127.263 2.363 . . . . 0.0 113.227 174.415 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 18.5 m 37.36 38.31 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 127.485 2.314 . . . . 0.0 116.79 -179.267 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 9.4 m -83.76 -79.53 0.2 Allowed 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 126.374 1.87 . . . . 0.0 110.568 -176.729 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -147.83 145.34 20.86 Favored Pre-proline 0 N--CA 1.475 0.784 0 C-N-CA 125.696 1.598 . . . . 0.0 110.209 -172.226 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.97 -10.34 22.55 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.023 2.482 . . . . 0.0 116.676 -169.138 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.65 -2.39 40.28 Favored Glycine 0 CA--C 1.539 1.562 0 CA-C-N 119.885 1.22 . . . . 0.0 114.871 169.219 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.461 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -60.46 -29.4 69.02 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.034 1.334 . . . . 0.0 113.292 -171.959 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 29.4 mt -49.97 -28.28 6.6 Favored 'General case' 0 C--O 1.218 -0.588 0 C-N-CA 125.878 1.671 . . . . 0.0 111.808 179.602 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -75.07 -32.95 61.61 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -173.616 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.89 -36.57 28.01 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.153 0.501 . . . . 0.0 110.697 169.037 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.461 ' CD2' HE22 ' A' ' 39' ' ' GLN . 11.3 t60 -73.39 -31.59 63.98 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 -174.131 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.8 mt -96.09 -19.43 19.42 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.692 1.597 . . . . 0.0 112.676 172.66 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.07 -5.12 20.53 Favored Glycine 0 CA--C 1.536 1.386 0 CA-C-O 118.832 -0.982 . . . . 0.0 113.594 -168.471 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -73.71 133.71 43.4 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.608 1.563 . . . . 0.0 109.891 175.578 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.4 t -60.83 146.02 47.81 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.646 1.112 . . . . 0.0 111.511 -177.283 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.0 -29.72 57.94 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 -174.659 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.2 m -63.86 -48.76 75.45 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.059 0.845 . . . . 0.0 112.374 170.408 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -64.37 -46.27 84.13 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.901 1.68 . . . . 0.0 110.968 178.039 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 1.2 t -56.66 -44.57 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 124.17 0.988 . . . . 0.0 111.905 170.181 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 97.2 p -67.62 -38.38 83.83 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.725 1.148 . . . . 0.0 113.971 179.423 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -56.94 -52.19 66.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.748 1.219 . . . . 0.0 109.839 174.976 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -72.15 -27.59 62.69 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 120.825 -1.172 . . . . 0.0 113.983 177.464 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 34.6 mt -67.85 -33.13 74.17 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 121.473 1.942 . . . . 0.0 112.566 169.59 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.7 m -59.51 -34.59 72.8 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.404 0.682 . . . . 0.0 112.006 -177.939 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 34.1 t -75.87 -43.07 47.33 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.673 -0.642 . . . . 0.0 111.912 173.624 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.3 tp -71.32 -39.4 71.43 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.589 1.556 . . . . 0.0 112.848 -169.243 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -74.09 -7.86 54.05 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.605 1.162 . . . . 0.0 111.766 173.186 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -100.05 -40.39 3.08 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.749 1.642 . . . . 0.0 113.452 172.997 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.3 m -75.35 1.11 14.64 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.043 1.737 . . . . 0.0 112.688 170.661 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.24 2.92 80.78 Favored Glycine 0 N--CA 1.467 0.709 0 C-N-CA 127.42 2.438 . . . . 0.0 116.494 166.778 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 76.5 mt -71.43 -20.04 62.16 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.623 1.712 . . . . 0.0 113.893 -175.001 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 6.3 m -126.97 140.35 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.226 1.411 . . . . 0.0 113.791 -178.559 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.1 t -141.33 142.24 29.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.974 -170.821 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.14 148.02 23.24 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.357 1.463 . . . . 0.0 113.582 171.833 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -135.49 178.6 6.91 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.124 1.769 . . . . 0.0 106.964 167.923 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -96.11 128.79 43.34 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 166.368 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -19.43 60.06 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.25 1.02 . . . . 0.0 112.492 168.948 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 128.16 -40.95 1.65 Allowed Glycine 0 N--CA 1.471 1.002 0 C-N-CA 125.526 1.536 . . . . 0.0 112.381 172.85 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -91.94 -38.1 12.47 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.599 1.959 . . . . 0.0 110.733 171.819 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.23 -175.84 4.59 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.945 2.098 . . . . 0.0 110.693 177.793 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.6 151.42 5.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 C-N-CA 123.481 0.712 . . . . 0.0 109.838 168.013 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -120.91 -173.31 2.57 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 126.918 2.087 . . . . 0.0 108.861 167.234 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -145.07 161.29 39.81 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.65 1.18 . . . . 0.0 108.122 -179.393 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -166.9 159.49 13.54 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 120.669 1.577 . . . . 0.0 112.887 -168.957 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -60.7 137.11 58.22 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 165.668 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.32 -23.38 66.73 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.785 1.402 . . . . 0.0 114.785 -173.8 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -159.23 161.72 36.09 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.267 1.027 . . . . 0.0 113.17 168.722 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 54.6 p -42.91 -35.33 1.17 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.572 1.949 . . . . 0.0 112.76 166.877 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -48.81 77.68 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.581 1.552 . . . . 0.0 112.764 177.661 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.7 mt -69.65 -47.24 64.03 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.75 1.159 . . . . 0.0 109.003 179.226 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.03 -16.82 3.12 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.853 1.661 . . . . 0.0 114.552 172.437 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -79.23 -67.05 0.79 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.821 1.248 . . . . 0.0 109.996 176.373 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.72 -32.49 72.72 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 178.941 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 tp -68.17 -32.61 72.98 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.766 1.627 . . . . 0.0 111.441 169.662 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.17 -36.52 9.87 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 127.273 2.368 . . . . 0.0 115.632 -172.02 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.83 -9.76 58.86 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 119.75 1.775 . . . . 0.0 112.853 169.17 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.428 ' C ' ' H ' ' A' ' 91' ' ' GLN . 6.2 tt 67.87 142.31 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 127.002 2.121 . . . . 0.0 108.031 -170.906 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 33.9 m -69.71 19.41 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 O-C-N 120.328 -1.483 . . . . 0.0 114.091 -175.107 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.428 ' H ' ' C ' ' A' ' 89' ' ' LEU . 47.3 mm-40 77.08 -13.88 0.9 Allowed 'General case' 0 N--CA 1.447 -0.598 0 O-C-N 120.685 -1.26 . . . . 0.0 113.707 156.519 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.2 p -68.38 35.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 126.966 2.106 . . . . 0.0 115.605 -177.105 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.3 t 69.07 4.76 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 125.941 1.696 . . . . 0.0 112.529 173.055 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.8 mp 97.34 105.49 0.01 OUTLIER 'General case' 0 C--N 1.348 0.521 0 C-N-CA 131.302 3.841 . . . . 0.0 110.259 -170.447 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.76 66.05 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 126.962 2.105 . . . . 0.0 114.459 176.462 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.1 m -52.49 138.19 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 O-C-N 121.568 -0.707 . . . . 0.0 110.412 168.563 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -59.35 -30.99 68.79 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.396 0.678 . . . . 0.0 112.44 -168.449 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.1 m 70.61 151.46 0.1 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 128.315 2.646 . . . . 0.0 111.633 178.524 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -87.36 1.34 53.6 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.859 1.664 . . . . 0.0 114.151 175.261 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.2 146.91 35.77 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 115.073 1.509 . . . . 0.0 115.073 -166.998 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -94.48 17.96 0.86 Allowed 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 124.029 3.153 . . . . 0.0 114.438 -178.325 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.5 t . . . . . 0 CA--C 1.547 0.85 0 CA-C-O 124.65 2.167 . . . . 0.0 113.893 -177.871 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.538 0.517 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.526 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.51 -45.88 63.03 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.009 0.924 . . . . 0.0 111.533 167.701 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -30.24 67.14 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.226 1.81 . . . . 0.0 111.934 175.442 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -81.39 -46.71 14.24 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.056 -1.027 . . . . 0.0 111.358 172.619 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.59 -32.3 68.82 Favored Glycine 0 C--O 1.219 -0.83 0 C-N-CA 124.493 1.044 . . . . 0.0 111.803 -178.165 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.6 -32.28 72.05 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.001 1.401 . . . . 0.0 111.171 173.739 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -80.63 -20.58 42.84 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 176.189 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.5 mp -101.78 -23.04 14.25 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 118.951 0.796 . . . . 0.0 112.761 175.198 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -83.64 37.76 0.6 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.372 1.469 . . . . 0.0 114.877 178.132 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.94 142.39 24.53 Favored Pre-proline 0 CA--C 1.55 0.947 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 168.181 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -59.0 -85.38 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.785 1 C-N-CA 125.793 4.329 . . . . 0.0 112.676 -167.482 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 58.9 m -49.58 -33.93 16.38 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 126.357 1.863 . . . . 0.0 112.507 170.09 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 18.2 ttp180 -72.08 -38.87 69.33 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -170.824 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 37.1 t -56.93 -39.95 75.46 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.249 0.931 . . . . 0.0 110.369 168.709 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 16.1 mtt-85 -64.59 -38.92 92.65 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-O 118.485 -0.769 . . . . 0.0 113.061 175.161 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 3.0 mt -52.09 -49.61 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 CA-C-N 120.069 1.304 . . . . 0.0 111.835 169.426 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 92.6 mt -65.4 -47.12 77.4 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.939 -178.242 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.24 -33.85 65.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 118.911 0.778 . . . . 0.0 112.562 178.099 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.1 -9.25 59.07 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.84 1.256 . . . . 0.0 113.419 174.265 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 5.6 mt -82.9 -37.96 23.52 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 117.361 -1.304 . . . . 0.0 112.353 167.079 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.2 mt -55.82 -46.22 78.14 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 125.195 1.56 . . . . 0.0 110.754 175.498 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -107.03 46.41 0.93 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 129.037 2.935 . . . . 0.0 110.453 177.762 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -150.9 -84.29 0.05 OUTLIER Glycine 0 N--CA 1.47 0.952 0 N-CA-C 116.996 1.559 . . . . 0.0 116.996 -176.261 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 34.9 m 49.57 -12.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 C-N-CA 129.175 2.99 . . . . 0.0 118.849 -168.348 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 51.9 m -37.01 -82.23 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 127.016 2.126 . . . . 0.0 116.368 -167.368 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -149.64 143.88 17.23 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 126.364 1.865 . . . . 0.0 109.809 -174.656 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -65.7 -7.18 15.69 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 124.07 3.18 . . . . 0.0 116.88 -168.686 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.9 -14.3 21.42 Favored Glycine 0 CA--C 1.536 1.366 0 CA-C-N 120.078 1.308 . . . . 0.0 115.161 171.053 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -69.92 -19.85 63.38 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.146 1.535 . . . . 0.0 115.146 -169.072 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 20.7 mt -44.51 -32.28 1.36 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.019 1.328 . . . . 0.0 112.333 175.928 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.16 -40.41 77.2 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -178.078 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.72 -43.38 37.68 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.141 0.496 . . . . 0.0 110.92 174.747 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -64.78 -24.09 67.45 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.79 1.236 . . . . 0.0 113.792 -177.011 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 20.4 mt -109.39 -18.12 13.63 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.224 1.809 . . . . 0.0 113.799 179.043 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.48 -9.59 54.35 Favored Glycine 0 CA--C 1.536 1.346 0 CA-C-O 118.383 -1.232 . . . . 0.0 114.487 -169.941 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.04 131.94 45.11 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.889 2.076 . . . . 0.0 111.786 177.541 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 6.1 t -59.81 140.49 56.53 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 119.985 -1.697 . . . . 0.0 109.242 168.935 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.58 -21.0 59.7 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -174.497 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 5.7 m -64.44 -48.55 74.9 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.946 1.248 . . . . 0.0 111.272 169.488 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -70.46 -38.9 74.53 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.538 -0.726 . . . . 0.0 111.23 176.248 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -62.15 -35.87 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 O-C-N 120.877 -1.139 . . . . 0.0 111.978 172.352 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 96.2 p -67.91 -30.22 69.49 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 120.038 1.29 . . . . 0.0 114.404 175.661 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 55.5 t-20 -60.3 -59.87 4.72 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.678 0.791 . . . . 0.0 110.589 178.94 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -67.94 -19.37 64.97 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 176.511 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 40.0 mt -73.78 -29.24 62.08 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 121.377 1.899 . . . . 0.0 112.493 169.493 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 45.4 m -61.88 -29.18 70.02 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.429 0.559 . . . . 0.0 111.807 175.942 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.4 t -80.37 -50.72 9.76 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 118.881 0.764 . . . . 0.0 111.388 169.163 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.7 tp -58.12 -41.05 82.8 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.099 0.96 . . . . 0.0 113.016 -172.642 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 82.8 mtt180 -82.34 -6.42 59.25 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.545 1.538 . . . . 0.0 113.167 179.353 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -97.74 -43.96 2.78 Favored Glycine 0 N--CA 1.472 1.04 0 C-N-CA 124.758 1.171 . . . . 0.0 111.666 172.086 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 80.8 m -75.87 9.03 2.6 Favored 'General case' 0 CA--C 1.557 1.212 0 C-N-CA 127.463 2.305 . . . . 0.0 113.849 177.329 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.19 11.34 81.9 Favored Glycine 0 N--CA 1.471 1.022 0 C-N-CA 128.242 2.829 . . . . 0.0 117.216 167.493 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 95.5 mt -80.82 -21.88 40.47 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 118.799 1.3 . . . . 0.0 114.105 -173.846 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 5.2 m -137.63 149.51 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 125.303 1.441 . . . . 0.0 113.915 -174.601 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 77.3 t -145.01 147.17 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -176.996 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.72 147.98 28.96 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 127.737 2.415 . . . . 0.0 112.065 169.8 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -136.78 170.61 15.8 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.379 1.872 . . . . 0.0 107.395 175.658 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -81.41 133.0 35.35 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 162.929 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.52 -9.1 58.64 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 119.279 0.945 . . . . 0.0 112.842 167.985 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 126.29 -15.55 6.81 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 126.224 1.869 . . . . 0.0 113.754 173.452 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.48 -40.57 0.51 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.042 2.137 . . . . 0.0 110.616 -172.887 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -127.64 177.45 6.78 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 128.468 2.707 . . . . 0.0 108.063 167.738 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 2.3 m -86.48 143.55 11.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 123.152 0.581 . . . . 0.0 109.609 165.731 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 12.3 ptt180 -106.17 -176.44 3.08 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 127.127 2.171 . . . . 0.0 108.64 172.202 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . 0.254 0.2 OUTLIER -143.76 171.54 14.07 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 124.709 1.204 . . . . 0.0 109.696 171.618 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -174.27 159.36 3.12 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.622 1.569 . . . . 0.0 111.687 -169.38 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -60.51 142.22 55.54 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 164.864 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.43 -23.26 65.7 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -174.841 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -157.56 159.36 37.04 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 168.366 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 56.6 p -44.25 -34.93 2.06 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 113.683 -1.598 . . . . 0.0 112.002 165.295 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.93 -45.65 93.85 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.582 1.553 . . . . 0.0 111.915 -179.489 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 9.0 mt -69.06 -45.64 69.88 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.447 1.021 . . . . 0.0 109.53 174.684 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.63 -20.73 50.22 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.965 1.306 . . . . 0.0 113.797 178.008 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -75.11 -66.52 0.75 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.591 1.556 . . . . 0.0 110.404 177.518 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.33 -36.26 79.65 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.022 0.828 . . . . 0.0 113.208 178.632 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 49.8 tp -61.89 -38.07 86.97 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.724 1.21 . . . . 0.0 111.13 169.494 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -78.97 -42.69 11.98 Favored Glycine 0 C--N 1.341 0.815 0 C-N-CA 127.509 2.481 . . . . 0.0 114.968 -171.754 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.22 -12.02 60.98 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.142 1.471 . . . . 0.0 112.484 168.843 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 89' ' ' LEU . . . . . 0.418 ' C ' ' H ' ' B' ' 91' ' ' GLN . 9.7 tt 72.22 142.41 0.06 Allowed 'General case' 0 C--N 1.342 0.279 0 C-N-CA 127.554 2.341 . . . . 0.0 108.849 175.539 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 33.7 m -60.4 12.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 116.819 2.155 . . . . 0.0 116.819 -173.489 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 91' ' ' GLN . . . . . 0.418 ' H ' ' C ' ' B' ' 89' ' ' LEU . 26.0 mm-40 78.43 -18.79 0.48 Allowed 'General case' 0 CA--C 1.535 0.367 0 O-C-N 120.347 -1.47 . . . . 0.0 114.281 155.865 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 2.8 p -66.8 32.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 126.795 2.038 . . . . 0.0 115.132 177.517 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 61.77 10.95 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 C-N-CA 125.645 1.578 . . . . 0.0 113.509 -179.686 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 10.1 mp 86.04 115.67 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 131.35 3.86 . . . . 0.0 109.709 -168.58 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.785 0 CA-C-O 121.475 0.655 . . . . 0.0 110.688 167.172 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.44 -6.39 55.17 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -175.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.404 HH11 ' CB ' ' B' ' 102' ' ' CYS . 5.6 mmp_? -90.47 -50.57 5.87 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.704 1.202 . . . . 0.0 108.96 167.031 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -44.01 -71.86 0.07 Allowed 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 127.87 2.468 . . . . 0.0 109.981 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -83.09 -8.19 85.95 Favored Glycine 0 CA--C 1.526 0.744 0 C-N-CA 119.112 -1.518 . . . . 0.0 115.259 -168.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.36 -45.66 53.68 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.482 1.641 . . . . 0.0 108.245 168.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.24 -23.4 57.52 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 118.084 -0.96 . . . . 0.0 112.804 174.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.8 tp -80.71 -34.89 34.21 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.508 1.049 . . . . 0.0 112.249 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -104.7 71.3 0.97 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 122.256 1.027 . . . . 0.0 110.463 169.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -132.59 143.17 47.6 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.93 1.292 . . . . 0.0 110.284 171.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -41.06 -68.21 0.1 Allowed 'Trans proline' 0 C--N 1.356 0.969 1 C-N-CA 127.012 5.141 . . . . 0.0 113.75 -173.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.449 ' HG1' ' CE1' ' A' ' 54' ' ' HIS . 0.7 OUTLIER -82.23 -32.86 29.53 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 116.896 -1.525 . . . . 0.0 110.801 -175.487 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.7 mtm180 -67.72 -41.48 83.46 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 116.256 -1.831 . . . . 0.0 113.893 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 38.7 t -55.52 -42.72 74.92 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 121.658 2.026 . . . . 0.0 110.545 170.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.89 -45.18 94.87 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.156 0.982 . . . . 0.0 113.184 175.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.6 mt -53.69 -56.55 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 124.395 1.078 . . . . 0.0 110.366 171.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 90.1 mt -61.66 -40.76 96.07 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.835 0.854 . . . . 0.0 111.713 -169.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.6 p -73.99 -30.3 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 175.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.21 -23.89 47.29 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.053 0.941 . . . . 0.0 113.522 174.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 tp -63.35 -44.26 95.34 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 121.09 -1.006 . . . . 0.0 110.987 173.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -47.86 -49.06 30.64 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 128.396 2.678 . . . . 0.0 112.226 177.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -93.6 14.6 18.42 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 127.444 2.298 . . . . 0.0 112.619 -179.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -134.95 -85.82 0.22 Allowed Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.568 1.556 . . . . 0.0 114.442 -175.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 27.8 m 41.38 30.28 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 126.771 2.029 . . . . 0.0 115.388 -168.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 2.3 m -80.39 -86.53 0.08 Allowed 'General case' 0 C--O 1.224 -0.266 0 O-C-N 121.822 -0.549 . . . . 0.0 110.654 -178.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -135.43 161.97 60.09 Favored Pre-proline 0 CA--C 1.538 0.5 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -169.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -54.07 124.15 15.24 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.377 2.718 . . . . 0.0 110.476 174.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.37 3.3 88.58 Favored Glycine 0 CA--C 1.528 0.882 0 CA-C-O 117.25 -1.861 . . . . 0.0 114.815 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.49 -30.58 70.7 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 121.012 2.406 . . . . 0.0 111.276 169.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.5 mt -53.7 -20.13 5.02 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 124.984 1.314 . . . . 0.0 112.674 172.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.29 -34.78 75.77 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.825 0.739 . . . . 0.0 111.319 176.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.43 -45.64 53.26 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.065 0.546 . . . . 0.0 111.159 175.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -60.17 -32.41 71.04 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 177.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 35.7 mt -103.3 -20.16 14.21 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -174.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.71 7.07 68.55 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.027 0.823 . . . . 0.0 113.905 -169.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.6 mt -108.69 150.48 27.5 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.945 1.298 . . . . 0.0 110.959 -174.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.0 p -60.87 145.74 49.03 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.315 0.578 . . . . 0.0 111.667 -169.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 40.5 ptt180 -59.54 -32.88 70.73 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 -177.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.4 m -64.6 -54.82 26.01 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.553 0.741 . . . . 0.0 111.29 169.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 55.9 t-20 -55.75 -54.1 48.58 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.794 1.238 . . . . 0.0 111.177 -178.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 97.4 t -58.38 -40.11 76.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 O-C-N 121.457 -0.777 . . . . 0.0 111.8 176.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 47.2 m -71.4 -28.65 64.16 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 114.217 1.191 . . . . 0.0 114.217 -177.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -49.27 -46.91 46.93 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.004 1.322 . . . . 0.0 111.59 173.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.449 ' CE1' ' HG1' ' A' ' 22' ' ' THR . 3.9 m80 -65.28 -27.05 68.36 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 178.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 60.3 mt -67.52 -31.03 70.86 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 118.833 0.742 . . . . 0.0 111.118 176.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 68.7 m -62.94 -8.07 6.45 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 174.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.2 t -99.16 -46.76 5.45 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 118.942 0.792 . . . . 0.0 111.514 164.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.4 tp -58.26 -36.08 72.71 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.178 2.591 . . . . 0.0 113.515 -168.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 80.2 mtm-85 -68.18 -41.71 81.04 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.626 0.771 . . . . 0.0 110.867 175.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -73.19 -36.66 55.89 Favored Glycine 0 N--CA 1.472 1.05 0 C-N-CA 124.094 0.854 . . . . 0.0 111.498 -177.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 27.4 m -67.26 -2.89 6.58 Favored 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 125.889 1.676 . . . . 0.0 113.398 168.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.22 -4.92 65.02 Favored Glycine 0 N--CA 1.47 0.929 0 C-N-CA 127.06 2.267 . . . . 0.0 114.829 174.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 73.5 mt -73.88 -20.71 60.33 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -169.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.6 m -134.21 144.99 33.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 C-N-CA 125.194 1.398 . . . . 0.0 111.941 177.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.4 t -127.23 138.43 54.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 125.161 1.384 . . . . 0.0 109.72 176.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.51 136.08 33.29 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.822 0.849 . . . . 0.0 111.003 173.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.98 179.79 5.38 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.938 2.095 . . . . 0.0 108.133 -175.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -119.26 147.83 43.82 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.945 1.698 . . . . 0.0 108.371 165.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.27 1.3 pp20? -119.66 -148.93 0.42 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.694 1.198 . . . . 0.0 111.578 176.154 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -70.38 -18.36 75.16 Favored Glycine 0 CA--C 1.535 1.341 0 CA-C-N 121.52 1.964 . . . . 0.0 115.251 -175.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.5 mmt180 -148.68 -17.82 0.32 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.538 1.681 . . . . 0.0 115.538 -177.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.55 -179.83 7.15 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 122.221 2.282 . . . . 0.0 112.335 -178.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 29.7 m -84.31 149.17 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.403 1.081 . . . . 0.0 111.253 172.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.1 ptt180 -126.67 170.93 11.6 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.782 1.233 . . . . 0.0 110.299 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -127.3 125.28 40.57 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.743 1.217 . . . . 0.0 109.611 169.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -128.73 153.81 46.99 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.547 1.539 . . . . 0.0 111.638 -177.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 82.8 mt -58.4 151.69 19.38 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 122.83 0.452 . . . . 0.0 109.858 170.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -49.03 -41.87 36.32 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.006 1.322 . . . . 0.0 114.031 -172.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -170.57 166.43 8.22 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 127.412 2.285 . . . . 0.0 109.135 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.1 m -36.24 -37.98 0.13 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 129.687 3.195 . . . . 0.0 112.297 165.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -44.19 -60.1 2.05 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 127.343 2.257 . . . . 0.0 113.394 171.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 13.4 mt -76.51 -34.98 58.58 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.255 0.934 . . . . 0.0 110.607 -177.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.17 -32.38 72.12 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 118.826 0.739 . . . . 0.0 112.733 176.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -77.47 -59.54 2.74 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.0 0.92 . . . . 0.0 110.941 176.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.85 -34.56 76.19 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tt -66.51 -46.44 76.23 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.238 -0.914 . . . . 0.0 108.858 168.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.02 -11.0 69.53 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 127.165 2.317 . . . . 0.0 117.078 -176.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -71.08 -40.03 71.81 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-N 121.728 2.764 . . . . 0.0 108.079 165.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.465 ' C ' ' H ' ' A' ' 91' ' ' GLN . 46.4 tp 90.91 112.62 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 131.628 3.971 . . . . 0.0 106.827 -167.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.5 m -39.31 -3.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 130.404 3.482 . . . . 0.0 117.925 169.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.465 ' H ' ' C ' ' A' ' 89' ' ' LEU . 1.4 mm-40 78.57 -28.79 0.15 Allowed 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 128.696 2.798 . . . . 0.0 112.814 164.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 8.0 p -59.18 35.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 C-N-CA 129.484 3.114 . . . . 0.0 115.697 173.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.411 ' H ' ' C ' ' A' ' 91' ' ' GLN . 2.0 t 73.84 5.06 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.891 0 C-N-CA 128.436 2.694 . . . . 0.0 112.025 169.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 85.1 104.52 0.05 OUTLIER 'General case' 0 C--N 1.346 0.439 0 C-N-CA 130.578 3.551 . . . . 0.0 106.226 -169.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.99 122.37 14.14 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.644 -0.66 . . . . 0.0 110.947 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.4 t -129.86 157.5 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 126.699 2.0 . . . . 0.0 106.688 168.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -54.52 123.6 13.58 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.724 0.809 . . . . 0.0 110.455 168.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -151.11 145.26 25.34 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.601 1.56 . . . . 0.0 108.728 -169.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -85.91 67.2 9.94 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.303 1.441 . . . . 0.0 110.529 -171.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -120.8 136.69 25.67 Favored Pre-proline 0 CA--C 1.551 1.012 0 O-C-N 121.195 -0.94 . . . . 0.0 111.171 176.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -85.63 -166.59 0.34 Allowed 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 124.755 3.637 . . . . 0.0 114.877 -166.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 8.6 t -126.68 -176.79 3.79 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 126.32 1.848 . . . . 0.0 112.307 173.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 13.6 t 69.42 127.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 128.814 2.846 . . . . 0.0 112.374 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.22 147.28 53.56 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.075 1.35 . . . . 0.0 112.67 176.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 59.43 19.76 8.1 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 124.263 1.025 . . . . 0.0 113.66 177.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.471 0.596 0 C-N-CA 125.47 1.508 . . . . 0.0 112.325 -169.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.423 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.0 tt -44.69 -52.25 8.46 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.612 1.565 . . . . 0.0 113.006 -176.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.14 1.5 18.06 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.219 1.562 . . . . 0.0 115.219 -177.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -107.08 -54.02 2.53 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.795 2.038 . . . . 0.0 110.138 168.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -43.3 -56.67 3.39 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 127.513 2.325 . . . . 0.0 110.41 174.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.66 -35.08 62.58 Favored Glycine 0 C--N 1.339 0.706 0 C-N-CA 120.357 -0.925 . . . . 0.0 113.64 -172.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.31 -38.01 71.75 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.363 1.082 . . . . 0.0 109.912 -179.04 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.51 -32.53 58.35 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 117.192 -1.385 . . . . 0.0 113.221 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.8 mp -81.14 -37.07 29.43 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 120.886 1.676 . . . . 0.0 112.435 178.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -90.95 70.55 6.42 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.532 1.06 . . . . 0.0 111.858 173.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -146.06 141.29 16.41 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 125.702 1.601 . . . . 0.0 110.49 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -45.43 -62.56 0.43 Allowed 'Trans proline' 0 C--N 1.357 0.979 1 C-N-CA 126.574 4.849 . . . . 0.0 113.053 -173.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.487 ' HG1' ' CD2' ' B' ' 54' ' ' HIS . 1.2 p -84.01 -38.83 20.41 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-O 116.813 -1.565 . . . . 0.0 110.714 -175.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 25.1 mtm180 -67.51 -36.35 80.87 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 121.195 1.816 . . . . 0.0 114.02 -175.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 43.5 t -56.34 -47.44 78.81 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 121.073 1.761 . . . . 0.0 109.784 169.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.1 -36.31 81.34 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.054 1.341 . . . . 0.0 113.249 177.264 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 3.2 mt -60.41 -61.93 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.109 0.964 . . . . 0.0 109.565 171.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 90.8 mt -56.95 -43.58 81.69 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 124.318 1.012 . . . . 0.0 111.168 -169.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 6.3 p -69.51 -31.52 49.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.34 -16.65 48.49 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.163 0.892 . . . . 0.0 113.27 175.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 3.5 tp -71.8 -37.72 70.35 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.223 -0.923 . . . . 0.0 112.288 172.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -45.8 -47.97 15.65 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.254 2.222 . . . . 0.0 111.65 170.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -100.17 22.39 11.49 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 127.23 2.212 . . . . 0.0 112.704 176.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -128.81 -95.1 0.8 Allowed Glycine 0 N--CA 1.476 1.305 0 C-N-CA 126.0 1.762 . . . . 0.0 114.67 -173.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 32.9 m 39.16 35.39 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 128.095 2.558 . . . . 0.0 116.64 -169.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 88.9 m -82.18 -106.8 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 122.91 0.484 . . . . 0.0 111.07 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -125.54 165.57 25.88 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 -169.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -55.47 124.25 15.82 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 122.557 2.171 . . . . 0.0 110.684 177.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.15 -1.34 88.85 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 117.82 -1.545 . . . . 0.0 115.267 -175.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -26.09 64.55 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 121.054 2.427 . . . . 0.0 113.663 177.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 10.3 mt -64.94 -18.61 65.39 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 123.752 0.821 . . . . 0.0 111.735 177.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.7 -36.98 72.7 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.86 0.754 . . . . 0.0 112.188 174.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.82 -41.43 68.21 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.838 0.745 . . . . 0.0 111.234 174.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -64.26 -33.21 75.3 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 177.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 38.5 mt -104.7 -21.15 13.43 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -172.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.29 -1.48 42.16 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 124.959 1.266 . . . . 0.0 113.944 -169.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 86.8 mt -93.73 153.25 18.43 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.28 1.432 . . . . 0.0 110.552 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 29.9 p -63.75 150.65 44.07 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 121.214 -0.929 . . . . 0.0 111.924 -169.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 40.9 ptt180 -59.43 -24.77 63.78 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 175.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 4.4 m -68.51 -59.8 2.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.52 1.528 . . . . 0.0 110.463 168.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -48.51 -56.76 7.44 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.359 1.864 . . . . 0.0 111.363 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 24.5 t -67.07 -35.31 74.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 O-C-N 121.085 -1.009 . . . . 0.0 112.732 -174.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 52.8 m -68.74 -28.83 67.17 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 34.5 t-20 -51.14 -51.41 53.85 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.855 1.262 . . . . 0.0 111.222 172.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . 0.487 ' CD2' ' HG1' ' B' ' 22' ' ' THR . 1.4 m80 -68.07 -28.43 67.35 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.963 -1.086 . . . . 0.0 113.086 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 92.9 mt -65.04 -30.21 71.17 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.646 -0.659 . . . . 0.0 111.236 173.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 66.3 m -67.63 -7.13 24.04 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 53.3 t -95.71 -44.18 7.56 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.672 0.789 . . . . 0.0 110.544 164.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 7.7 tp -64.14 -37.83 88.85 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 127.621 2.368 . . . . 0.0 113.179 -168.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 75.9 mtm-85 -70.93 -22.43 62.24 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.13 0.572 . . . . 0.0 112.001 174.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -86.55 -37.95 8.5 Favored Glycine 0 N--CA 1.473 1.164 0 C-N-CA 124.86 1.219 . . . . 0.0 111.423 178.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 48.2 m -68.26 -4.21 13.44 Favored 'General case' 0 CA--C 1.56 1.348 0 C-N-CA 125.906 1.683 . . . . 0.0 112.032 168.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.23 -22.75 6.77 Favored Glycine 0 N--CA 1.47 0.955 0 C-N-CA 128.479 2.942 . . . . 0.0 114.868 177.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 89.8 mt -52.59 -22.16 4.68 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 129.285 3.034 . . . . 0.0 116.235 -168.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.95 138.42 54.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 125.02 1.328 . . . . 0.0 109.648 172.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 41.4 t -114.27 122.56 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 125.073 1.349 . . . . 0.0 108.812 178.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -88.41 119.29 28.71 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.609 1.164 . . . . 0.0 109.7 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.7 -177.17 3.66 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 127.059 2.144 . . . . 0.0 109.711 -167.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -123.08 142.59 50.71 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.699 2.0 . . . . 0.0 108.784 166.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -113.25 -149.37 0.45 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.442 1.497 . . . . 0.0 111.813 176.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -71.21 -19.92 77.71 Favored Glycine 0 CA--C 1.535 1.342 0 O-C-N 119.801 -1.812 . . . . 0.0 114.81 -173.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 36.8 mmt180 -144.81 -18.6 0.52 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.547 1.539 . . . . 0.0 115.087 -177.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.47 -179.17 7.0 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 121.704 2.047 . . . . 0.0 113.174 -175.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 18.6 m -87.25 150.94 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 124.553 1.141 . . . . 0.0 111.345 177.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 15.1 ptt180 -135.85 169.75 17.08 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.995 0.918 . . . . 0.0 110.761 -174.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 40.0 m-85 -123.64 113.89 19.27 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 168.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -109.29 156.06 20.41 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.727 1.211 . . . . 0.0 111.161 177.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 82.8 mt -59.17 150.02 26.56 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.754 0.707 . . . . 0.0 109.499 169.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -51.57 -35.55 41.64 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.393 1.077 . . . . 0.0 113.818 -171.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -173.31 168.69 4.61 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.882 2.473 . . . . 0.0 109.176 175.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -34.07 -35.6 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 129.655 3.182 . . . . 0.0 112.307 164.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -37.64 -67.41 0.19 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 127.703 2.401 . . . . 0.0 113.518 169.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 16.6 mt -77.24 -35.61 55.26 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 118.975 -0.536 . . . . 0.0 109.766 -174.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.92 -30.79 66.2 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.8 -60.05 2.3 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.362 -0.836 . . . . 0.0 111.112 175.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.91 -29.17 70.03 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -176.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.63 -32.21 47.3 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 120.78 -1.2 . . . . 0.0 111.433 169.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.27 -18.76 79.86 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 126.525 2.012 . . . . 0.0 115.367 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.58 -32.73 64.28 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 120.688 2.244 . . . . 0.0 108.99 165.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . 0.476 ' C ' ' H ' ' B' ' 91' ' ' GLN . 39.7 tp 77.28 127.09 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 130.652 3.581 . . . . 0.0 108.388 -169.11 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 12.8 m -44.03 -7.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 127.993 2.517 . . . . 0.0 116.734 169.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.476 ' H ' ' C ' ' B' ' 89' ' ' LEU . 4.5 mm-40 73.63 -21.1 0.27 Allowed 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 127.215 2.206 . . . . 0.0 114.054 165.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 5.9 p -60.48 41.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 129.881 3.272 . . . . 0.0 114.792 171.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER 67.64 -0.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 C-N-CA 128.708 2.803 . . . . 0.0 113.633 177.461 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.0 tt 89.49 105.7 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 130.394 3.478 . . . . 0.0 105.431 -168.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.23 118.03 5.44 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 122.794 0.438 . . . . 0.0 111.063 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 1.9 t -119.74 158.38 21.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 125.499 1.519 . . . . 0.0 108.525 169.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -56.9 138.54 53.64 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 166.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.83 150.27 13.42 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.178 -0.951 . . . . 0.0 109.029 -174.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -84.84 74.28 10.51 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.583 0.753 . . . . 0.0 110.498 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -119.09 142.33 31.93 Favored Pre-proline 0 CA--C 1.542 0.667 0 O-C-N 121.668 -0.645 . . . . 0.0 110.426 169.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -81.97 -171.07 1.09 Allowed 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 124.478 3.452 . . . . 0.0 112.959 -168.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . 0.404 ' CB ' HH11 ' A' ' 13' ' ' ARG . 8.5 t -127.83 177.26 6.95 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.824 1.25 . . . . 0.0 111.096 168.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 6.5 t 66.82 133.44 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 127.976 2.51 . . . . 0.0 110.758 -170.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.85 154.07 23.02 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.703 1.601 . . . . 0.0 112.351 172.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 54.0 22.76 3.59 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 125.081 1.352 . . . . 0.0 113.75 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.47 0.553 0 O-C-N 120.475 -1.391 . . . . 0.0 111.816 -173.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.27 0 CA-C-O 121.263 0.554 . . . . 0.0 110.035 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -67.23 -21.62 65.73 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.327 -0.858 . . . . 0.0 113.144 -168.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.47 -39.76 80.82 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 118.818 0.735 . . . . 0.0 111.734 167.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.2 mtp180 -60.02 -32.13 70.6 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 121.029 -1.044 . . . . 0.0 112.317 174.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.39 -43.6 98.43 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.281 1.032 . . . . 0.0 111.578 177.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -74.53 -33.98 54.98 Favored Glycine 0 N--CA 1.474 1.179 0 CA-C-N 118.59 0.632 . . . . 0.0 112.695 176.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 16.3 mtp180 -55.24 -49.66 71.44 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.304 1.042 . . . . 0.0 109.721 170.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.76 -28.39 63.61 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 mp -85.92 -20.28 29.24 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.252 0.933 . . . . 0.0 113.325 -177.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -96.88 16.92 17.97 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.28 165.17 9.27 Favored Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 125.931 1.692 . . . . 0.0 112.05 168.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -69.34 -115.57 0.0 OUTLIER 'Trans proline' 0 CA--C 1.554 1.502 1 C-N-CA 126.314 4.676 . . . . 0.0 111.519 172.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -37.5 -35.7 0.14 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 128.626 2.771 . . . . 0.0 115.245 169.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.501 HH12 ' CB ' ' A' ' 57' ' ' CYS . 6.4 ttm-85 -64.12 -38.45 91.12 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 120.008 1.277 . . . . 0.0 112.974 178.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.9 t -58.35 -43.61 88.43 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.501 1.046 . . . . 0.0 109.855 174.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -38.05 89.69 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 173.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 6.2 mm -57.95 -47.83 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 125.433 1.493 . . . . 0.0 111.337 171.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.3 mt -65.49 -43.61 89.63 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.52 -0.738 . . . . 0.0 112.075 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.4 p -71.81 -24.17 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 CA-C-N 119.076 0.853 . . . . 0.0 112.243 175.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.0 -38.03 79.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.439 0.696 . . . . 0.0 111.214 171.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 25.4 mt -71.99 -33.5 68.16 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -178.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -39.55 -50.96 2.23 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.322 2.249 . . . . 0.0 112.94 170.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -97.7 -20.36 17.65 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.575 1.15 . . . . 0.0 113.107 173.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.95 15.93 54.84 Favored Glycine 0 N--CA 1.469 0.897 0 C-N-CA 126.661 2.077 . . . . 0.0 116.552 -165.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 1.8 m -50.47 74.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 127.251 2.22 . . . . 0.0 115.575 171.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 9.0 t -144.44 -54.22 0.33 Allowed 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.474 1.657 . . . . 0.0 115.474 -174.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 12.3 p90 -158.24 157.08 28.83 Favored Pre-proline 0 N--CA 1.481 1.1 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 177.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -53.94 127.89 27.46 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.943 2.429 . . . . 0.0 108.737 168.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.93 -3.08 62.26 Favored Glycine 0 CA--C 1.53 1.021 0 CA-C-O 117.484 -1.731 . . . . 0.0 115.006 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.87 -34.38 62.92 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 120.595 2.198 . . . . 0.0 110.902 169.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.581 HD13 ' H ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -62.16 -17.79 59.0 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 127.147 2.179 . . . . 0.0 112.204 -178.441 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.07 -43.99 97.06 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.028 0.531 . . . . 0.0 111.002 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.05 -38.69 75.88 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.806 -0.559 . . . . 0.0 111.957 173.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -73.49 -15.6 61.31 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 -177.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 30.0 mt -110.53 -24.84 10.33 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.435 1.494 . . . . 0.0 113.842 174.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.56 6.89 88.85 Favored Glycine 0 CA--C 1.533 1.197 0 CA-C-N 119.554 1.07 . . . . 0.0 112.514 -168.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.8 mt -110.93 148.94 31.4 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.355 1.062 . . . . 0.0 111.693 -170.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.448 HG23 ' H ' ' A' ' 50' ' ' ASN . 3.4 t -58.31 149.71 23.8 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.795 0.838 . . . . 0.0 112.839 -172.057 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.7 mtm-85 -48.43 -37.14 16.37 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.977 1.711 . . . . 0.0 111.632 172.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.6 m -60.79 -60.01 4.48 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.281 1.032 . . . . 0.0 111.376 175.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.448 ' H ' HG23 ' A' ' 47' ' ' THR . 7.9 m-20 -67.97 -34.37 76.43 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.603 -0.685 . . . . 0.0 111.011 -175.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.9 t -57.21 -52.78 52.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 123.448 0.699 . . . . 0.0 111.191 169.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 13.1 p -72.67 -26.79 61.76 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -177.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -49.63 -48.38 49.2 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.355 1.074 . . . . 0.0 111.438 174.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -78.8 -18.21 54.46 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 177.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 56.9 mt -70.72 -21.46 62.54 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 120.995 1.725 . . . . 0.0 112.042 172.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.0 t -63.21 -53.29 55.43 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.534 1.061 . . . . 0.0 110.908 176.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.501 ' CB ' HH12 ' A' ' 23' ' ' ARG . 48.9 t -78.94 12.81 1.99 Allowed 'General case' 0 CA--C 1.561 1.367 0 C-N-CA 125.557 1.543 . . . . 0.0 112.611 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -106.96 -52.22 2.8 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 126.821 2.048 . . . . 0.0 111.216 175.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 44.7 mtm105 -81.78 -25.76 34.99 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.692 0.797 . . . . 0.0 112.422 -170.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.64 -31.11 9.01 Favored Glycine 0 N--CA 1.474 1.233 0 C-N-CA 124.034 0.826 . . . . 0.0 113.715 178.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 41.5 m -82.39 -5.92 58.94 Favored 'General case' 0 CA--C 1.567 1.618 0 C-N-CA 126.065 1.746 . . . . 0.0 113.596 173.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.75 -3.68 83.25 Favored Glycine 0 N--CA 1.478 1.456 0 C-N-CA 126.831 2.158 . . . . 0.0 116.891 170.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.7 mt -56.62 -22.31 33.19 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.997 1.719 . . . . 0.0 114.195 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.9 m -143.97 149.68 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 C-N-CA 126.689 1.996 . . . . 0.0 111.842 177.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 97.7 t -115.61 143.13 26.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 126.464 1.905 . . . . 0.0 109.276 176.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -99.2 123.25 43.34 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.975 0.91 . . . . 0.0 111.953 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -124.36 162.54 23.62 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.645 1.178 . . . . 0.0 109.348 -178.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -91.86 126.55 36.99 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 164.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.258 0.0 OUTLIER -90.85 4.03 52.87 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -179.544 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 109.25 -15.79 32.77 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 125.124 1.345 . . . . 0.0 113.32 175.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.58 -45.08 2.2 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 128.197 2.599 . . . . 0.0 111.602 172.162 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -139.69 169.11 18.33 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.312 2.245 . . . . 0.0 110.917 -168.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 7.1 p -83.24 145.16 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 O-C-N 121.328 -0.857 . . . . 0.0 109.877 167.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.1 ptt180 -134.54 172.91 12.26 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.457 1.103 . . . . 0.0 111.829 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -122.77 124.62 43.75 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.483 1.113 . . . . 0.0 110.651 173.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -123.63 143.18 50.39 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.122 1.369 . . . . 0.0 110.768 -177.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.2 tp -52.14 143.73 13.71 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.589 1.156 . . . . 0.0 111.492 177.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -45.79 -38.87 7.62 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 115.907 1.817 . . . . 0.0 115.907 -173.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -176.41 168.32 2.75 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.515 1.926 . . . . 0.0 109.803 -175.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.3 p -41.94 -31.54 0.35 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.852 2.061 . . . . 0.0 112.174 164.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -46.81 -67.04 0.32 Allowed 'General case' 0 C--N 1.345 0.37 0 C-N-CA 127.249 2.22 . . . . 0.0 113.566 169.141 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 13.8 mt -68.09 -34.71 76.91 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 119.527 1.058 . . . . 0.0 109.813 178.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.29 -32.29 73.87 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.819 0.736 . . . . 0.0 112.357 -172.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.2 -58.84 3.03 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.911 0.884 . . . . 0.0 112.31 170.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.75 -28.41 69.86 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.958 1.254 . . . . 0.0 113.59 -174.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.99 -33.13 21.17 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.906 0.882 . . . . 0.0 112.611 172.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.05 -31.86 75.83 Favored Glycine 0 CA--C 1.539 1.583 0 C-N-CA 125.064 1.316 . . . . 0.0 113.155 175.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -62.67 -23.36 67.07 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.467 1.907 . . . . 0.0 111.299 166.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 46.2 tp 81.67 128.26 0.05 OUTLIER 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 130.305 3.442 . . . . 0.0 107.047 -174.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 76.3 t -65.06 5.81 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 125.433 1.493 . . . . 0.0 114.544 -169.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.408 ' C ' ' H ' ' A' ' 93' ' ' VAL . 2.5 tp-100 88.07 -26.86 0.07 Allowed 'General case' 0 C--O 1.217 -0.619 0 O-C-N 120.12 -1.612 . . . . 0.0 111.191 132.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.3 p -63.97 35.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 130.327 3.451 . . . . 0.0 112.666 167.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.408 ' H ' ' C ' ' A' ' 91' ' ' GLN . 0.2 OUTLIER 59.18 8.36 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 C-N-CA 128.007 2.523 . . . . 0.0 114.047 176.653 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 96.63 111.24 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 131.141 3.776 . . . . 0.0 106.791 -166.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.51 96.57 0.17 Allowed 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.925 -0.485 . . . . 0.0 110.895 175.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.0 t -52.98 147.44 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 167.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.17 34.58 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 129.526 3.13 . . . . 0.0 113.665 -175.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.2 p -100.34 129.03 46.28 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 126.153 1.781 . . . . 0.0 111.421 -176.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.4 ' CG ' HH12 ' B' ' 16' ' ' ARG . 31.3 t0 -127.35 153.83 45.72 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.379 166.266 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -170.63 163.03 5.84 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 126.569 1.948 . . . . 0.0 108.904 -167.032 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -64.76 155.11 69.17 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.187 1.925 . . . . 0.0 110.15 169.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -93.04 -149.4 0.26 Allowed 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 122.179 0.99 . . . . 0.0 113.43 -172.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 5.3 t 50.41 52.81 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 125.855 1.662 . . . . 0.0 110.193 175.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . 77.18 -12.89 1.0 Allowed 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 127.024 2.13 . . . . 0.0 116.434 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -60.77 167.12 2.92 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.595 1.089 . . . . 0.0 113.249 -177.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.5 mtm180 . . . . . 0 N--CA 1.469 0.503 0 C-N-CA 125.394 1.477 . . . . 0.0 110.974 -169.153 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.545 0 CA-C-O 121.614 0.721 . . . . 0.0 111.108 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -65.93 -21.32 66.43 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -167.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.24 -31.74 72.34 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 120.27 1.396 . . . . 0.0 112.511 168.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -61.43 -32.75 72.73 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.374 -0.829 . . . . 0.0 111.835 173.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -50.78 -57.84 7.4 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.85 1.26 . . . . 0.0 109.498 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.3 -34.03 88.84 Favored Glycine 0 CA--C 1.53 1.03 0 O-C-N 121.803 -0.561 . . . . 0.0 112.827 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.4 HH12 ' CG ' ' A' ' 99' ' ' ASP . 17.5 mtp180 -69.6 -11.52 60.9 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.035 1.334 . . . . 0.0 114.16 173.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.53 -8.11 14.67 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.756 1.622 . . . . 0.0 113.763 170.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -96.79 -29.98 13.44 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 119.909 1.231 . . . . 0.0 113.197 175.127 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -88.53 36.42 0.79 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.47 1.108 . . . . 0.0 112.604 173.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.434 ' CG ' ' HE ' ' B' ' 23' ' ' ARG . 0.1 OUTLIER -78.6 167.04 38.44 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 128.217 2.607 . . . . 0.0 112.46 172.882 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -69.12 -115.63 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.358 1 C-N-CA 126.686 4.924 . . . . 0.0 111.767 169.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -42.17 -33.67 0.64 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 128.314 2.645 . . . . 0.0 114.412 176.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . 0.552 HH12 ' CB ' ' B' ' 57' ' ' CYS . 6.9 ttm-85 -59.92 -32.14 70.49 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 117.957 -1.021 . . . . 0.0 112.91 178.237 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 1.6 m -53.37 -56.64 15.08 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.403 1.002 . . . . 0.0 109.716 169.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -35.57 80.78 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 117.799 -1.096 . . . . 0.0 112.189 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 5.2 mm -53.74 -50.96 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 CA-C-N 120.778 1.626 . . . . 0.0 112.279 170.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 42.6 mt -69.21 -40.84 77.74 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.555 -0.736 . . . . 0.0 112.062 -174.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 12.5 p -74.38 -25.25 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-N 118.995 0.816 . . . . 0.0 112.276 175.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.3 -27.92 68.95 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.1 -1.0 . . . . 0.0 111.996 170.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 4.9 mp -67.82 -51.08 52.75 Favored 'General case' 0 C--O 1.226 -0.16 0 CA-C-O 117.176 -1.392 . . . . 0.0 111.598 168.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 4.7 mt -44.48 -46.03 9.5 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.767 1.227 . . . . 0.0 112.022 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -81.07 3.52 23.0 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 126.932 2.093 . . . . 0.0 113.998 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -153.12 -63.31 0.01 OUTLIER Glycine 0 N--CA 1.478 1.452 0 N-CA-C 118.049 1.98 . . . . 0.0 118.049 -167.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 16.0 m 33.42 40.37 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 127.854 2.462 . . . . 0.0 115.915 -169.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 3.6 t -96.74 -60.84 1.51 Allowed 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 -169.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -158.97 159.22 29.43 Favored Pre-proline 0 N--CA 1.479 1.008 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 -174.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -60.09 124.54 15.46 Favored 'Trans proline' 0 C--N 1.356 0.93 0 C-N-CA 123.112 2.542 . . . . 0.0 110.368 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.28 -4.62 85.3 Favored Glycine 0 CA--C 1.527 0.832 0 CA-C-O 117.423 -1.765 . . . . 0.0 114.331 -175.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . 0.576 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -55.94 -36.05 67.33 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 120.002 1.901 . . . . 0.0 109.776 169.322 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.563 HD13 ' H ' ' B' ' 40' ' ' LEU . 0.3 OUTLIER -60.94 -18.92 59.7 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 125.916 1.686 . . . . 0.0 112.574 179.799 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.99 -58.29 5.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 118.397 0.544 . . . . 0.0 110.222 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.34 -33.08 74.74 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 122.669 0.387 . . . . 0.0 111.286 176.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . 0.576 ' CD2' HE22 ' B' ' 39' ' ' GLN . 0.6 OUTLIER -71.94 -13.28 61.59 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 179.77 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 33.5 mt -117.85 -23.66 7.44 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.969 1.707 . . . . 0.0 113.721 177.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.7 12.04 84.03 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 124.633 1.111 . . . . 0.0 111.808 -167.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 94.8 mt -124.82 132.48 53.33 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 118.599 1.199 . . . . 0.0 112.209 -169.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 8.7 t -48.87 145.96 3.55 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.134 1.774 . . . . 0.0 115.448 -169.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 38.8 mtm-85 -49.68 -34.96 20.01 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.726 2.01 . . . . 0.0 112.508 177.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 5.9 m -61.72 -59.33 5.33 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.588 0.755 . . . . 0.0 110.989 174.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -64.59 -37.24 86.87 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.029 0.932 . . . . 0.0 111.534 -178.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.1 t -55.76 -49.93 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 C-N-CA 123.611 0.764 . . . . 0.0 111.177 169.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 15.4 p -76.38 -25.42 54.56 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 -176.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -51.3 -49.14 61.86 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.461 1.104 . . . . 0.0 110.969 170.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 60.3 m-70 -75.79 -22.4 56.42 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 173.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 91.6 mt -67.71 -23.07 65.24 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 121.008 1.731 . . . . 0.0 112.221 171.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.8 t -62.41 -53.55 53.2 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.718 1.144 . . . . 0.0 111.336 178.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . 0.552 ' CB ' HH12 ' B' ' 23' ' ' ARG 0.265 42.2 t -82.79 15.47 2.65 Favored 'General case' 0 CA--C 1.559 1.32 0 CA-C-O 122.417 1.104 . . . . 0.0 111.705 -178.991 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . 0.452 ' CD1' ' HD3' ' B' ' 23' ' ' ARG . 1.3 tp -105.28 -51.18 3.07 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 127.638 2.375 . . . . 0.0 111.708 173.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 29.9 mtm105 -89.63 -8.33 52.76 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.597 1.159 . . . . 0.0 112.656 -170.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -106.35 -29.84 4.64 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.356 1.455 . . . . 0.0 113.291 172.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 97.8 m -87.11 8.99 21.31 Favored 'General case' 0 CA--C 1.563 1.475 0 C-N-CA 126.067 1.747 . . . . 0.0 113.293 171.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.37 -13.84 14.45 Favored Glycine 0 N--CA 1.476 1.334 0 C-N-CA 126.825 2.155 . . . . 0.0 117.017 170.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 91.5 mt -48.79 -26.14 2.22 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.479 1.912 . . . . 0.0 114.88 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 4.0 m -136.99 150.64 26.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 126.186 1.794 . . . . 0.0 111.688 173.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 90.2 t -118.76 148.59 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 126.659 1.984 . . . . 0.0 108.661 170.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.92 135.12 51.92 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.784 1.234 . . . . 0.0 112.406 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.4 p -120.35 -178.49 3.7 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.811 1.244 . . . . 0.0 110.836 176.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -97.63 135.01 40.05 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 104.866 -2.272 . . . . 0.0 104.866 160.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.57 -11.94 23.11 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 115.146 1.535 . . . . 0.0 115.146 177.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 117.55 -34.15 4.65 Favored Glycine 0 N--CA 1.474 1.176 0 C-N-CA 124.85 1.214 . . . . 0.0 112.874 176.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -96.75 -35.39 11.0 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 125.85 1.66 . . . . 0.0 111.454 169.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -155.05 -141.74 0.1 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 128.046 2.538 . . . . 0.0 110.382 -177.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 15.2 m -133.65 152.9 35.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 127.152 2.181 . . . . 0.0 108.583 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 7.2 ptt85 -135.04 173.83 11.28 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.077 0.853 . . . . 0.0 111.751 -173.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -121.71 141.96 50.64 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.531 1.132 . . . . 0.0 109.063 168.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -142.42 145.06 33.4 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.851 1.261 . . . . 0.0 109.003 -178.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 tp -51.91 147.26 7.24 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.41 1.084 . . . . 0.0 111.05 175.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -49.57 -43.01 45.86 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 115.0 1.481 . . . . 0.0 115.0 -175.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -168.36 163.44 12.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.934 1.694 . . . . 0.0 110.61 -174.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 97.3 p -40.81 -33.92 0.34 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.624 2.37 . . . . 0.0 113.468 167.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -58.98 -54.95 41.38 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.344 1.058 . . . . 0.0 113.817 175.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 20.2 mt -66.37 -31.35 72.07 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.465 1.029 . . . . 0.0 109.746 177.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.22 -32.22 73.72 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 118.512 0.596 . . . . 0.0 109.512 178.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 2.8 mmt85 -71.57 -57.09 4.71 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.709 1.204 . . . . 0.0 111.123 168.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.45 -32.56 62.87 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.942 1.246 . . . . 0.0 114.036 -177.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -87.97 -37.47 16.36 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 172.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -81.42 -42.93 8.87 Favored Glycine 0 CA--C 1.539 1.533 0 C-N-CA 124.767 1.175 . . . . 0.0 113.984 -171.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -71.06 -35.88 72.09 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.8 1.24 . . . . 0.0 108.29 166.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 21.6 tp 93.76 144.34 0.02 OUTLIER 'General case' 0 C--N 1.342 0.268 0 C-N-CA 130.736 3.614 . . . . 0.0 111.434 168.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . 0.41 ' C ' ' H ' ' B' ' 92' ' ' VAL . 1.5 m -53.2 -14.91 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 126.162 1.785 . . . . 0.0 113.897 171.115 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 65.42 -13.18 0.13 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 127.026 2.131 . . . . 0.0 114.011 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.41 ' H ' ' C ' ' B' ' 90' ' ' VAL . 1.3 p -58.02 24.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 130.635 3.574 . . . . 0.0 117.423 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.3 t 65.63 13.96 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 126.949 2.1 . . . . 0.0 111.358 171.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 78.75 116.15 0.06 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.604 2.362 . . . . 0.0 108.123 -167.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.68 87.72 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 169.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -57.73 147.46 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 C-N-CA 124.992 1.317 . . . . 0.0 110.928 168.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -50.39 58.32 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.061 1 C-N-CA 131.832 4.053 . . . . 0.0 115.021 170.236 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 16.5 p -135.48 123.73 23.13 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 120.764 -1.21 . . . . 0.0 112.224 176.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -126.37 156.75 40.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 114.275 -1.329 . . . . 0.0 108.294 165.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -168.31 164.3 8.23 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 124.585 1.154 . . . . 0.0 109.357 -166.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -64.26 156.33 60.28 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 121.602 1.535 . . . . 0.0 109.264 167.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -101.02 -148.81 0.37 Allowed 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 122.189 0.995 . . . . 0.0 112.989 -169.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 4.7 t 51.43 50.54 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 125.533 1.533 . . . . 0.0 110.149 176.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . 85.27 -16.93 0.45 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 128.266 2.627 . . . . 0.0 116.225 177.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 -61.36 173.57 0.87 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.911 1.285 . . . . 0.0 114.45 -173.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 . . . . . 0 N--CA 1.471 0.606 0 C-N-CA 127.328 2.251 . . . . 0.0 110.483 -169.394 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.827 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -52.4 -39.59 61.08 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -166.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.46 -36.78 52.55 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.799 1.181 . . . . 0.0 111.722 174.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -62.89 -28.19 69.88 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.136 1.374 . . . . 0.0 112.562 177.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -47.85 -57.54 5.52 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.877 1.671 . . . . 0.0 109.337 168.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -76.85 -14.72 82.29 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-O 119.065 -0.853 . . . . 0.0 113.722 -178.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 76.6 mmt-85 -66.97 -62.59 1.36 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 166.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.13 -38.2 85.55 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.603 1.961 . . . . 0.0 114.905 -173.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.2 mp -79.66 -14.16 58.98 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 119.571 1.078 . . . . 0.0 112.538 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -118.88 24.26 10.95 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.452 1.101 . . . . 0.0 112.064 170.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -90.17 148.66 39.81 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 104.91 -2.255 . . . . 0.0 104.91 165.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -54.56 -99.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 0.979 1 C-N-CA 126.788 4.992 . . . . 0.0 113.777 -166.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.453 ' HG1' ' CD2' ' A' ' 54' ' ' HIS . 21.4 p -46.76 -36.88 7.74 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 126.155 1.782 . . . . 0.0 112.157 169.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -65.45 -36.87 85.21 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.179 0.899 . . . . 0.0 111.466 -174.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 52.4 t -67.38 -45.14 77.13 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.157 -0.964 . . . . 0.0 110.65 166.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.91 -43.08 69.41 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 121.743 -0.598 . . . . 0.0 112.535 178.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.6 mm -55.58 -50.42 66.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.617 1.567 . . . . 0.0 111.59 171.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 85.4 mt -61.47 -40.71 95.52 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.157 0.889 . . . . 0.0 112.015 -177.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 7.3 p -80.72 -32.6 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.1 -28.19 61.24 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.743 0.817 . . . . 0.0 112.522 173.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 17.7 tp -66.33 -39.49 89.27 Favored 'General case' 0 N--CA 1.437 -1.088 0 CA-C-O 116.644 -1.646 . . . . 0.0 111.601 169.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -47.33 -62.43 1.43 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.703 2.001 . . . . 0.0 110.1 175.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -83.3 26.24 0.66 Allowed 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.595 1.958 . . . . 0.0 113.04 174.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.25 -87.25 0.31 Allowed Glycine 0 C--N 1.337 0.63 0 C-N-CA 125.783 1.659 . . . . 0.0 112.738 -177.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 30.7 m 39.66 41.3 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 127.455 2.302 . . . . 0.0 114.575 -170.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -90.68 -68.16 0.8 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -177.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 24.1 p90 -159.25 157.76 27.74 Favored Pre-proline 0 N--CA 1.475 0.781 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -170.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -56.74 128.85 31.65 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.451 2.1 . . . . 0.0 109.276 171.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.74 -0.61 81.47 Favored Glycine 0 CA--C 1.534 1.226 0 CA-C-O 117.738 -1.59 . . . . 0.0 114.818 -175.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.535 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -59.1 -37.89 78.23 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 120.631 2.215 . . . . 0.0 110.898 170.865 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.5 mt -60.84 -17.8 52.0 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.564 1.145 . . . . 0.0 112.126 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.33 -31.84 73.1 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 118.698 0.681 . . . . 0.0 111.316 174.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.14 -50.43 19.45 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.429 0.692 . . . . 0.0 111.042 173.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.535 ' CD2' HE22 ' A' ' 39' ' ' GLN . 12.1 m-70 -57.78 -37.39 73.61 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 178.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.7 mt -98.29 -23.22 15.74 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.772 0.829 . . . . 0.0 113.196 -174.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.14 6.49 74.46 Favored Glycine 0 CA--C 1.534 1.273 0 CA-C-N 119.568 1.077 . . . . 0.0 113.919 -170.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.9 mp -96.93 155.44 16.78 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 118.143 0.971 . . . . 0.0 111.442 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.499 HG21 ' H ' ' A' ' 50' ' ' ASN . 1.4 t -58.21 144.7 39.86 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.971 0.508 . . . . 0.0 111.698 -179.287 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 29.9 mtt85 -55.24 -24.24 26.76 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.084 1.354 . . . . 0.0 111.947 171.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.9 m -65.33 -62.92 1.25 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.096 1.358 . . . . 0.0 111.275 170.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.499 ' H ' HG21 ' A' ' 47' ' ' THR . 3.7 m120 -66.12 -36.9 84.36 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.386 -0.821 . . . . 0.0 111.234 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.41 -31.8 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 O-C-N 120.327 -1.483 . . . . 0.0 113.045 169.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.3 m -75.47 -37.33 60.34 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.327 1.421 . . . . 0.0 113.209 171.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -54.58 -49.22 70.91 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.521 0.728 . . . . 0.0 110.154 172.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.453 ' CD2' ' HG1' ' A' ' 22' ' ' THR . 16.7 m80 -64.27 -20.91 66.38 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 176.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 65.2 mt -88.98 -18.83 26.61 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 117.033 -1.461 . . . . 0.0 114.443 174.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 55.3 m -53.47 -58.0 8.68 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 121.988 2.176 . . . . 0.0 112.114 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 40.5 t -66.01 -45.13 82.64 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 122.853 1.311 . . . . 0.0 110.344 -176.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.84 -41.33 57.69 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 127.916 2.487 . . . . 0.0 113.356 -178.32 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.7 mtm180 -84.33 -21.04 31.11 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -177.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -95.7 -45.08 3.0 Favored Glycine 0 N--CA 1.473 1.145 0 CA-C-N 119.275 0.943 . . . . 0.0 113.879 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 51.7 m -66.04 -13.91 60.77 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 124.987 1.315 . . . . 0.0 111.831 174.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 97.45 14.36 41.53 Favored Glycine 0 C--N 1.346 1.1 0 C-N-CA 127.427 2.442 . . . . 0.0 115.848 167.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.9 mt -71.11 -28.62 64.44 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.772 1.286 . . . . 0.0 113.562 179.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 3.5 m -140.81 159.11 23.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 126.007 1.723 . . . . 0.0 111.901 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 2.9 t -140.85 160.59 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 125.487 1.515 . . . . 0.0 110.137 -172.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -86.08 146.45 26.61 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.842 1.257 . . . . 0.0 112.344 169.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -140.73 174.63 10.33 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.715 1.606 . . . . 0.0 107.396 169.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -111.32 127.47 55.65 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.153 0.981 . . . . 0.0 111.948 169.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -80.66 14.75 1.97 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.858 0.863 . . . . 0.0 110.984 165.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 80.52 -56.34 4.7 Favored Glycine 0 C--N 1.343 0.937 0 C-N-CA 126.415 1.959 . . . . 0.0 112.067 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -76.05 -18.73 59.1 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.173 1.789 . . . . 0.0 112.568 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -164.08 167.3 20.45 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.8 2.04 . . . . 0.0 109.763 -173.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 34.3 m -87.04 154.98 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 O-C-N 121.725 -0.609 . . . . 0.0 110.078 167.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -132.67 169.43 16.67 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 125.321 1.448 . . . . 0.0 109.169 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -108.15 162.03 14.44 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 164.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -152.47 151.14 30.4 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.81 1.644 . . . . 0.0 110.214 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.2 tp -64.03 148.08 50.6 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.059 0.944 . . . . 0.0 109.249 169.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -76.75 -8.0 56.45 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 117.641 2.46 . . . . 0.0 117.641 -169.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -179.54 164.38 1.28 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 127.644 2.377 . . . . 0.0 111.883 172.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 26.4 t -47.65 -28.87 2.59 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.235 2.214 . . . . 0.0 112.448 166.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -49.14 -65.07 0.63 Allowed 'General case' 0 C--N 1.341 0.223 0 C-N-CA 125.51 1.524 . . . . 0.0 112.082 169.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.9 mt -68.29 -34.22 75.76 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 118.976 0.807 . . . . 0.0 110.138 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.98 -43.81 91.38 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 119.21 0.914 . . . . 0.0 111.207 -174.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.93 -31.69 40.07 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-O 117.906 -1.045 . . . . 0.0 112.574 179.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.94 -42.86 59.94 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 120.457 1.48 . . . . 0.0 112.518 176.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.18 -43.06 74.96 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.364 -0.835 . . . . 0.0 110.102 174.373 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.91 -30.47 65.72 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 125.855 1.693 . . . . 0.0 113.394 -174.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -62.79 -25.61 68.31 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 125.029 1.332 . . . . 0.0 111.499 166.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.562 ' C ' ' H ' ' A' ' 91' ' ' GLN . 27.8 tp 77.55 148.39 0.1 Allowed 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 129.139 2.975 . . . . 0.0 107.877 -167.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 4.3 m -57.1 5.09 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 120.396 -1.44 . . . . 0.0 113.969 165.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.562 ' H ' ' C ' ' A' ' 89' ' ' LEU . 28.7 mm-40 71.9 -43.28 0.56 Allowed 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 130.66 3.584 . . . . 0.0 111.026 -175.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -55.47 103.21 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 125.939 1.696 . . . . 0.0 112.937 -171.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.4 t 61.82 -31.03 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 C-N-CA 130.606 3.562 . . . . 0.0 117.651 168.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 tm? 109.38 93.03 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.509 1 C-N-CA 132.278 4.231 . . . . 0.0 101.858 -163.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.61 82.57 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 -169.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.7 t -63.11 149.58 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 126.835 2.054 . . . . 0.0 111.889 169.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -59.45 -6.82 1.15 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 128.88 2.872 . . . . 0.0 115.403 175.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 17.7 p -75.97 113.38 13.41 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.426 1.091 . . . . 0.0 112.294 -175.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -75.44 69.5 2.22 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.864 1.266 . . . . 0.0 110.353 168.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.94 145.34 72.37 Favored Pre-proline 0 CA--C 1.55 0.949 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.478 173.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -63.83 136.1 51.58 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 123.111 2.54 . . . . 0.0 113.47 -168.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.0 t -70.16 66.36 0.28 Allowed 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 127.347 2.259 . . . . 0.0 111.106 -178.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 9.0 p -34.21 -51.08 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 N-CA-C 117.604 2.446 . . . . 0.0 117.604 -166.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -89.57 133.65 34.5 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 119.631 1.105 . . . . 0.0 111.336 174.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 55.49 35.1 24.42 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.043 1.337 . . . . 0.0 114.15 -172.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? . . . . . 0 CA--C 1.539 0.548 0 C-N-CA 125.257 1.423 . . . . 0.0 114.523 -174.232 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.834 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -45.35 -41.95 9.48 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.864 2.065 . . . . 0.0 116.011 -167.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.13 -52.38 14.42 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.48 1.036 . . . . 0.0 111.568 173.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -53.85 -35.17 61.2 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.405 1.482 . . . . 0.0 113.188 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -50.28 -56.36 11.54 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 127.597 2.359 . . . . 0.0 110.347 169.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.62 -19.61 78.0 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-O 118.858 -0.968 . . . . 0.0 113.781 177.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 57.8 mmt-85 -66.75 -49.4 66.07 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.447 1.623 . . . . 0.0 108.624 168.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.96 -37.22 72.78 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.955 1.702 . . . . 0.0 113.971 -178.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 7.0 mp -72.52 -14.84 61.74 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.382 0.992 . . . . 0.0 113.156 176.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -121.84 29.45 7.11 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.107 0.963 . . . . 0.0 112.681 170.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -90.87 153.2 45.17 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 165.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -54.8 -94.36 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.781 1 C-N-CA 126.224 4.616 . . . . 0.0 113.38 -168.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 16.5 p -51.7 -31.01 24.35 Favored 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 126.492 1.917 . . . . 0.0 112.625 170.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.87 -42.18 77.37 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.553 1.069 . . . . 0.0 111.726 -176.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 39.0 t -61.93 -42.72 99.43 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 119.003 0.819 . . . . 0.0 109.988 167.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -46.52 81.82 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 118.21 -0.9 . . . . 0.0 113.116 175.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.4 mm -55.81 -51.77 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 CA-C-N 120.487 1.494 . . . . 0.0 110.091 173.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 79.6 mt -59.68 -42.67 93.44 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 118.635 -0.698 . . . . 0.0 112.408 -177.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 7.1 p -80.45 -30.23 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 118.874 0.761 . . . . 0.0 112.731 -178.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.39 -35.95 68.57 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.586 -0.696 . . . . 0.0 112.215 173.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 20.0 tp -61.76 -37.97 86.27 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 117.068 -1.444 . . . . 0.0 112.5 177.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -44.24 -53.77 6.32 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 128.365 2.666 . . . . 0.0 112.28 -177.446 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -88.26 -15.47 35.73 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.732 1.613 . . . . 0.0 112.447 179.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.39 -77.54 1.26 Allowed Glycine 0 C--N 1.338 0.682 0 C-N-CA 124.901 1.239 . . . . 0.0 112.281 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 29.4 m 37.45 41.21 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 126.582 1.953 . . . . 0.0 114.509 -169.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -87.67 -72.78 0.51 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 121.727 -0.608 . . . . 0.0 112.046 -173.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 49.4 p90 -155.82 157.49 31.43 Favored Pre-proline 0 CA--C 1.538 0.506 0 CA-C-O 118.761 -0.638 . . . . 0.0 112.571 -170.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -60.49 125.04 16.34 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.576 2.184 . . . . 0.0 109.703 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.95 -1.54 88.81 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-O 117.564 -1.687 . . . . 0.0 114.763 -174.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . 0.461 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -56.81 -36.27 69.73 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.336 2.068 . . . . 0.0 111.015 169.751 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mt -61.51 -18.49 59.34 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.218 1.007 . . . . 0.0 112.133 -177.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.35 -34.36 75.15 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 118.596 0.635 . . . . 0.0 111.026 175.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.77 -38.66 32.69 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.133 0.973 . . . . 0.0 112.741 175.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . 0.461 ' CD2' HE22 ' B' ' 39' ' ' GLN . 4.0 m-70 -62.18 -34.7 76.93 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 172.265 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 26.2 mt -103.55 -23.08 13.53 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -173.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.54 8.29 85.9 Favored Glycine 0 CA--C 1.533 1.216 0 CA-C-N 119.194 0.907 . . . . 0.0 114.015 -170.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 9.3 mp -104.64 155.73 18.6 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 118.404 1.102 . . . . 0.0 112.395 -177.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' THR . . . . . 0.444 HG21 ' H ' ' B' ' 50' ' ' ASN . 1.6 t -59.47 145.68 43.03 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.11 0.964 . . . . 0.0 112.282 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 29.5 mtm180 -57.19 -24.08 52.0 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.14 1.376 . . . . 0.0 112.469 169.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.9 m -59.76 -59.29 5.66 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.587 1.155 . . . . 0.0 109.856 169.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . 0.444 ' H ' HG21 ' B' ' 47' ' ' THR . 2.7 m120 -72.67 -42.51 64.21 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.969 0.908 . . . . 0.0 110.831 -177.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.5 t -53.79 -40.53 44.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 120.565 1.53 . . . . 0.0 111.924 171.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 50.5 m -68.66 -39.52 80.6 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 120.078 1.308 . . . . 0.0 113.441 175.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -57.99 -48.55 79.68 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.932 0.893 . . . . 0.0 111.259 172.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 19.4 m170 -60.63 -38.49 84.95 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 118.034 -0.984 . . . . 0.0 112.097 173.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 42.7 mt -70.89 -21.22 62.42 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.11 1.364 . . . . 0.0 114.115 174.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' SER . . . . . 0.461 ' HA ' HH21 ' B' ' 59' ' ' ARG . 0.2 OUTLIER -61.14 -59.35 5.48 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 121.476 1.944 . . . . 0.0 112.711 -172.282 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -73.21 -26.35 61.11 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 122.121 0.962 . . . . 0.0 111.487 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.22 -48.17 71.36 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.62 1.568 . . . . 0.0 111.216 169.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . 0.461 HH21 ' HA ' ' B' ' 56' ' ' SER . 76.5 mtm180 -82.81 -21.54 34.47 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.537 1.135 . . . . 0.0 112.48 178.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -78.29 -60.45 2.68 Favored Glycine 0 N--CA 1.469 0.891 0 CA-C-N 119.381 0.991 . . . . 0.0 113.234 177.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 20.8 m -67.89 -7.94 32.41 Favored 'General case' 0 CA--C 1.564 1.495 0 C-N-CA 125.236 1.414 . . . . 0.0 114.106 -178.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.87 7.99 54.72 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 127.008 2.242 . . . . 0.0 115.87 171.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 1.7 mt -66.5 -26.38 67.14 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.77 1.628 . . . . 0.0 112.98 -176.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 3.0 m -142.38 159.75 19.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 127.417 2.287 . . . . 0.0 110.723 174.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 4.8 t -133.91 167.04 27.22 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 C-N-CA 126.185 1.794 . . . . 0.0 109.449 176.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.33 130.43 50.6 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.652 1.581 . . . . 0.0 111.84 171.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.3 m -120.64 -178.23 3.66 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.637 1.575 . . . . 0.0 108.223 178.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -116.21 131.46 56.94 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.332 1.053 . . . . 0.0 112.005 169.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.52 10.29 18.23 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.579 0.752 . . . . 0.0 110.484 165.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.9 -56.45 4.94 Favored Glycine 0 C--N 1.344 0.984 0 C-N-CA 125.956 1.741 . . . . 0.0 112.182 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -70.49 -19.98 62.89 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.645 1.578 . . . . 0.0 112.553 174.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -165.2 168.47 17.05 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.121 2.168 . . . . 0.0 109.621 -174.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 32.9 m -88.3 156.73 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 O-C-N 121.489 -0.757 . . . . 0.0 110.226 167.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -132.92 173.13 11.72 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.503 1.121 . . . . 0.0 109.034 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -111.59 160.53 17.12 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 164.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -156.16 152.87 28.42 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.649 1.58 . . . . 0.0 110.295 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 tp -63.25 158.39 20.28 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.417 1.487 . . . . 0.0 112.594 176.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.67 -29.88 60.09 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 116.958 2.207 . . . . 0.0 116.958 -175.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 10.0 t70 168.63 166.37 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 129.425 3.09 . . . . 0.0 109.4 -169.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 45.2 t -46.11 -33.21 3.36 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.435 1.894 . . . . 0.0 112.121 166.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -45.76 -64.66 0.68 Allowed 'General case' 0 C--N 1.343 0.287 0 C-N-CA 125.208 1.403 . . . . 0.0 112.878 171.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 14.5 mt -68.07 -31.91 71.87 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.416 1.007 . . . . 0.0 110.848 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.27 -45.23 94.2 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.416 1.007 . . . . 0.0 110.286 -176.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.95 -40.24 28.49 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.569 0.748 . . . . 0.0 112.765 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.2 -33.58 71.88 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.797 1.18 . . . . 0.0 113.733 179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.13 -42.34 47.17 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.47 -0.769 . . . . 0.0 110.193 170.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.05 -39.06 54.8 Favored Glycine 0 CA--C 1.538 1.519 0 C-N-CA 125.6 1.571 . . . . 0.0 114.222 -169.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.84 -31.67 59.45 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 119.116 1.458 . . . . 0.0 109.662 166.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . 0.493 ' C ' ' H ' ' B' ' 91' ' ' GLN . 19.3 tp 82.14 160.8 0.14 Allowed 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 128.98 2.912 . . . . 0.0 111.296 169.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 15.9 m -57.07 8.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 127.21 2.204 . . . . 0.0 114.648 169.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.493 ' H ' ' C ' ' B' ' 89' ' ' LEU . 15.3 mm-40 71.56 -20.39 0.24 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.461 1.905 . . . . 0.0 114.895 171.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 2.5 p -54.56 29.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 C-N-CA 131.393 3.877 . . . . 0.0 118.301 -176.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.2 t 69.26 15.72 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 125.533 1.533 . . . . 0.0 111.379 171.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 2.1 tm? 101.63 107.3 0.01 OUTLIER 'General case' 0 C--N 1.35 0.601 0 C-N-CA 130.583 3.553 . . . . 0.0 109.055 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.04 88.91 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.873 0 O-C-N 120.94 -1.1 . . . . 0.0 110.998 168.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 15.3 t -65.38 149.13 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 125.916 1.687 . . . . 0.0 110.312 173.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -57.91 -2.58 0.16 Allowed 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 127.284 2.234 . . . . 0.0 115.24 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 38.0 p -87.05 118.98 26.79 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.864 1.266 . . . . 0.0 111.976 -178.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -76.97 67.1 2.92 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 122.655 1.217 . . . . 0.0 109.769 167.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.68 134.9 64.45 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 172.381 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -57.59 136.77 77.8 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.382 2.721 . . . . 0.0 112.895 -169.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 9.0 t -65.7 55.35 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 128.786 2.835 . . . . 0.0 111.331 175.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 7.5 p -25.49 -58.11 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 128.772 2.829 . . . . 0.0 115.034 -166.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.46 110.68 13.75 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.861 0.755 . . . . 0.0 109.448 168.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . 0.26 73.0 mt-10 78.0 30.37 0.45 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 126.414 1.885 . . . . 0.0 113.737 171.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? . . . . . 0 CA--C 1.539 0.523 0 C-N-CA 124.739 1.216 . . . . 0.0 112.562 170.08 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.424 0 CA-C-O 121.846 0.832 . . . . 0.0 109.909 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -59.72 -30.06 68.56 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 -170.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.59 -32.04 49.34 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 120.293 1.406 . . . . 0.0 112.91 172.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.0 mmt85 -66.94 -18.36 65.34 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 120.312 -1.492 . . . . 0.0 113.017 177.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -70.28 -39.22 75.02 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.6 1.16 . . . . 0.0 110.807 172.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.08 -40.83 99.7 Favored Glycine 0 C--N 1.341 0.86 0 N-CA-C 111.099 -0.8 . . . . 0.0 111.099 171.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -57.25 -46.03 83.4 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.212 1.006 . . . . 0.0 109.674 171.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.73 -19.63 65.1 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 116.916 -1.516 . . . . 0.0 113.578 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 mp -98.4 -16.35 19.31 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 171.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.86 -34.17 51.81 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.633 1.973 . . . . 0.0 114.3 169.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -50.85 136.37 26.74 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 125.098 1.359 . . . . 0.0 111.203 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.44 ' HG2' ' H ' ' A' ' 22' ' ' THR . 61.5 Cg_endo -60.01 -77.34 0.02 OUTLIER 'Trans proline' 0 CA--C 1.537 0.647 1 C-N-CA 125.47 4.113 . . . . 0.0 113.23 -169.03 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.46 ' HB ' ' CD2' ' A' ' 54' ' ' HIS . 24.6 m -53.98 -36.7 63.18 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 117.59 -1.195 . . . . 0.0 110.408 174.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.32 -43.0 82.7 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.915 1.234 . . . . 0.0 113.336 -175.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 11.8 t -54.43 -44.63 72.62 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.601 1.16 . . . . 0.0 110.276 168.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -43.68 93.98 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-O 117.857 -1.068 . . . . 0.0 112.444 175.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -54.44 -50.45 57.68 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 C-N-CA 125.948 1.699 . . . . 0.0 111.061 174.528 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 14.9 mt -52.57 -39.39 61.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 118.671 -0.68 . . . . 0.0 112.573 -176.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.08 -20.26 26.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 118.807 0.731 . . . . 0.0 112.559 -177.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.39 -6.93 59.43 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 174.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -105.91 -13.26 15.55 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 169.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.47 -48.35 64.72 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 127.394 2.277 . . . . 0.0 108.773 165.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -135.86 96.06 3.35 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.514 2.726 . . . . 0.0 107.932 175.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 159.59 -95.8 0.14 Allowed Glycine 0 N--CA 1.468 0.78 0 C-N-CA 124.824 1.202 . . . . 0.0 111.105 176.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.0 m 51.4 33.13 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 178.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 2.4 m -80.55 -65.58 0.99 Allowed 'General case' 0 C--O 1.222 -0.364 0 O-C-N 121.199 -0.938 . . . . 0.0 111.284 178.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -150.96 157.5 35.41 Favored Pre-proline 0 N--CA 1.47 0.533 0 CA-C-O 117.731 -1.128 . . . . 0.0 111.069 -172.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -59.07 -18.1 41.76 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 122.892 2.395 . . . . 0.0 114.166 169.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -86.91 -12.27 68.83 Favored Glycine 0 CA--C 1.536 1.403 0 CA-C-O 118.494 -1.17 . . . . 0.0 115.252 170.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.87 -36.67 56.6 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.884 1.842 . . . . 0.0 112.051 -170.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.586 ' H ' HD11 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -66.71 -19.4 65.75 Favored 'General case' 0 C--O 1.217 -0.616 0 C-N-CA 123.14 0.576 . . . . 0.0 110.919 -174.546 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.8 -36.75 79.82 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.387 -0.82 . . . . 0.0 112.734 -177.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -75.0 -47.76 27.53 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 122.794 0.437 . . . . 0.0 110.926 170.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -57.68 -35.72 70.97 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.766 1.226 . . . . 0.0 113.919 -176.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 65.7 mt -94.53 -15.27 24.29 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 127.598 2.359 . . . . 0.0 112.324 -178.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.33 10.96 54.88 Favored Glycine 0 CA--C 1.53 1.023 0 C-N-CA 124.291 0.948 . . . . 0.0 112.976 -170.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.4 mt -117.22 149.99 39.49 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 124.107 0.963 . . . . 0.0 111.427 -169.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 12.7 p -61.75 147.31 46.61 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.833 -0.542 . . . . 0.0 110.115 -172.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -59.15 -20.33 52.77 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 177.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.0 m -73.94 -46.53 43.64 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.138 0.975 . . . . 0.0 112.085 169.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -65.09 -44.2 89.62 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.364 1.065 . . . . 0.0 111.889 175.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 23.2 t -61.53 -40.87 87.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.725 1.21 . . . . 0.0 111.391 173.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 70.7 m -64.04 -41.35 97.44 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.921 1.237 . . . . 0.0 112.717 172.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -55.11 -48.93 72.93 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 123.491 0.716 . . . . 0.0 111.48 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.46 ' CD2' ' HB ' ' A' ' 22' ' ' THR 0.272 11.2 m-70 -80.4 -22.98 40.71 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.811 1.412 . . . . 0.0 114.811 176.45 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 31.4 mt -65.16 -30.5 71.42 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.773 1.624 . . . . 0.0 110.619 166.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.6 t -50.76 -59.81 3.71 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.568 1.076 . . . . 0.0 112.857 -173.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 9.0 t -78.29 -11.02 59.91 Favored 'General case' 0 CA--C 1.554 1.112 0 O-C-N 121.476 -0.765 . . . . 0.0 112.227 174.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.9 tp -68.15 -36.28 79.42 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 122.065 2.211 . . . . 0.0 109.882 168.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.0 mtp180 -81.34 -12.77 58.92 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.37 1.868 . . . . 0.0 111.131 173.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -88.48 -60.84 1.5 Allowed Glycine 0 C--N 1.34 0.8 0 C-N-CA 125.044 1.307 . . . . 0.0 111.006 176.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 96.1 m -59.2 8.13 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 128.361 2.664 . . . . 0.0 115.022 171.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.23 -3.55 14.67 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 126.202 1.858 . . . . 0.0 115.743 177.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 75.4 mt -59.65 -29.53 68.1 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 126.398 1.879 . . . . 0.0 114.555 -174.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.38 137.25 58.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 125.16 1.384 . . . . 0.0 111.95 173.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.6 t -118.06 139.86 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 C-N-CA 125.849 1.66 . . . . 0.0 109.298 174.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -89.01 149.58 23.19 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.556 1.142 . . . . 0.0 113.461 177.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 m -171.16 157.79 5.25 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 126.442 1.897 . . . . 0.0 108.05 -176.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -73.1 143.79 47.24 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 118.903 0.774 . . . . 0.0 112.529 171.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.499 ' CD ' ' H ' ' A' ' 70' ' ' GLY 0.289 2.2 pp20? -84.75 -124.42 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 117.034 -1.46 . . . . 0.0 107.654 165.264 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.499 ' H ' ' CD ' ' A' ' 69' ' ' GLU . . . -77.29 -28.82 57.35 Favored Glycine 0 CA--C 1.537 1.416 0 CA-C-N 121.919 2.145 . . . . 0.0 114.286 171.288 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.49 -29.02 0.07 Allowed 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 119.15 1.475 . . . . 0.0 114.818 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -81.99 168.86 17.41 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 125.711 1.605 . . . . 0.0 111.011 169.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 26.7 m -98.84 146.78 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 123.272 0.629 . . . . 0.0 110.181 169.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -129.83 168.64 16.28 Favored 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 125.432 1.493 . . . . 0.0 111.626 -171.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -121.6 129.0 52.54 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 124.97 1.308 . . . . 0.0 109.215 170.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -143.05 153.44 42.95 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 125.333 1.453 . . . . 0.0 111.398 -173.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 68.7 mt -64.42 147.24 53.09 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -177.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.35 -28.71 61.26 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -172.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -163.8 159.54 21.36 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 123.148 1.451 . . . . 0.0 112.931 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 96.0 p -43.42 -36.34 1.91 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 128.646 2.778 . . . . 0.0 113.815 167.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -50.78 -52.68 38.5 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 125.201 1.4 . . . . 0.0 112.59 172.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.9 mt -71.43 -53.4 14.12 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.31 -36.52 61.33 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.661 1.185 . . . . 0.0 113.0 -177.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -74.92 -57.42 3.92 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 117.726 -1.131 . . . . 0.0 111.974 -177.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.7 -27.33 68.84 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.466 1.03 . . . . 0.0 112.869 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 60.1 tp -69.35 -41.15 76.98 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.565 1.146 . . . . 0.0 111.469 169.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -78.47 -38.36 25.05 Favored Glycine 0 N--CA 1.469 0.88 0 C-N-CA 126.692 2.091 . . . . 0.0 115.129 -172.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -82.94 -16.6 46.74 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 118.637 1.219 . . . . 0.0 113.014 171.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.449 ' C ' ' H ' ' A' ' 91' ' ' GLN . 43.5 tp 67.95 140.94 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 128.841 2.856 . . . . 0.0 112.241 178.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 34.7 m -63.64 22.19 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.434 1.893 . . . . 0.0 114.656 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.449 ' H ' ' C ' ' A' ' 89' ' ' LEU . 27.3 mm-40 81.08 -26.91 0.14 Allowed 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 125.98 1.712 . . . . 0.0 112.949 158.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.1 p -54.44 23.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 C-N-CA 131.57 3.948 . . . . 0.0 118.135 178.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 68.56 11.69 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 O-C-N 120.379 -1.45 . . . . 0.0 112.459 167.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.1 tt 84.94 100.93 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 129.389 3.076 . . . . 0.0 109.369 -172.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.93 108.13 0.98 Allowed 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 -175.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -66.89 150.42 11.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 125.125 1.37 . . . . 0.0 113.843 169.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -87.41 146.22 25.96 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.423 1.889 . . . . 0.0 108.621 165.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -173.01 136.29 0.65 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.557 1.943 . . . . 0.0 109.164 -177.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.0 p30 -67.48 -31.12 71.05 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 129.783 3.233 . . . . 0.0 112.115 169.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.09 168.26 2.3 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 128.501 2.721 . . . . 0.0 113.378 172.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -68.49 158.73 56.42 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 123.017 2.478 . . . . 0.0 112.848 -172.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 31.4 p -47.49 -57.42 5.4 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 123.418 1.58 . . . . 0.0 106.793 165.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -176.84 -56.15 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.479 1 C-N-CA 131.826 4.05 . . . . 0.0 108.134 167.545 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -87.25 56.63 4.06 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.628 1.171 . . . . 0.0 112.563 175.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -140.87 -177.31 5.02 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.002 2.121 . . . . 0.0 107.174 172.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.079 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 176.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.393 0 CA-C-O 121.247 0.546 . . . . 0.0 111.27 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -64.28 -18.64 64.77 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 114.487 1.291 . . . . 0.0 114.487 -176.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.91 -39.46 62.78 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 120.975 1.716 . . . . 0.0 110.027 167.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 67.8 mtt180 -72.25 -13.35 61.5 Favored 'General case' 0 CA--C 1.55 0.976 0 O-C-N 120.334 -1.479 . . . . 0.0 113.58 178.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -69.59 -41.85 75.21 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 120.14 1.336 . . . . 0.0 109.751 169.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -60.37 -38.54 94.87 Favored Glycine 0 N--CA 1.47 0.958 0 O-C-N 120.911 -1.118 . . . . 0.0 111.91 172.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -58.09 -38.86 77.23 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.711 -0.876 . . . . 0.0 110.659 172.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.12 -12.93 61.07 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 117.86 -1.067 . . . . 0.0 113.77 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 12.4 mt -93.7 -25.71 17.33 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.205 0.911 . . . . 0.0 112.258 169.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.67 -20.54 49.98 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.641 1.976 . . . . 0.0 114.638 168.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.462 ' CG ' ' HE ' ' B' ' 23' ' ' ARG . 9.7 t70 -56.92 130.09 78.71 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 127.287 2.235 . . . . 0.0 109.371 178.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -49.03 -83.0 0.02 OUTLIER 'Trans proline' 0 C--O 1.237 0.452 1 C-N-CA 126.925 5.083 . . . . 0.0 114.003 -165.28 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.433 ' HB ' ' CG ' ' B' ' 54' ' ' HIS . 59.8 m -59.6 -32.63 70.57 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 116.652 -1.642 . . . . 0.0 110.89 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . 0.462 ' HE ' ' CG ' ' B' ' 20' ' ' ASP . 23.7 mtm180 -62.27 -42.41 99.31 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 121.136 1.789 . . . . 0.0 114.441 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 6.7 t -52.47 -47.84 66.25 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.689 0.757 . . . . 0.0 110.413 173.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.57 -42.47 82.51 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.488 1.115 . . . . 0.0 112.849 175.016 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -53.21 -52.12 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 C-N-CA 126.585 1.954 . . . . 0.0 110.263 176.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 25.4 mt -54.73 -37.34 65.77 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 123.556 0.742 . . . . 0.0 112.167 -172.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -64.03 -22.15 30.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 118.928 0.785 . . . . 0.0 112.821 178.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.14 -5.11 59.19 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.031 1.332 . . . . 0.0 114.286 173.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -106.8 -19.57 13.6 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 124.867 1.267 . . . . 0.0 113.562 170.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.24 -48.06 77.25 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 127.191 2.197 . . . . 0.0 108.953 164.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -135.12 93.56 3.01 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 128.324 2.649 . . . . 0.0 108.462 175.096 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . 161.86 -92.73 0.11 Allowed Glycine 0 N--CA 1.468 0.773 0 C-N-CA 124.552 1.073 . . . . 0.0 112.145 173.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 4.0 m 51.4 35.86 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 2.7 m -81.8 -66.88 0.83 Allowed 'General case' 0 C--O 1.223 -0.336 0 O-C-N 121.185 -0.947 . . . . 0.0 111.694 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -147.98 157.17 43.71 Favored Pre-proline 0 CA--C 1.537 0.465 0 CA-C-O 117.738 -1.125 . . . . 0.0 110.685 -174.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -59.1 -14.25 22.77 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 123.299 2.666 . . . . 0.0 114.599 171.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -93.89 -14.3 52.61 Favored Glycine 0 CA--C 1.535 1.336 0 CA-C-O 118.242 -1.31 . . . . 0.0 115.465 170.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.65 -34.13 73.57 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.262 2.031 . . . . 0.0 112.108 -170.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.566 ' H ' HD11 ' B' ' 40' ' ' LEU . 0.2 OUTLIER -66.81 -19.01 65.66 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 123.75 0.82 . . . . 0.0 110.511 -172.984 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.52 -37.32 80.78 Favored 'General case' 0 CA--C 1.547 0.833 0 O-C-N 120.891 -1.131 . . . . 0.0 112.174 -177.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.04 -46.83 27.3 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.168 0.587 . . . . 0.0 111.361 171.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -58.72 -32.31 69.08 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -176.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 69.2 mt -98.93 -20.24 16.9 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 127.128 2.171 . . . . 0.0 112.674 -177.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.4 13.52 77.22 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 124.807 1.194 . . . . 0.0 112.964 -170.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 76.3 mt -118.69 151.36 38.12 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 118.229 1.014 . . . . 0.0 111.96 -169.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.8 p -62.89 145.53 54.94 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.497 -0.752 . . . . 0.0 109.783 -173.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -61.39 -17.39 53.9 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 176.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 6.0 m -73.42 -47.94 37.8 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.212 1.005 . . . . 0.0 111.68 169.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -66.17 -45.42 80.94 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.756 0.822 . . . . 0.0 111.134 175.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 5.3 t -58.3 -40.02 76.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 117.929 -1.034 . . . . 0.0 112.218 171.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 67.8 m -67.34 -41.04 85.85 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 121.005 1.729 . . . . 0.0 112.676 174.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -57.99 -47.65 82.35 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.488 0.715 . . . . 0.0 111.218 177.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . 0.433 ' CG ' ' HB ' ' B' ' 22' ' ' THR . 79.0 m-70 -75.75 -26.11 57.13 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 121.262 -0.899 . . . . 0.0 113.329 175.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 38.3 mt -66.07 -29.43 69.77 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 121.077 1.762 . . . . 0.0 111.193 167.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.2 t -51.33 -57.93 7.56 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.593 1.088 . . . . 0.0 113.375 -172.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 34.2 t -79.69 -9.79 59.69 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 123.542 0.737 . . . . 0.0 112.672 172.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.2 tp -67.03 -37.57 84.36 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 121.965 2.166 . . . . 0.0 109.063 167.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 22.6 mtp-105 -82.2 -7.28 59.62 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.08 2.152 . . . . 0.0 111.429 174.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -91.14 -64.35 1.18 Allowed Glycine 0 C--N 1.342 0.863 0 C-N-CA 125.936 1.732 . . . . 0.0 111.358 173.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 67.8 m -61.1 13.79 0.01 OUTLIER 'General case' 0 CA--C 1.563 1.472 0 C-N-CA 128.227 2.611 . . . . 0.0 115.238 172.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.06 -2.36 6.97 Favored Glycine 0 N--CA 1.474 1.216 0 C-N-CA 126.439 1.971 . . . . 0.0 115.836 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 52.7 mt -59.27 -28.26 66.57 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.845 1.658 . . . . 0.0 113.8 -175.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -129.46 137.32 57.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 125.243 1.417 . . . . 0.0 112.636 172.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 75.1 t -116.0 136.75 51.91 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 C-N-CA 126.289 1.836 . . . . 0.0 109.566 171.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.68 145.56 28.71 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 122.192 0.996 . . . . 0.0 112.457 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 41.1 m -158.68 159.44 35.32 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 126.048 1.739 . . . . 0.0 107.206 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -83.63 144.2 29.59 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 119.481 1.037 . . . . 0.0 111.771 170.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.269 2.6 pp20? -88.39 -141.48 0.13 Allowed 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 165.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -69.82 -23.09 77.06 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 121.636 2.016 . . . . 0.0 114.572 177.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.72 -30.12 0.07 Allowed 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 -89.36 171.92 9.4 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 126.826 2.05 . . . . 0.0 112.068 174.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 19.7 m -96.13 150.21 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.315 0.646 . . . . 0.0 109.742 167.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -137.57 163.54 30.94 Favored 'General case' 0 CA--C 1.521 -0.139 0 C-N-CA 125.73 1.612 . . . . 0.0 110.935 -171.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -119.54 127.83 53.37 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 125.238 1.415 . . . . 0.0 109.187 174.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -141.15 156.06 46.0 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.348 1.459 . . . . 0.0 110.971 -175.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 61.8 mt -63.85 148.38 49.5 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.155 0.502 . . . . 0.0 111.751 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.0 -28.07 62.16 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 -173.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -167.16 160.12 13.52 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.06 1.344 . . . . 0.0 111.715 -178.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 94.6 p -41.7 -35.91 0.87 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 128.134 2.574 . . . . 0.0 113.448 167.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -48.38 -54.76 12.79 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 126.08 1.752 . . . . 0.0 112.784 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 7.5 mt -75.32 -47.07 29.49 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.629 -0.7 . . . . 0.0 109.474 -177.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.42 -36.08 53.45 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.103 0.961 . . . . 0.0 113.026 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -76.03 -56.13 4.95 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.888 1.275 . . . . 0.0 111.865 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.81 -28.96 66.49 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 176.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 61.1 tp -77.64 -37.5 49.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.426 1.89 . . . . 0.0 112.524 171.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -80.95 -42.37 9.69 Favored Glycine 0 N--CA 1.469 0.837 0 C-N-CA 126.035 1.779 . . . . 0.0 113.915 -169.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -80.69 -23.74 39.35 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 117.967 0.884 . . . . 0.0 111.372 168.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . 0.541 ' C ' ' H ' ' B' ' 91' ' ' GLN . 19.8 tp 68.76 160.71 0.19 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 129.464 3.106 . . . . 0.0 111.398 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 17.8 m -58.92 12.22 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 125.857 1.663 . . . . 0.0 114.087 167.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.541 ' H ' ' C ' ' B' ' 89' ' ' LEU . 18.7 mm-40 73.82 -17.75 0.43 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 126.146 1.778 . . . . 0.0 114.229 168.63 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 1.6 p -59.49 20.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 C-N-CA 128.187 2.595 . . . . 0.0 116.863 177.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . 0.422 ' H ' ' C ' ' B' ' 91' ' ' GLN . 1.4 t 65.87 23.45 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 C-N-CA 125.373 1.469 . . . . 0.0 113.656 165.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 tt 79.34 92.56 0.06 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 127.47 2.308 . . . . 0.0 110.203 -176.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.68 130.07 42.75 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 178.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -84.94 148.64 4.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.755 1.222 . . . . 0.0 111.174 168.605 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . 0.428 ' C ' ' HG1' ' B' ' 98' ' ' THR . 28.1 t0 -79.96 151.38 30.08 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.106 0.962 . . . . 0.0 109.476 166.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' THR . . . . . 0.428 ' HG1' ' C ' ' B' ' 97' ' ' ASP . 0.2 OUTLIER -174.31 144.31 0.92 Allowed 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.832 1.653 . . . . 0.0 109.225 -171.089 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 7.0 p30 -79.96 -22.54 42.47 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 130.465 3.506 . . . . 0.0 112.946 171.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.28 -176.64 0.26 Allowed Pre-proline 0 CA--C 1.556 1.177 0 C-N-CA 126.784 2.033 . . . . 0.0 113.596 -176.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -76.19 151.67 34.56 Favored 'Trans proline' 0 C--N 1.352 0.753 0 CA-C-N 122.505 1.93 . . . . 0.0 111.383 177.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 26.4 p -44.77 -56.18 4.7 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-O 123.534 1.635 . . . . 0.0 107.998 166.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -176.33 -57.85 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.593 1 C-N-CA 132.459 4.304 . . . . 0.0 107.396 169.637 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -88.96 50.85 2.03 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.082 1.353 . . . . 0.0 113.367 178.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -135.71 -173.47 3.37 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.026 1.73 . . . . 0.0 107.907 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . 0.268 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.017 0 O-C-N 119.468 -2.02 . . . . 0.0 115.524 175.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.619 0 CA-C-O 120.813 0.339 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.472 ' H ' HD11 ' A' ' 11' ' ' LEU . 5.4 mp -47.4 -56.41 6.98 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 126.886 2.075 . . . . 0.0 113.199 -169.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.21 -34.38 76.35 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.173 -0.955 . . . . 0.0 112.356 178.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -58.27 -31.48 67.48 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 120.983 -1.073 . . . . 0.0 112.893 -176.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -49.57 -58.08 5.9 Favored 'General case' 0 C--O 1.225 -0.228 0 C-N-CA 126.119 1.768 . . . . 0.0 110.576 173.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -61.3 -35.01 90.29 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-N 118.77 0.714 . . . . 0.0 112.186 -173.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.8 -50.42 62.69 Favored 'General case' 0 C--O 1.221 -0.434 0 C-N-CA 124.043 0.937 . . . . 0.0 110.538 173.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.99 -22.93 64.98 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -177.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -88.19 -24.76 23.21 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 119.107 0.867 . . . . 0.0 112.133 170.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.45 31.74 1.48 Allowed 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.652 1.581 . . . . 0.0 112.574 167.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.56 167.29 21.28 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 125.528 1.531 . . . . 0.0 107.407 167.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.76 -105.9 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 123.975 3.117 . . . . 0.0 109.997 174.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.7 m -63.85 -14.76 55.87 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.626 1.57 . . . . 0.0 113.078 -178.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.75 -37.86 87.53 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 120.285 1.402 . . . . 0.0 111.765 169.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 19.8 t -64.93 -40.18 94.64 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 118.901 0.773 . . . . 0.0 110.593 172.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 13.5 mmp_? -59.69 -51.4 69.96 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.941 0.896 . . . . 0.0 112.77 172.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.3 mm -47.7 -57.16 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 124.279 1.032 . . . . 0.0 110.835 170.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 86.9 mt -60.8 -50.4 73.62 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.022 0.828 . . . . 0.0 112.092 -176.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.4 p -72.12 -27.07 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -174.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.3 -26.23 28.7 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.358 0.663 . . . . 0.0 112.685 173.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.8 mt -63.2 -41.76 99.21 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 117.879 -1.057 . . . . 0.0 112.154 170.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -40.13 -51.89 2.6 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.93 2.492 . . . . 0.0 114.492 -177.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -97.8 -16.08 19.99 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.613 1.565 . . . . 0.0 112.459 173.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.52 ' HA3' ' HE2' ' A' ' 43' ' ' HIS . . . -77.09 -46.9 9.75 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 125.388 1.471 . . . . 0.0 115.069 -174.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 15.9 m 3.48 58.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 131.245 3.818 . . . . 0.0 118.603 -178.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 55.6 m -118.65 -57.86 2.01 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.517 1.927 . . . . 0.0 111.669 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -149.02 148.77 28.16 Favored Pre-proline 0 N--CA 1.474 0.728 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -171.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -55.53 -45.34 40.4 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 122.7 2.266 . . . . 0.0 112.406 172.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -74.89 -6.55 78.86 Favored Glycine 0 CA--C 1.532 1.14 0 CA-C-O 118.836 -0.98 . . . . 0.0 114.541 178.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -65.42 -33.74 76.66 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.159 1.48 . . . . 0.0 111.875 -175.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mt -64.39 -6.97 8.18 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 123.443 0.697 . . . . 0.0 112.043 -175.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.84 -39.96 95.47 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 122.638 0.375 . . . . 0.0 110.462 172.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.77 -38.85 62.07 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.608 0.763 . . . . 0.0 111.59 171.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.52 ' HE2' ' HA3' ' A' ' 33' ' ' GLY . 2.4 m-70 -61.63 -23.73 66.24 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 177.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 69.0 mt -119.81 -16.3 8.75 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.076 1.35 . . . . 0.0 113.941 -173.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.78 10.31 67.4 Favored Glycine 0 CA--C 1.537 1.423 0 CA-C-N 118.99 0.814 . . . . 0.0 112.925 -168.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 79.4 mt -104.86 158.26 16.65 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.574 1.187 . . . . 0.0 112.98 -171.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.2 t -66.4 153.37 42.96 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 122.103 0.954 . . . . 0.0 111.374 176.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -54.59 -22.47 13.45 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.348 1.459 . . . . 0.0 113.424 173.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.6 t -67.39 -56.71 8.57 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.336 0.971 . . . . 0.0 111.293 169.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -62.69 -37.58 87.02 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.47 1.108 . . . . 0.0 112.151 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.8 t -58.16 -50.0 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 123.557 0.743 . . . . 0.0 111.024 169.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.4 m -63.34 -34.09 76.95 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 177.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -57.43 -52.63 64.59 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.722 1.609 . . . . 0.0 110.651 -178.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 49.1 m-70 -76.98 -19.0 57.85 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.343 1.238 . . . . 0.0 114.343 175.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 41.7 mt -76.05 -22.14 56.01 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 120.402 1.456 . . . . 0.0 112.845 169.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 88.9 p -52.2 -64.13 0.92 Allowed 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 120.648 1.567 . . . . 0.0 113.48 -175.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 51.0 t -64.69 -39.62 93.97 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.404 1.082 . . . . 0.0 110.785 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.5 tp -48.02 -40.65 23.41 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.673 1.589 . . . . 0.0 113.761 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 -88.1 -17.0 31.99 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.928 1.291 . . . . 0.0 113.3 -175.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -93.3 -45.55 3.49 Favored Glycine 0 N--CA 1.477 1.4 0 C-N-CA 125.248 1.404 . . . . 0.0 111.959 175.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 55.5 m -75.23 7.58 3.32 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 127.151 2.181 . . . . 0.0 112.866 170.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 66.1 6.28 31.42 Favored Glycine 0 N--CA 1.468 0.827 0 C-N-CA 126.019 1.771 . . . . 0.0 117.083 169.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 47.2 mt -61.37 -19.95 62.45 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.4 1.6 . . . . 0.0 113.384 178.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.1 m -132.47 147.26 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 127.333 2.253 . . . . 0.0 111.862 169.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 82.8 t -128.82 137.37 57.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 126.791 2.036 . . . . 0.0 109.616 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.19 172.82 11.08 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 123.126 1.441 . . . . 0.0 114.346 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.7 m -160.72 149.16 16.37 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.92 1.288 . . . . 0.0 108.514 177.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -98.63 114.25 26.64 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.692 1.133 . . . . 0.0 110.869 168.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -93.52 34.36 1.18 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.144 1.778 . . . . 0.0 113.428 -173.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.33 -17.35 1.08 Allowed Glycine 0 CA--C 1.536 1.363 0 O-C-N 120.209 -1.557 . . . . 0.0 115.254 174.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -145.26 -17.09 0.49 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.28 1.432 . . . . 0.0 113.773 -178.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -152.61 -178.98 7.2 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 127.944 2.498 . . . . 0.0 107.105 175.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 16.3 m -108.85 155.48 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 123.785 0.834 . . . . 0.0 109.212 168.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.2 ptt180 -122.95 175.21 6.7 Favored 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 124.76 1.224 . . . . 0.0 111.092 176.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -130.76 118.66 21.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.094 -1.412 . . . . 0.0 107.914 168.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -108.92 156.97 19.08 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 125.07 1.348 . . . . 0.0 109.396 174.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.2 tp -54.99 152.27 7.76 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.048 1.339 . . . . 0.0 111.377 172.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -45.54 -48.35 14.27 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.514 1.302 . . . . 0.0 114.514 -171.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -171.87 -179.96 2.57 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.122 0.963 . . . . 0.0 111.308 -176.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.6 p -42.78 -39.23 2.39 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.441 1.896 . . . . 0.0 112.309 167.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -54.19 -57.08 12.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.469 1.507 . . . . 0.0 113.262 177.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 18.4 mt -74.61 -34.87 62.92 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.9 1.227 . . . . 0.0 110.626 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.39 -21.92 66.73 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.457 0.571 . . . . 0.0 112.329 -178.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -81.58 -74.28 0.34 Allowed 'General case' 0 C--O 1.219 -0.515 0 CA-C-O 116.753 -1.594 . . . . 0.0 111.278 166.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.04 -21.91 66.71 Favored 'General case' 0 CA--C 1.555 1.168 0 CA-C-N 123.06 2.663 . . . . 0.0 115.974 -169.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.69 -42.62 50.57 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 120.553 1.524 . . . . 0.0 109.702 167.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -66.26 -32.32 81.74 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 127.912 2.672 . . . . 0.0 115.6 179.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.32 -27.25 62.04 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 126.85 2.06 . . . . 0.0 112.416 169.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 28.6 tp 71.29 97.95 0.07 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 128.408 2.683 . . . . 0.0 108.909 -170.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 33.6 m -51.62 11.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 129.414 3.086 . . . . 0.0 118.418 -176.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.5 mm-40 80.64 -28.58 0.13 Allowed 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 119.749 -1.844 . . . . 0.0 113.464 157.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.9 p -62.12 43.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 C-N-CA 128.755 2.822 . . . . 0.0 115.691 176.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 67.32 6.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 C-N-CA 127.609 2.364 . . . . 0.0 113.058 177.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.8 tt 71.97 93.71 0.08 Allowed 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 127.731 2.412 . . . . 0.0 107.414 -168.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.49 123.23 14.04 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.108 0.563 . . . . 0.0 112.326 -173.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 29.0 t -63.55 164.78 1.38 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 126.19 1.796 . . . . 0.0 110.149 169.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.88 19.27 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 126.098 1.759 . . . . 0.0 113.905 172.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 16.3 p -109.39 131.58 54.93 Favored 'General case' 0 CA--C 1.516 -0.352 0 O-C-N 120.124 -1.61 . . . . 0.0 114.268 -173.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -87.89 131.31 34.62 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 105.81 -1.922 . . . . 0.0 105.81 162.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -132.84 137.88 30.66 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 105.675 -1.972 . . . . 0.0 105.675 -174.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -73.6 179.37 5.65 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 124.682 3.588 . . . . 0.0 113.367 -168.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.08 138.19 58.16 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-O 121.595 0.712 . . . . 0.0 111.178 178.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 21.3 t -68.23 -25.6 32.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 O-C-N 121.748 -0.595 . . . . 0.0 111.566 -171.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -86.47 -21.61 26.93 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 170.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -149.01 106.23 3.62 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.213 1.005 . . . . 0.0 111.542 -169.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.552 1.05 0 C-N-CA 126.356 1.862 . . . . 0.0 115.68 -170.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.013 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 29.3 mt -46.31 -66.05 0.46 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 128.819 2.848 . . . . 0.0 112.469 -169.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.31 -37.69 68.89 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 122.833 0.453 . . . . 0.0 112.166 173.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.33 -30.19 62.27 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -176.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -46.4 -60.93 2.04 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 127.199 2.2 . . . . 0.0 110.015 169.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.13 -21.96 70.36 Favored Glycine 0 C--N 1.338 0.684 0 CA-C-O 118.806 -0.997 . . . . 0.0 112.842 -172.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -53.81 8.79 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.388 1.094 . . . . 0.0 110.171 169.089 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.98 -22.77 65.9 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -174.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -87.97 -19.38 27.3 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.369 0.986 . . . . 0.0 112.093 169.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -82.31 63.65 6.59 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.009 1.324 . . . . 0.0 110.097 171.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.5 166.88 20.13 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 125.033 1.333 . . . . 0.0 112.73 -168.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -71.64 -116.82 0.01 OUTLIER 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 124.671 3.581 . . . . 0.0 107.781 165.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 42.4 p -60.19 -22.18 62.64 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 -173.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 4.5 ttp180 -61.57 -36.24 80.08 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 121.635 2.016 . . . . 0.0 112.23 174.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 48.7 t -69.25 -41.74 76.54 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.027 0.83 . . . . 0.0 111.577 168.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 17.1 mmp_? -58.97 -52.44 65.73 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.372 0.669 . . . . 0.0 112.075 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 18.3 mm -42.78 -56.16 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 125.837 1.655 . . . . 0.0 109.832 172.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 94.6 mt -62.71 -45.53 92.33 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 118.983 -0.532 . . . . 0.0 112.422 -175.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 8.4 p -74.24 -28.05 22.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -178.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.8 -25.75 27.96 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 175.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 9.0 mt -62.23 -43.05 99.72 Favored 'General case' 0 CA--C 1.52 -0.178 0 O-C-N 121.28 -0.888 . . . . 0.0 111.977 172.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -41.65 -45.18 3.34 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 129.137 2.975 . . . . 0.0 115.092 -174.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -117.35 13.17 14.48 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 126.059 1.744 . . . . 0.0 112.658 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.69 -69.34 0.77 Allowed Glycine 0 N--CA 1.472 1.093 0 C-N-CA 127.321 2.391 . . . . 0.0 112.806 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 29.43 41.13 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 128.599 2.76 . . . . 0.0 117.201 -177.623 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 94.2 m -84.07 -79.31 0.21 Allowed 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 125.443 1.497 . . . . 0.0 110.208 173.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.36 158.35 51.17 Favored Pre-proline 0 N--CA 1.482 1.143 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 -168.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.08 -34.69 93.39 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 123.162 2.574 . . . . 0.0 113.519 176.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -76.92 -12.43 84.61 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-O 118.419 -1.212 . . . . 0.0 113.916 175.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.12 -31.15 72.2 Favored 'General case' 0 C--N 1.348 0.502 0 CA-C-N 120.076 1.938 . . . . 0.0 112.424 -170.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.1 mt -69.06 -7.34 34.88 Favored 'General case' 0 C--N 1.342 0.258 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -175.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.0 -39.06 80.7 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 118.422 0.555 . . . . 0.0 110.651 169.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.79 -43.93 57.41 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.62 0.768 . . . . 0.0 111.867 172.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 5.4 m-70 -59.13 -27.1 65.3 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 67.9 mt -111.83 -16.59 13.13 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.983 1.713 . . . . 0.0 113.533 -177.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.09 15.26 69.45 Favored Glycine 0 CA--C 1.536 1.367 0 CA-C-N 118.757 0.708 . . . . 0.0 112.708 -168.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 86.4 mt -108.76 171.04 7.66 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.753 1.276 . . . . 0.0 113.453 -173.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.9 t -69.98 151.09 45.99 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 122.026 0.917 . . . . 0.0 111.149 169.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -54.45 -18.92 4.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.686 1.594 . . . . 0.0 113.553 168.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 11.7 t -68.05 -58.62 4.2 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.066 0.848 . . . . 0.0 111.493 169.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -59.32 -36.73 76.16 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.452 -0.78 . . . . 0.0 112.531 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 42.1 t -57.83 -50.29 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 123.419 0.688 . . . . 0.0 111.027 170.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 41.2 m -68.7 -31.82 71.18 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -178.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 32.4 t-20 -57.43 -62.0 2.09 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.212 1.405 . . . . 0.0 109.806 178.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 -68.13 -24.53 65.02 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 121.034 -1.041 . . . . 0.0 112.876 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 73.7 mt -69.97 -19.19 63.37 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 119.711 1.141 . . . . 0.0 113.76 170.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 89.3 p -58.16 -48.17 81.11 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 121.075 1.761 . . . . 0.0 111.892 174.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 51.7 t -68.89 -46.23 68.91 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.566 0.621 . . . . 0.0 111.034 175.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 2.9 tp -57.52 -36.83 72.08 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.307 1.043 . . . . 0.0 113.357 -171.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -90.13 -16.38 29.7 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.242 1.417 . . . . 0.0 112.867 178.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -79.97 -51.71 4.95 Favored Glycine 0 N--CA 1.472 1.06 0 CA-C-N 119.38 0.991 . . . . 0.0 111.135 170.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 83.4 m -74.44 3.19 7.91 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 126.913 2.085 . . . . 0.0 113.903 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.53 3.95 50.24 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.006 1.288 . . . . 0.0 115.446 169.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 84.5 mt -57.85 -23.81 54.59 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.496 1.648 . . . . 0.0 112.619 176.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.8 m -126.73 147.6 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 126.742 2.017 . . . . 0.0 111.662 168.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 65.8 t -136.05 132.99 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 126.838 2.055 . . . . 0.0 109.589 -176.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.75 157.82 27.04 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.832 1.653 . . . . 0.0 113.488 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 15.7 m -165.29 140.73 5.22 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.547 1.539 . . . . 0.0 108.072 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -63.83 122.29 16.08 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.814 0.734 . . . . 0.0 111.479 172.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . 0.431 ' CD ' ' H ' ' B' ' 72' ' ' GLN . 5.1 pt-20 -71.99 -21.66 61.54 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -178.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 116.25 4.67 17.92 Favored Glycine 0 CA--C 1.539 1.589 0 C-N-CA 125.52 1.534 . . . . 0.0 113.834 -168.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 29.2 ttm180 -155.5 -53.46 0.09 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.187 1.395 . . . . 0.0 111.493 175.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . 0.431 ' H ' ' CD ' ' B' ' 69' ' ' GLU . 9.4 mm-40 -116.37 -125.04 0.28 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.57 1.548 . . . . 0.0 108.181 167.013 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 11.5 p -149.13 137.07 14.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 126.095 1.758 . . . . 0.0 107.182 -167.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.2 ptt85 -105.04 170.84 7.64 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.967 1.307 . . . . 0.0 109.034 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -129.27 116.14 18.68 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 168.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -108.43 169.18 8.81 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.773 1.229 . . . . 0.0 109.579 175.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 tp -59.88 162.07 5.85 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.987 0.915 . . . . 0.0 111.421 169.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -48.96 -54.42 15.62 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.981 0.912 . . . . 0.0 112.603 176.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -165.97 165.63 17.91 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.708 1.203 . . . . 0.0 110.945 -169.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 92.2 p -40.26 -37.5 0.65 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.615 2.366 . . . . 0.0 112.582 166.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -52.33 -58.45 6.63 Favored 'General case' 0 C--N 1.341 0.231 0 C-N-CA 125.165 1.386 . . . . 0.0 113.762 173.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 13.9 mt -70.36 -32.47 70.17 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.505 1.048 . . . . 0.0 110.011 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.5 -28.33 67.74 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.682 0.793 . . . . 0.0 111.769 -176.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.42 -71.11 0.46 Allowed 'General case' 0 C--O 1.22 -0.461 0 CA-C-O 116.63 -1.652 . . . . 0.0 111.407 168.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.9 -22.91 65.97 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 122.998 2.635 . . . . 0.0 115.253 -170.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.57 -46.55 25.81 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.049 -1.032 . . . . 0.0 110.356 167.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.24 -28.83 74.02 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 126.158 1.837 . . . . 0.0 115.304 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.11 -26.9 67.99 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.673 1.989 . . . . 0.0 112.257 168.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 34.7 tp 70.32 100.11 0.06 Allowed 'General case' 0 C--O 1.232 0.172 0 C-N-CA 128.481 2.712 . . . . 0.0 109.281 -172.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 34.0 m -51.5 11.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 C-N-CA 129.431 3.092 . . . . 0.0 118.247 -178.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.433 ' C ' ' H ' ' B' ' 93' ' ' VAL . 31.0 mm-40 77.84 -18.0 0.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 O-C-N 119.854 -1.779 . . . . 0.0 114.53 159.284 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 4.5 p -66.42 34.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 127.049 2.14 . . . . 0.0 113.452 168.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . 0.433 ' H ' ' C ' ' B' ' 91' ' ' GLN . 2.7 t 69.98 1.07 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.028 0 C-N-CA 127.381 2.273 . . . . 0.0 113.367 169.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 87.53 99.41 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 130.101 3.36 . . . . 0.0 107.135 -174.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.96 100.98 0.05 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.159 0.984 . . . . 0.0 113.137 -173.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 25.2 t -51.97 153.66 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 125.622 1.569 . . . . 0.0 110.205 168.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -66.75 32.17 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 126.907 2.083 . . . . 0.0 114.984 175.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 33.8 p -121.73 111.03 16.66 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.226 1.81 . . . . 0.0 112.815 -174.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -93.95 143.22 26.55 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 165.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -154.97 174.09 4.21 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 124.657 1.183 . . . . 0.0 108.265 -168.483 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -72.29 165.39 32.79 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.175 1.917 . . . . 0.0 112.661 -170.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -70.19 140.72 52.56 Favored 'General case' 0 CA--C 1.552 1.056 0 O-C-N 122.162 -0.336 . . . . 0.0 110.219 178.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 19.2 t -55.29 -22.92 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -166.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -100.6 -16.75 17.35 Favored 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 178.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -143.6 121.77 12.21 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.477 1.035 . . . . 0.0 110.658 -169.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.547 0.864 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -169.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.619 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 pp -65.71 -22.42 66.61 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.112 169.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.94 -56.83 9.69 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 169.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 -53.76 -36.37 62.29 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.369 1.068 . . . . 0.0 113.647 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.25 -64.92 0.75 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.492 1.517 . . . . 0.0 110.404 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.64 -19.18 76.32 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 118.927 -0.929 . . . . 0.0 113.531 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -65.55 -4.09 5.5 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.63 1.715 . . . . 0.0 113.328 174.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.4 -6.73 1.54 Allowed 'General case' 0 CA--C 1.547 0.865 0 CA-C-O 117.116 -1.421 . . . . 0.0 114.3 169.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.88 -31.61 17.25 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 121.394 1.906 . . . . 0.0 110.171 165.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -94.73 76.04 3.69 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.435 1.094 . . . . 0.0 111.913 -177.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.511 ' CG ' ' HE ' ' A' ' 23' ' ' ARG . 1.4 t70 -164.27 140.34 5.0 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 126.62 1.968 . . . . 0.0 111.239 -173.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -51.84 -60.59 0.72 Allowed 'Trans proline' 0 C--N 1.353 0.81 1 C-N-CA 125.463 4.109 . . . . 0.0 112.97 -171.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.415 ' HG1' ' CE1' ' A' ' 54' ' ' HIS . 2.9 m -79.15 -31.36 44.02 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 119.425 -0.321 . . . . 0.0 110.566 -173.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.511 ' HE ' ' CG ' ' A' ' 20' ' ' ASP . 67.1 mtm180 -69.23 -33.56 73.48 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 116.241 -1.838 . . . . 0.0 113.633 -173.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 44.5 t -57.67 -55.21 37.79 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 121.185 1.812 . . . . 0.0 110.29 168.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 44.3 mtt180 -45.2 -45.33 11.63 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.221 1.408 . . . . 0.0 112.998 169.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.5 mt -62.4 -58.41 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 CA-C-N 120.181 1.355 . . . . 0.0 111.156 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.13 -44.86 79.57 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.967 0.907 . . . . 0.0 110.883 -175.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.4 p -79.2 -29.39 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 124.496 1.118 . . . . 0.0 112.374 -174.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.73 -35.11 30.08 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 122.893 0.477 . . . . 0.0 112.022 175.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.2 tp -67.29 -32.14 72.93 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 116.733 -1.603 . . . . 0.0 112.37 172.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -41.67 -45.31 3.39 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.431 1.892 . . . . 0.0 112.579 -178.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -99.9 -26.22 14.08 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.524 1.93 . . . . 0.0 112.724 169.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -83.01 -3.7 90.33 Favored Glycine 0 C--N 1.339 0.74 0 CA-C-O 116.591 -2.227 . . . . 0.0 117.101 -168.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.7 m -29.91 45.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.663 1 C-N-CA 132.087 4.155 . . . . 0.0 120.564 171.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 2.4 t -107.78 -51.88 2.84 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 119.369 -2.082 . . . . 0.0 113.203 -175.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.3 p90 -158.24 157.78 29.34 Favored Pre-proline 0 N--CA 1.477 0.882 0 N-CA-C 115.347 1.61 . . . . 0.0 115.347 -178.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -55.83 128.77 31.67 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.223 1.949 . . . . 0.0 108.214 169.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.69 -3.61 68.36 Favored Glycine 0 CA--C 1.531 1.086 0 CA-C-O 116.639 -2.201 . . . . 0.0 115.413 -176.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.502 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -53.94 -37.3 63.72 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 121.475 2.638 . . . . 0.0 110.841 170.702 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 20.5 mt -53.14 -28.99 28.71 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 127.144 2.178 . . . . 0.0 112.488 176.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.79 -32.62 70.78 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 118.427 0.558 . . . . 0.0 110.89 -179.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.82 -45.62 27.96 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.687 0.795 . . . . 0.0 112.092 174.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.502 ' CD2' HE22 ' A' ' 39' ' ' GLN . 4.8 m-70 -58.8 -32.66 69.54 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 175.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 16.0 mt -102.37 -26.86 13.13 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -173.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.41 1.79 66.1 Favored Glycine 0 CA--C 1.533 1.215 0 CA-C-N 119.503 1.047 . . . . 0.0 113.975 -170.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.9 mp -99.52 147.44 25.31 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.104 0.952 . . . . 0.0 109.663 177.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 70.4 p -59.23 151.95 21.87 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.305 1.442 . . . . 0.0 111.184 -169.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.14 -20.34 57.94 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.308 171.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.3 m -73.62 -55.29 6.48 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.232 -0.918 . . . . 0.0 110.805 169.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -53.08 -56.45 16.11 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.402 1.081 . . . . 0.0 110.898 178.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 69.3 t -65.96 -24.5 34.11 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 O-C-N 120.904 -1.122 . . . . 0.0 112.428 -177.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.7 m -71.05 -36.69 72.42 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 120.54 1.518 . . . . 0.0 113.657 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -52.99 -50.48 64.1 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.675 0.79 . . . . 0.0 110.4 169.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.415 ' CE1' ' HG1' ' A' ' 22' ' ' THR . 38.1 m80 -63.84 -36.06 82.68 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.381 1.073 . . . . 0.0 113.688 178.129 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 21.3 mt -72.51 -31.56 65.44 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 117.841 -1.076 . . . . 0.0 113.533 174.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.89 -46.7 43.08 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.821 1.191 . . . . 0.0 112.876 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 4.0 t -78.9 -35.63 43.28 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-O 121.601 0.715 . . . . 0.0 112.093 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.6 tp -59.61 -38.44 81.29 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.738 1.215 . . . . 0.0 112.332 178.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 45.2 mtm105 -77.47 -30.0 52.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.372 1.069 . . . . 0.0 112.467 177.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.33 -40.39 5.76 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 124.59 1.091 . . . . 0.0 114.769 -173.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 69.9 m -71.6 -9.75 58.71 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 124.116 0.966 . . . . 0.0 111.828 171.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 91.17 20.76 37.67 Favored Glycine 0 C--N 1.344 0.976 0 C-N-CA 125.472 1.511 . . . . 0.0 115.851 168.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.3 mt -86.6 -23.09 25.87 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.622 1.711 . . . . 0.0 114.799 178.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.5 m -127.97 148.49 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 124.728 1.211 . . . . 0.0 111.214 169.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 25.6 t -137.45 148.96 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.383 1.473 . . . . 0.0 109.8 -178.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.97 160.88 30.06 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.262 1.425 . . . . 0.0 113.814 173.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.2 m -163.24 167.8 21.48 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.392 1.877 . . . . 0.0 108.426 173.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -101.68 121.19 41.58 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 165.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.27 -13.25 59.36 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -178.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 133.37 -26.01 3.57 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 125.762 1.648 . . . . 0.0 113.958 173.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 48.5 ttt-85 -132.62 -10.75 3.14 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.395 1.878 . . . . 0.0 112.737 172.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -148.79 160.05 43.57 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.892 2.077 . . . . 0.0 111.304 -177.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 23.4 m -82.91 145.0 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 O-C-N 121.44 -0.787 . . . . 0.0 109.757 168.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.1 ptt180 -131.2 165.62 22.93 Favored 'General case' 0 CA--C 1.518 -0.275 0 C-N-CA 124.769 1.228 . . . . 0.0 110.408 -172.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -107.65 148.64 29.1 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 163.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -147.67 156.97 43.32 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 123.397 0.679 . . . . 0.0 110.146 174.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tp -53.96 144.79 18.06 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 123.542 0.526 . . . . 0.0 110.172 170.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.97 -20.12 64.17 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 116.083 1.883 . . . . 0.0 116.083 -170.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -168.97 164.03 11.47 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.711 1.604 . . . . 0.0 112.367 173.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 50.7 m -51.49 -30.14 18.99 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.845 2.058 . . . . 0.0 112.574 168.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -52.82 -58.24 7.57 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 126.643 1.977 . . . . 0.0 112.334 171.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 19.1 mt -64.21 -44.19 92.7 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 177.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -56.94 -34.3 67.87 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 125.068 1.347 . . . . 0.0 111.444 -175.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.1 ttm-85 -74.22 -57.7 3.78 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 116.685 -1.626 . . . . 0.0 112.092 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.26 -22.91 64.73 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 122.103 2.229 . . . . 0.0 113.33 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 54.5 tp -71.64 -45.52 61.81 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.425 1.89 . . . . 0.0 110.69 168.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.53 -36.24 12.52 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 126.147 1.832 . . . . 0.0 115.088 -171.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -77.91 -5.51 51.32 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.34 1.456 . . . . 0.0 112.777 176.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 25.9 tp 60.79 89.46 0.07 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.657 2.383 . . . . 0.0 113.484 168.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.3 m -41.37 150.42 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 125.194 1.398 . . . . 0.0 112.4 176.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -72.0 2.9 4.94 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 -159.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.7 p -66.45 35.39 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 126.289 1.836 . . . . 0.0 114.221 174.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 61.08 20.01 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 126.396 1.879 . . . . 0.0 113.544 169.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 tt 94.93 106.96 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 129.337 3.055 . . . . 0.0 106.513 -167.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.79 89.5 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.97 0.908 . . . . 0.0 111.667 170.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.0 t -63.43 135.57 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 125.201 1.4 . . . . 0.0 110.266 171.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -62.57 6.26 0.1 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 127.547 2.339 . . . . 0.0 115.065 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.6 138.09 58.09 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 122.307 1.051 . . . . 0.0 110.612 176.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -92.92 153.6 18.69 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 113.438 -1.71 . . . . 0.0 107.595 164.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -161.16 136.17 5.55 Favored Pre-proline 0 N--CA 1.447 -0.575 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 174.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -60.59 165.34 11.64 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 121.331 1.354 . . . . 0.0 109.886 169.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 46.3 t -74.79 -129.79 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.143 0 CA-C-O 122.647 1.213 . . . . 0.0 110.189 170.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 27.4 t 76.19 -45.51 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 128.811 2.844 . . . . 0.0 113.341 168.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . 123.6 1.72 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 131.003 3.721 . . . . 0.0 113.748 177.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.6 -176.82 1.08 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.835 0.854 . . . . 0.0 112.133 174.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.473 0.679 0 C-N-CA 123.91 0.884 . . . . 0.0 109.111 169.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.401 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 pp -70.3 -23.78 62.91 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 176.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.93 -55.27 27.4 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.95 0.9 . . . . 0.0 109.982 169.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 24.5 ttm180 -60.07 -40.13 88.44 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 177.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -53.54 -59.27 4.81 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.451 1.1 . . . . 0.0 110.416 176.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -73.26 -21.1 79.99 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-O 118.739 -1.034 . . . . 0.0 113.689 -177.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.83 -18.11 53.73 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 126.465 1.906 . . . . 0.0 114.179 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -123.83 -7.58 7.87 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 177.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 3.1 mt -87.56 -37.08 17.17 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 119.429 1.013 . . . . 0.0 110.911 167.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.6 77.45 5.67 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.647 1.179 . . . . 0.0 111.676 -177.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -163.78 139.16 4.97 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 125.219 1.408 . . . . 0.0 111.598 -171.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -51.46 -50.26 14.5 Favored 'Trans proline' 0 C--N 1.353 0.8 1 C-N-CA 125.677 4.251 . . . . 0.0 114.117 -172.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 45.7 m -91.83 -32.96 15.14 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 119.394 -0.336 . . . . 0.0 110.52 -172.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 74.1 mtm180 -68.74 -34.21 75.22 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 116.571 -1.68 . . . . 0.0 112.691 -177.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 45.9 t -55.13 -55.51 30.32 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 120.755 1.616 . . . . 0.0 110.637 168.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -48.07 -52.27 20.96 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.126 1.37 . . . . 0.0 112.47 172.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.5 mt -51.12 -58.83 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 CA-C-N 119.424 1.011 . . . . 0.0 111.234 174.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 93.4 mt -63.37 -41.84 98.82 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.222 1.009 . . . . 0.0 111.176 -169.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.7 p -75.98 -26.72 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.226 0.611 . . . . 0.0 112.399 178.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.61 -39.09 67.56 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 118.793 -0.622 . . . . 0.0 111.039 169.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 2.1 tp -65.32 -26.62 68.13 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 -176.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 7.8 mt -45.95 -26.51 0.72 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 125.959 1.704 . . . . 0.0 112.205 168.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -113.64 -31.65 6.42 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 127.658 2.383 . . . . 0.0 111.522 167.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . 0.423 ' C ' ' H ' ' B' ' 35' ' ' CYS . . . -82.51 15.57 29.26 Favored Glycine 0 C--N 1.335 0.477 0 C-N-CA 129.775 3.559 . . . . 0.0 115.204 -166.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 26.1 m -60.15 28.75 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.038 0 C-N-CA 126.111 1.765 . . . . 0.0 115.565 167.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . 0.423 ' H ' ' C ' ' B' ' 33' ' ' GLY . 0.0 OUTLIER -85.6 -73.11 0.46 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.434 1.494 . . . . 0.0 111.528 179.944 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -159.07 157.35 27.86 Favored Pre-proline 0 N--CA 1.474 0.726 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -169.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -57.29 121.27 9.76 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.628 2.218 . . . . 0.0 109.046 173.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.91 -5.66 83.2 Favored Glycine 0 CA--C 1.531 1.071 0 CA-C-O 117.572 -1.682 . . . . 0.0 115.024 -175.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . 0.556 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -57.67 -35.11 70.13 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 120.942 2.371 . . . . 0.0 111.402 172.114 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 23.0 mt -56.96 -25.33 57.69 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 125.216 1.406 . . . . 0.0 111.928 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.85 -32.75 73.12 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 121.883 -0.51 . . . . 0.0 111.461 -174.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.11 -49.12 18.26 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.486 0.714 . . . . 0.0 111.543 172.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . 0.556 ' CD2' HE22 ' B' ' 39' ' ' GLN . 2.8 m-70 -56.18 -32.92 64.78 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.217 1.191 . . . . 0.0 114.217 178.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 14.1 mt -104.02 -23.87 13.28 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.624 1.17 . . . . 0.0 113.118 -173.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.18 -6.67 49.24 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.533 1.063 . . . . 0.0 114.1 -171.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 10.6 mp -93.19 156.39 16.87 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.44 1.096 . . . . 0.0 109.539 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 71.2 p -71.91 154.7 41.05 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 122.448 1.118 . . . . 0.0 111.745 -170.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 -56.68 -25.34 53.68 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.099 169.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 15.3 m -71.82 -58.28 3.6 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.657 1.183 . . . . 0.0 110.633 169.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -53.27 -58.12 8.17 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.831 1.252 . . . . 0.0 111.676 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 88.7 t -63.33 -22.09 29.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 121.363 -0.836 . . . . 0.0 111.575 -175.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 50.1 m -68.69 -36.32 78.33 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 119.87 1.213 . . . . 0.0 113.93 178.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -56.72 -47.14 80.63 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.98 0.809 . . . . 0.0 111.61 169.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -63.69 -32.24 73.66 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.092 0.957 . . . . 0.0 112.621 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 43.4 mt -75.87 -32.92 59.93 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.084 1.354 . . . . 0.0 113.628 172.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 19.4 m -54.61 -39.02 67.47 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 120.292 1.405 . . . . 0.0 113.323 177.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 42.1 t -69.18 -47.86 63.76 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.524 1.056 . . . . 0.0 112.132 171.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.3 tp -58.25 -37.82 75.67 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.359 1.464 . . . . 0.0 112.0 -171.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 34.3 mtm105 -83.12 -7.03 59.69 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.842 1.657 . . . . 0.0 113.774 178.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -106.6 -37.95 2.32 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 125.558 1.551 . . . . 0.0 114.414 177.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 22.5 m -73.75 -13.54 60.97 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 124.928 1.291 . . . . 0.0 112.288 172.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.33 20.14 42.89 Favored Glycine 0 C--N 1.341 0.837 0 CA-C-O 118.355 -1.247 . . . . 0.0 114.572 172.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.05 -24.09 30.6 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 119.626 1.713 . . . . 0.0 113.825 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 3.5 m -127.72 147.28 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 124.336 1.054 . . . . 0.0 113.003 171.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 24.2 t -130.0 143.05 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.373 1.869 . . . . 0.0 110.808 -176.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.02 152.34 27.98 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.787 1.635 . . . . 0.0 112.936 174.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.9 m -161.02 172.26 17.2 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.393 1.477 . . . . 0.0 109.075 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -100.99 126.05 47.63 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 165.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.34 -14.38 59.02 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 177.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 136.12 -26.77 3.08 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 126.201 1.858 . . . . 0.0 114.0 175.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 51.5 ttt-85 -136.42 -6.9 1.99 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.809 2.044 . . . . 0.0 112.977 174.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -150.36 160.23 43.88 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.17 2.188 . . . . 0.0 110.749 -178.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 33.6 m -82.4 148.02 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 O-C-N 121.509 -0.745 . . . . 0.0 110.565 169.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 3.0 ptt180 -132.52 167.99 19.02 Favored 'General case' 0 C--O 1.231 0.116 0 C-N-CA 125.43 1.492 . . . . 0.0 110.745 -171.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -112.16 160.58 17.44 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 164.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -160.28 150.61 18.37 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 120.742 -1.224 . . . . 0.0 111.257 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -49.94 129.65 20.71 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 169.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.23 0.41 2.8 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 -168.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -179.61 161.74 1.05 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 128.123 2.569 . . . . 0.0 110.644 169.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 43.4 m -48.35 -29.99 4.49 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.573 1.549 . . . . 0.0 111.797 168.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -49.08 -53.78 18.96 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 126.226 1.811 . . . . 0.0 113.526 171.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 13.3 mt -79.45 -41.41 27.62 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.919 -0.562 . . . . 0.0 109.818 -175.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.9 -36.11 59.03 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.033 0.533 . . . . 0.0 111.952 170.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 34.5 ttm-85 -75.93 -61.04 2.06 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-O 116.719 -1.61 . . . . 0.0 112.836 174.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.04 -20.74 66.28 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 122.5 2.409 . . . . 0.0 113.384 -176.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.15 -53.54 8.14 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.672 -0.643 . . . . 0.0 109.28 166.657 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.98 -28.36 70.65 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.374 1.464 . . . . 0.0 115.574 -171.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -78.38 -6.76 56.12 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.681 1.24 . . . . 0.0 112.051 169.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 30.6 tp 60.67 86.36 0.1 Allowed 'General case' 0 C--N 1.345 0.394 0 C-N-CA 127.623 2.369 . . . . 0.0 113.565 167.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.2 m -43.36 147.59 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 CA-C-O 122.667 1.222 . . . . 0.0 112.986 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.474 ' C ' ' H ' ' B' ' 93' ' ' VAL . 20.1 mm-40 -68.54 6.62 0.78 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 117.021 2.23 . . . . 0.0 117.021 -163.054 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 6.1 p -66.28 32.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 126.476 1.911 . . . . 0.0 113.243 169.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . 0.474 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.4 OUTLIER 63.16 11.63 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 128.6 2.76 . . . . 0.0 114.359 171.499 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.6 tt 102.05 107.62 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 130.519 3.528 . . . . 0.0 105.35 -167.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.11 84.28 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.617 1.167 . . . . 0.0 111.812 174.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 4.5 t -55.86 133.15 19.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.138 0.975 . . . . 0.0 109.618 174.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -60.67 12.06 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 127.732 2.413 . . . . 0.0 115.578 176.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 29.8 p -67.27 135.89 54.07 Favored 'General case' 0 CA--C 1.519 -0.241 0 O-C-N 121.157 -0.964 . . . . 0.0 110.654 173.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -99.56 136.02 40.11 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 166.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.57 139.67 10.92 Favored Pre-proline 0 C--N 1.32 -0.702 0 N-CA-C 104.318 -2.475 . . . . 0.0 104.318 173.328 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -73.88 -173.12 1.28 Allowed 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.469 2.113 . . . . 0.0 112.059 -169.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 6.5 t -87.92 -161.51 0.73 Allowed 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 124.44 1.096 . . . . 0.0 111.695 177.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.6 t 62.58 32.99 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 125.434 1.494 . . . . 0.0 111.88 169.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . 71.38 -15.43 0.42 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 118.029 2.603 . . . . 0.0 118.029 169.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.55 179.74 0.15 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.306 1.842 . . . . 0.0 115.182 -170.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.472 0.641 0 O-C-N 121.307 -0.87 . . . . 0.0 111.556 170.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.616 0 CA-C-O 119.378 -0.344 . . . . 0.0 110.893 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.569 HD22 ' H ' ' A' ' 12' ' ' ALA . 1.1 pt? -51.67 -49.67 61.91 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 -169.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.569 ' H ' HD22 ' A' ' 11' ' ' LEU . . . -67.25 -18.72 65.34 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.661 1.584 . . . . 0.0 113.468 177.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.459 HH11 ' HG2' ' A' ' 13' ' ' ARG . 0.2 OUTLIER -86.11 -42.81 13.58 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.052 0.842 . . . . 0.0 109.421 167.738 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.55 -46.41 82.94 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.623 1.569 . . . . 0.0 112.25 -171.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.96 -18.39 68.7 Favored Glycine 0 CA--C 1.535 1.333 0 O-C-N 121.182 -0.949 . . . . 0.0 113.073 172.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 81.6 mtp180 -99.16 29.84 3.72 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 127.546 2.339 . . . . 0.0 111.314 170.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.93 -35.47 0.57 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.463 1.905 . . . . 0.0 111.898 169.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mt -95.78 -39.38 9.88 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 178.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -96.26 54.35 1.41 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.656 1.116 . . . . 0.0 109.54 170.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -132.42 138.28 31.82 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 126.933 2.093 . . . . 0.0 108.202 -168.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -52.61 -98.35 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.809 1 C-N-CA 126.66 4.907 . . . . 0.0 115.789 -164.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.95 -27.82 63.76 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 125.571 1.548 . . . . 0.0 111.799 175.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.39 -36.04 63.5 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -174.169 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 14.1 t -65.85 -38.0 87.7 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.519 -1.363 . . . . 0.0 109.921 167.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -57.52 -38.55 74.84 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.056 0.942 . . . . 0.0 112.964 169.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.9 mm -62.11 -49.52 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 O-C-N 120.717 -1.24 . . . . 0.0 110.997 170.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.4 mt -58.61 -48.46 80.9 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.246 0.475 . . . . 0.0 112.157 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.2 p -68.51 -20.39 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 118.986 0.812 . . . . 0.0 112.782 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.51 -16.84 60.24 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.351 1.061 . . . . 0.0 113.069 171.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.39 -13.55 27.91 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 170.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.92 -20.92 64.3 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.211 163.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -116.99 -60.39 1.85 Allowed 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 127.456 2.302 . . . . 0.0 115.205 -177.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.37 -83.05 0.43 Allowed Glycine 0 C--N 1.343 0.948 0 C-N-CA 124.989 1.281 . . . . 0.0 114.313 -165.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.8 m 49.58 30.96 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 125.288 1.435 . . . . 0.0 113.768 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.6 m -77.81 -66.52 0.83 Allowed 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 178.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -140.88 156.63 68.57 Favored Pre-proline 0 C--O 1.238 0.465 0 CA-C-O 118.665 -0.683 . . . . 0.0 112.124 -169.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -59.13 115.37 2.52 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 122.509 2.139 . . . . 0.0 109.128 169.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 95.93 -0.88 62.84 Favored Glycine 0 CA--C 1.531 1.084 0 CA-C-O 117.552 -1.693 . . . . 0.0 115.93 -178.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.23 -30.47 71.53 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.949 2.374 . . . . 0.0 112.317 172.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.584 HD12 ' H ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -56.5 -22.65 34.11 Favored 'General case' 0 C--O 1.222 -0.346 0 C-N-CA 124.431 1.093 . . . . 0.0 111.61 177.833 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.25 -36.99 79.03 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.482 0.713 . . . . 0.0 112.322 176.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.45 -38.06 74.43 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.372 0.533 . . . . 0.0 111.436 175.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -64.57 -38.12 89.92 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 175.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 32.9 mt -99.69 -14.67 18.82 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -172.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 64.8 25.36 70.49 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-O 118.717 -1.046 . . . . 0.0 112.281 -169.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 67.4 mt -126.95 134.53 50.38 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.266 1.027 . . . . 0.0 112.223 -176.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.3 p -50.18 156.81 0.75 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.101 1.36 . . . . 0.0 114.311 -168.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.6 ttm180 -53.24 -26.16 16.96 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.07 -1.423 . . . . 0.0 112.049 169.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.6 m -80.04 -47.23 15.2 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.063 -1.023 . . . . 0.0 111.778 175.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -60.07 -52.61 64.62 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.481 1.112 . . . . 0.0 110.266 176.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.4 t -58.84 -38.92 75.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 121.018 -1.051 . . . . 0.0 111.955 176.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 74.9 m -64.69 -39.72 94.15 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.916 1.234 . . . . 0.0 113.31 174.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -56.51 -52.55 64.32 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.676 0.79 . . . . 0.0 110.771 174.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 20.0 m80 -61.22 -39.77 91.53 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 48.7 mt -68.09 -25.85 65.53 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.171 -0.919 . . . . 0.0 112.968 175.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.4 t -59.42 -56.82 17.23 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 120.705 1.593 . . . . 0.0 113.637 -168.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 30.8 t -67.95 -28.78 67.76 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 122.209 -0.307 . . . . 0.0 111.764 172.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.4 tp -60.78 -35.42 76.4 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.915 0.886 . . . . 0.0 111.647 177.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 87.0 mtm-85 -74.83 -28.98 60.91 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.188 0.995 . . . . 0.0 112.026 172.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.39 -50.31 6.76 Favored Glycine 0 N--CA 1.472 1.072 0 CA-C-N 119.357 0.981 . . . . 0.0 113.129 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 18.2 m -67.53 -2.01 5.89 Favored 'General case' 0 CA--C 1.562 1.423 0 C-N-CA 126.826 2.05 . . . . 0.0 111.444 168.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.32 -0.62 16.23 Favored Glycine 0 C--N 1.343 0.959 0 C-N-CA 126.884 2.183 . . . . 0.0 115.191 173.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 77.5 mt -53.27 -25.67 15.39 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.13 1.772 . . . . 0.0 112.667 179.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 3.3 m -123.91 153.31 29.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 126.718 2.007 . . . . 0.0 109.641 164.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -142.32 155.28 18.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 C-N-CA 126.77 2.028 . . . . 0.0 109.891 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.6 151.93 28.8 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 122.706 1.241 . . . . 0.0 111.009 171.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.0 m -158.11 -170.85 3.28 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 127.008 2.123 . . . . 0.0 105.959 173.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -120.91 157.99 28.66 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 119.773 1.17 . . . . 0.0 113.418 174.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -110.49 -151.45 0.48 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 126.641 1.976 . . . . 0.0 109.414 167.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.48 -12.49 56.22 Favored Glycine 0 CA--C 1.539 1.562 0 O-C-N 120.027 -1.671 . . . . 0.0 116.332 -172.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -164.54 -28.71 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.644 1.577 . . . . 0.0 113.307 173.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -99.48 170.64 8.47 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.801 1.64 . . . . 0.0 110.405 -177.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 26.0 m -80.81 160.87 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 O-C-N 121.92 -0.488 . . . . 0.0 111.54 168.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -126.61 171.78 10.83 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.394 1.877 . . . . 0.0 110.455 175.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -123.87 121.96 36.72 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.214 1.406 . . . . 0.0 107.963 167.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.13 167.53 17.44 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.866 1.266 . . . . 0.0 111.552 177.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 69.7 mt -60.61 156.7 15.98 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.573 0.749 . . . . 0.0 111.765 172.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.22 -51.36 68.35 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 125.948 1.699 . . . . 0.0 113.846 179.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -164.27 173.55 12.18 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 123.683 1.706 . . . . 0.0 114.258 -167.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 43.2 t -47.18 -42.42 19.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 113.168 -1.833 . . . . 0.0 113.308 170.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 55.9 m-70 -63.97 -42.47 97.25 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 116.938 -1.506 . . . . 0.0 113.478 -178.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 10.2 mt -71.9 -45.14 62.3 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 121.188 1.813 . . . . 0.0 109.846 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.99 -35.65 59.44 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.814 0.846 . . . . 0.0 111.782 175.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.418 ' HE ' ' CD ' ' A' ' 88' ' ' GLU . 0.4 OUTLIER -70.86 -67.27 0.52 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 128.398 2.679 . . . . 0.0 112.661 175.532 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.74 -30.25 70.43 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -173.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.04 -39.57 60.92 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.723 -0.611 . . . . 0.0 109.642 169.394 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -57.61 -45.06 93.64 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 125.897 1.713 . . . . 0.0 114.347 -178.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.418 ' CD ' ' HE ' ' A' ' 84' ' ' ARG . 2.0 pt-20 -87.84 3.76 47.09 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 174.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 39.0 tp 73.5 143.2 0.07 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 129.3 3.04 . . . . 0.0 111.64 177.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 31.2 m -38.25 -20.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 128.992 2.917 . . . . 0.0 116.367 176.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 86.82 -35.83 0.03 OUTLIER 'General case' 0 C--O 1.218 -0.594 0 C-N-CA 126.232 1.813 . . . . 0.0 108.963 161.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 8.7 p -62.62 36.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 128.915 2.886 . . . . 0.0 114.677 168.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.5 t 79.07 -25.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 128.7 2.8 . . . . 0.0 113.027 170.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 tt 110.59 99.05 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.636 1 C-N-CA 132.57 4.348 . . . . 0.0 104.582 -169.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.99 133.84 56.48 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 119.309 -0.377 . . . . 0.0 110.968 -178.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.1 t -74.76 137.14 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -166.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -60.68 -23.04 64.53 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.26 1.424 . . . . 0.0 114.72 173.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 59.0 p -64.82 117.08 7.01 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.382 1.073 . . . . 0.0 109.098 176.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -69.46 12.77 0.16 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.083 2.153 . . . . 0.0 114.447 -175.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 -74.16 159.29 84.21 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 125.674 1.59 . . . . 0.0 113.424 -167.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.85 135.92 43.23 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.376 2.718 . . . . 0.0 110.965 169.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 20.5 p -55.75 -45.59 78.0 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.833 0.853 . . . . 0.0 110.816 168.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 7.7 p 167.06 -31.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 131.329 3.852 . . . . 0.0 111.513 175.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.32 7.44 2.83 Favored 'General case' 0 CA--C 1.552 1.05 0 N-CA-C 115.262 1.578 . . . . 0.0 115.262 -174.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -142.66 162.0 36.61 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 127.246 2.218 . . . . 0.0 108.744 -177.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.581 0 O-C-N 121.161 -0.962 . . . . 0.0 111.346 169.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.508 0 CA-C-O 119.623 -0.227 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . 0.524 HD22 ' H ' ' B' ' 12' ' ' ALA . 1.2 pt? -50.12 -53.32 28.22 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.687 1.195 . . . . 0.0 113.65 -171.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . 0.524 ' H ' HD22 ' B' ' 11' ' ' LEU . . . -63.29 -21.9 66.54 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.541 1.536 . . . . 0.0 114.202 176.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . 0.456 HH11 ' HG2' ' B' ' 13' ' ' ARG . 1.3 mmt-85 -84.03 -41.11 17.58 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 119.607 1.094 . . . . 0.0 111.723 170.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -57.98 -52.73 64.31 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.709 1.604 . . . . 0.0 111.114 177.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.39 -22.48 69.45 Favored Glycine 0 CA--C 1.533 1.177 0 O-C-N 121.884 -0.51 . . . . 0.0 112.715 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 72.3 mtp180 -87.47 14.05 8.89 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 126.212 1.805 . . . . 0.0 112.508 173.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -125.19 -37.58 2.39 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.845 1.258 . . . . 0.0 112.354 168.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 24.5 mt -88.88 -25.75 21.97 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.541 -1.218 . . . . 0.0 113.078 178.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -115.9 55.16 0.8 Allowed 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 120.977 1.717 . . . . 0.0 110.705 168.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -133.43 143.9 49.99 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 127.587 2.355 . . . . 0.0 106.678 -174.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -57.54 -98.98 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.945 1 C-N-CA 125.698 4.266 . . . . 0.0 115.7 -163.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.401 ' HG1' ' CD2' ' B' ' 54' ' ' HIS . 1.3 p -53.08 -32.92 49.69 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.515 1.926 . . . . 0.0 112.42 172.062 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.84 -43.85 62.12 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.687 0.795 . . . . 0.0 112.906 -170.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 46.8 t -63.38 -39.26 94.04 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.193 0.906 . . . . 0.0 109.455 168.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -55.92 -33.24 64.5 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 120.582 -1.324 . . . . 0.0 113.973 171.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.6 mm -62.06 -48.76 86.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 CA-C-N 120.23 1.377 . . . . 0.0 110.061 169.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 89.6 mt -58.56 -45.01 89.86 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.957 0.799 . . . . 0.0 112.066 176.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 51.8 t -61.38 -47.25 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 126.424 1.889 . . . . 0.0 110.847 179.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.52 -36.21 63.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.89 0.876 . . . . 0.0 112.298 -177.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 16.6 tp -66.17 -35.35 80.24 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 117.486 -1.245 . . . . 0.0 112.103 -178.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -37.14 -45.71 0.64 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 129.492 3.117 . . . . 0.0 113.91 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -105.34 -16.96 14.6 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.065 1.746 . . . . 0.0 113.165 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.28 -71.42 1.23 Allowed Glycine 0 C--N 1.341 0.85 0 C-N-CA 124.658 1.123 . . . . 0.0 112.329 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 34.6 m 33.45 36.43 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 -170.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.93 -76.27 0.3 Allowed 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.357 -0.84 . . . . 0.0 111.553 -177.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -145.74 158.15 50.11 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-O 118.648 -0.692 . . . . 0.0 112.82 -168.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -58.62 123.14 12.91 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.919 2.413 . . . . 0.0 110.162 172.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 88.19 -3.83 85.52 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 117.575 -1.68 . . . . 0.0 115.449 -174.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -32.82 71.08 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 120.493 2.146 . . . . 0.0 111.87 174.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 2.1 mt -59.52 -15.74 20.05 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 123.716 0.806 . . . . 0.0 112.246 179.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.9 -41.76 87.98 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.57 0.623 . . . . 0.0 111.159 175.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -75.57 -30.35 59.63 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.512 0.725 . . . . 0.0 112.418 176.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -69.01 -33.97 74.5 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 171.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 23.9 mt -106.59 -14.57 15.01 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -170.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.33 16.95 69.85 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-N 119.136 0.88 . . . . 0.0 113.008 -169.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 36.7 mt -117.65 139.63 50.74 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 118.506 1.153 . . . . 0.0 111.6 -175.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.2 p -59.67 161.68 5.92 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.388 0.675 . . . . 0.0 111.933 -172.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 20.7 ttm180 -58.61 -29.08 66.2 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 122.056 -0.403 . . . . 0.0 111.938 175.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 20.3 m -69.81 -46.07 66.5 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.386 0.994 . . . . 0.0 111.622 175.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -61.94 -55.19 32.02 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 122.821 0.449 . . . . 0.0 110.128 173.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . 0.402 ' HA ' ' HD1' ' B' ' 54' ' ' HIS . 2.8 t -56.26 -40.73 67.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 121.002 -1.061 . . . . 0.0 112.976 179.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 49.7 m -66.17 -37.93 86.83 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.663 1.12 . . . . 0.0 112.865 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -55.54 -49.97 71.25 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.93 0.786 . . . . 0.0 110.89 172.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . 0.402 ' HD1' ' HA ' ' B' ' 51' ' ' VAL . 20.6 m80 -64.17 -37.44 87.45 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 26.1 mt -73.27 -27.33 61.5 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 117.599 -1.191 . . . . 0.0 113.441 175.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.1 t -50.65 -63.71 1.04 Allowed 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.293 0.951 . . . . 0.0 112.608 -169.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.7 t -66.76 -33.79 76.41 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.541 0.736 . . . . 0.0 111.66 174.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 3.6 tp -53.34 -33.92 55.46 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.29 1.036 . . . . 0.0 112.47 178.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 79.9 mtm-85 -83.16 -21.54 33.51 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 173.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -80.73 -47.43 6.71 Favored Glycine 0 N--CA 1.475 1.273 0 CA-C-N 120.228 1.376 . . . . 0.0 111.825 176.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 3.3 m -62.93 -11.29 17.6 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.961 2.104 . . . . 0.0 112.388 168.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 59.65 28.09 64.83 Favored Glycine 0 C--N 1.345 1.083 0 C-N-CA 125.818 1.675 . . . . 0.0 113.477 -178.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 93.0 mt -73.15 -24.73 60.62 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 117.918 0.859 . . . . 0.0 111.167 168.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 4.5 m -130.28 159.68 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 C-N-CA 126.108 1.763 . . . . 0.0 110.284 168.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -145.5 155.44 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 126.016 1.726 . . . . 0.0 110.266 -172.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.28 150.77 24.55 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.073 1.349 . . . . 0.0 111.53 172.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 10.6 m -158.99 168.83 25.74 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 176.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -102.67 142.62 33.51 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.349 0.977 . . . . 0.0 111.197 168.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.261 1.6 pp20? -99.52 -155.74 0.52 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.35 1.06 . . . . 0.0 109.435 166.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -67.09 -14.95 64.49 Favored Glycine 0 CA--C 1.535 1.341 0 O-C-N 120.176 -1.577 . . . . 0.0 115.46 -171.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -159.19 -20.85 0.07 Allowed 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.95 1.375 . . . . 0.0 114.433 174.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -111.93 162.36 15.41 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.975 2.11 . . . . 0.0 110.994 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 17.6 m -82.1 152.4 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 O-C-N 121.468 -0.77 . . . . 0.0 109.377 167.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -129.15 168.67 15.8 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 122.594 1.188 . . . . 0.0 109.643 -178.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -113.16 148.2 35.86 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 164.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -149.55 157.8 43.6 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.307 1.043 . . . . 0.0 110.285 176.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -53.14 151.83 4.73 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.988 0.915 . . . . 0.0 110.651 168.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -49.66 -52.35 31.47 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.535 1.134 . . . . 0.0 113.775 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.35 179.81 3.76 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 122.818 1.294 . . . . 0.0 113.896 -167.115 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 24.5 t -49.3 -43.96 43.76 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.054 -1.43 . . . . 0.0 113.25 170.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -62.06 -48.42 80.31 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 117.664 -1.16 . . . . 0.0 112.926 -178.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 15.8 mt -68.72 -38.89 80.54 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 120.615 1.552 . . . . 0.0 109.954 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.35 -32.24 73.61 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.535 0.607 . . . . 0.0 110.994 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -69.56 -70.13 0.3 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 128.462 2.705 . . . . 0.0 110.936 171.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.72 -33.44 61.08 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 120.803 1.638 . . . . 0.0 114.555 -178.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 tt -77.65 -39.93 43.41 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 121.322 -0.861 . . . . 0.0 111.123 173.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.12 -46.77 90.23 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.634 1.588 . . . . 0.0 114.41 -173.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 12.8 pm0 -84.08 -0.49 52.05 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 119.255 1.528 . . . . 0.0 113.499 168.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . 0.404 ' C ' ' H ' ' B' ' 91' ' ' GLN . 33.8 tp 72.85 135.35 0.05 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 129.563 3.145 . . . . 0.0 111.504 177.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 97.5 t -62.79 8.62 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 129.225 3.01 . . . . 0.0 113.716 -176.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.404 ' H ' ' C ' ' B' ' 89' ' ' LEU . 4.7 tp-100 93.4 -35.85 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.611 -1.306 . . . . 0.0 110.82 129.688 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 7.7 p -56.48 35.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.043 1 C-N-CA 132.628 4.371 . . . . 0.0 115.626 171.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER 67.15 6.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.876 0 C-N-CA 126.698 1.999 . . . . 0.0 112.836 176.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 tt 78.54 105.4 0.07 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.762 2.425 . . . . 0.0 107.631 -168.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.92 128.02 35.01 Favored 'General case' 0 CA--C 1.551 1.007 0 O-C-N 121.563 -0.711 . . . . 0.0 110.336 174.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 2.5 t -84.87 139.43 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -164.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -60.33 -16.68 37.1 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.579 1.552 . . . . 0.0 115.127 173.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' THR . . . . . 0.411 ' C ' ' H ' ' B' ' 100' ' ' GLN . 41.7 p -68.75 106.11 2.54 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.495 1.118 . . . . 0.0 109.697 175.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -64.83 13.3 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 128.134 2.574 . . . . 0.0 114.9 178.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . 0.411 ' H ' ' C ' ' B' ' 98' ' ' THR . 89.8 mm-40 -74.47 161.97 75.77 Favored Pre-proline 0 CA--C 1.547 0.858 0 C-N-CA 127.096 2.158 . . . . 0.0 114.668 -167.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.45 130.73 20.24 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 124.681 3.587 . . . . 0.0 112.527 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 24.2 p -72.01 -41.54 67.45 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.212 1.005 . . . . 0.0 112.369 175.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 8.0 p 155.67 -41.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.066 1 C-N-CA 132.922 4.489 . . . . 0.0 112.234 169.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.99 -10.99 59.99 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -177.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.14 137.88 51.46 Favored 'General case' 0 N--CA 1.437 -1.107 0 C-N-CA 124.313 1.045 . . . . 0.0 108.559 168.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.444 0 C-N-CA 124.127 0.971 . . . . 0.0 111.635 178.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.774 0 N-CA-C 114.867 1.432 . . . . 0.0 114.867 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.9 mt -43.26 -54.58 4.49 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.69 1.196 . . . . 0.0 113.862 -168.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.45 -41.62 98.63 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -177.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -53.91 -51.05 64.98 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.668 1.187 . . . . 0.0 110.633 172.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.73 -47.18 73.11 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.759 1.223 . . . . 0.0 113.001 -178.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.61 -40.95 94.23 Favored Glycine 0 N--CA 1.473 1.133 0 CA-C-N 120.301 1.41 . . . . 0.0 111.303 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -40.4 92.18 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.15 1.38 . . . . 0.0 110.763 172.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.6 -3.18 4.21 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.725 1.379 . . . . 0.0 114.725 175.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.9 mp -115.29 -35.63 4.59 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.836 1.254 . . . . 0.0 111.836 166.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.91 98.93 11.89 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 128.113 2.565 . . . . 0.0 111.929 -176.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.66 172.13 5.99 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 127.421 2.288 . . . . 0.0 108.971 -169.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -74.27 -119.71 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 124.927 3.751 . . . . 0.0 110.482 172.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 68.4 m -50.15 -28.96 8.19 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.732 2.013 . . . . 0.0 113.227 176.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.94 -24.93 64.33 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 120.093 1.315 . . . . 0.0 113.479 174.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 30.0 t -74.23 -45.0 50.87 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.185 -0.947 . . . . 0.0 109.251 166.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.44 -44.75 76.61 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.498 -0.751 . . . . 0.0 112.726 173.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.2 mm -50.06 -51.24 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 119.984 1.265 . . . . 0.0 110.714 169.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 25.5 mt -59.67 -45.34 92.36 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 117.249 -1.358 . . . . 0.0 112.87 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.5 m -66.55 -28.05 42.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 CA-C-N 121.267 1.849 . . . . 0.0 111.862 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.23 -20.0 45.62 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.057 1.343 . . . . 0.0 112.932 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 77.2 mt -63.02 -49.45 74.6 Favored 'General case' 0 N--CA 1.469 0.489 0 O-C-N 121.075 -1.015 . . . . 0.0 111.017 170.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -46.41 -53.48 10.97 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 129.304 3.042 . . . . 0.0 112.56 -169.476 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -105.72 22.79 14.95 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 127.444 2.298 . . . . 0.0 111.272 177.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.68 -84.7 0.96 Allowed Glycine 0 C--N 1.34 0.758 0 C-N-CA 126.456 1.979 . . . . 0.0 112.633 -178.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 23.7 m 30.71 39.2 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 127.245 2.218 . . . . 0.0 116.557 -171.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 34.6 m -89.52 -76.72 0.41 Allowed 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.236 -0.915 . . . . 0.0 112.718 -177.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -137.51 164.24 42.94 Favored Pre-proline 0 CA--C 1.546 0.813 0 CA-C-O 118.454 -0.784 . . . . 0.0 111.515 -174.28 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -66.3 -20.23 55.54 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.583 2.188 . . . . 0.0 114.379 -167.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.55 8.24 43.57 Favored Glycine 0 CA--C 1.535 1.302 0 CA-C-O 118.388 -1.229 . . . . 0.0 115.028 171.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -28.97 67.25 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 120.189 1.995 . . . . 0.0 113.899 -170.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.74 -18.38 59.52 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.359 0.664 . . . . 0.0 111.723 -177.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.52 -32.96 71.96 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.133 0.973 . . . . 0.0 112.249 174.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.5 -41.49 46.8 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.209 0.604 . . . . 0.0 111.478 176.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -63.63 -40.13 96.1 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 175.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 28.6 mt -92.62 -22.83 19.25 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -174.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.81 8.72 82.54 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 123.961 0.791 . . . . 0.0 112.644 -169.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 86.3 mt -103.73 152.01 22.34 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.305 1.442 . . . . 0.0 110.919 -171.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.5 p -63.94 154.53 33.66 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.543 0.737 . . . . 0.0 111.442 -171.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -56.88 -31.36 64.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 176.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.9 m -69.42 -49.69 52.8 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 123.883 0.873 . . . . 0.0 111.473 172.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -63.32 -37.11 86.0 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 119.133 0.879 . . . . 0.0 113.099 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.3 t -63.64 -50.78 76.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 C-N-CA 123.907 0.883 . . . . 0.0 111.381 169.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.3 m -63.48 -35.65 81.14 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 119.225 0.921 . . . . 0.0 113.212 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 43.8 m-20 -49.21 -37.15 21.93 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 125.726 1.611 . . . . 0.0 111.998 170.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 53.1 m-70 -100.58 2.99 42.32 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 115.505 1.668 . . . . 0.0 115.505 176.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 87.4 mt -92.07 -31.65 15.46 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.807 1.185 . . . . 0.0 111.754 165.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.8 t -45.98 -59.27 2.94 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -170.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 10.6 t -76.45 -21.08 56.37 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.6 tp -61.18 -36.36 79.65 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.613 1.165 . . . . 0.0 110.931 177.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 55.6 mtm180 -79.94 -20.29 46.0 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.147 1.379 . . . . 0.0 112.41 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.8 -41.39 4.7 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.984 1.278 . . . . 0.0 114.227 -177.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 58.5 m -74.8 -3.48 31.99 Favored 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 124.615 1.166 . . . . 0.0 112.305 170.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 92.04 -4.03 77.6 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 126.008 1.766 . . . . 0.0 116.312 169.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 78.4 mt -64.25 -28.99 70.11 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 120.582 2.191 . . . . 0.0 114.77 -173.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -122.12 132.45 70.97 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.406 0 C-N-CA 124.629 1.172 . . . . 0.0 110.455 175.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.8 t -120.66 133.23 68.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 C-N-CA 125.828 1.651 . . . . 0.0 107.971 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.98 144.5 50.47 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 122.953 1.359 . . . . 0.0 112.16 172.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 m -156.98 157.7 35.23 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 126.47 1.908 . . . . 0.0 106.405 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -91.83 135.33 34.0 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.929 1.241 . . . . 0.0 112.458 176.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.69 -11.95 59.83 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.156 0.582 . . . . 0.0 110.773 164.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 126.68 -44.45 1.24 Allowed Glycine 0 C--N 1.346 1.09 0 C-N-CA 126.831 2.158 . . . . 0.0 112.859 169.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.0 mtp-105 -92.6 -22.11 19.67 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.85 2.86 . . . . 0.0 111.502 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -156.66 168.48 27.29 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 127.525 2.33 . . . . 0.0 109.087 -169.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 33.3 m -85.15 158.08 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 123.436 0.694 . . . . 0.0 110.828 168.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -129.57 162.39 28.33 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 128.518 2.727 . . . . 0.0 109.0 172.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -108.06 110.95 22.77 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 168.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -109.88 145.98 35.9 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.901 0.88 . . . . 0.0 110.399 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.6 mt -56.11 145.34 26.21 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 123.17 0.294 . . . . 0.0 110.208 169.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.2 -32.77 73.22 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -167.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -155.82 159.81 39.71 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.639 1.976 . . . . 0.0 111.033 168.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.2 p -45.27 -30.47 1.25 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 128.534 2.733 . . . . 0.0 114.176 168.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -54.41 -45.97 73.07 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 125.01 1.324 . . . . 0.0 112.652 172.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 11.2 mt -74.08 -45.36 49.81 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 118.527 -0.749 . . . . 0.0 109.645 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.97 -31.53 60.81 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.157 0.983 . . . . 0.0 112.459 175.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.5 mtt-85 -72.44 -64.03 1.03 Allowed 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 125.194 1.398 . . . . 0.0 113.379 174.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.56 -12.23 59.9 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 120.429 1.468 . . . . 0.0 112.592 -176.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 60.2 tp -75.78 -53.27 8.76 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.245 1.818 . . . . 0.0 110.155 164.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.22 -41.15 8.13 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 128.183 2.802 . . . . 0.0 117.947 -168.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.47 -22.39 66.86 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.105 1.453 . . . . 0.0 111.274 169.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 35.6 tp 68.94 128.48 0.03 OUTLIER 'General case' 0 C--N 1.344 0.363 0 C-N-CA 129.657 3.183 . . . . 0.0 114.223 165.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 3.6 m -53.19 140.86 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-O 122.566 1.174 . . . . 0.0 109.849 174.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.445 ' C ' ' H ' ' A' ' 93' ' ' VAL . 21.2 mm-40 -74.78 -4.95 40.69 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -162.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 2.4 p -62.31 23.89 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 C-N-CA 127.585 2.354 . . . . 0.0 115.722 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.445 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.7 t 73.85 8.51 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 C-N-CA 126.7 2.0 . . . . 0.0 112.23 167.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 tt 82.56 93.52 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 128.676 2.79 . . . . 0.0 108.609 -170.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.77 160.29 32.87 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.595 0.758 . . . . 0.0 112.616 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 58.4 t -65.29 144.94 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 124.648 1.179 . . . . 0.0 111.914 173.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -66.28 49.53 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 127.22 2.208 . . . . 0.0 114.773 169.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.8 p -122.49 165.39 16.45 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.853 1.661 . . . . 0.0 112.422 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -118.59 138.38 52.61 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 112.906 -1.952 . . . . 0.0 106.366 163.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 70.0 mm-40 -155.53 150.64 20.89 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 127.581 2.352 . . . . 0.0 107.476 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.47 149.33 84.57 Favored 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 122.481 2.12 . . . . 0.0 116.025 -167.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 34.5 t -110.87 105.48 14.3 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 127.29 2.236 . . . . 0.0 108.475 175.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 12.0 p -178.71 -44.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 126.955 2.102 . . . . 0.0 111.94 -169.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . 65.13 -10.51 0.17 Allowed 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 117.711 2.486 . . . . 0.0 117.711 177.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.5 tm-20 -77.42 -35.61 53.97 Favored 'General case' 0 N--CA 1.442 -0.86 0 O-C-N 123.086 0.241 . . . . 0.0 111.358 166.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.227 -0.102 0 O-C-N 121.621 -0.675 . . . . 0.0 112.406 -177.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.809 0 N-CA-C 114.833 1.419 . . . . 0.0 114.833 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 12.1 mt -45.16 -47.47 12.34 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.137 1.375 . . . . 0.0 114.168 -169.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.02 -48.35 76.66 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.98 0.912 . . . . 0.0 111.901 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 -51.35 -50.06 60.23 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.022 1.329 . . . . 0.0 110.996 177.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -65.34 -52.59 52.82 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.395 1.078 . . . . 0.0 111.955 -175.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.81 -29.73 73.94 Favored Glycine 0 CA--C 1.527 0.823 0 CA-C-O 119.098 -0.834 . . . . 0.0 112.806 -178.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.73 -37.65 73.49 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 118.495 1.148 . . . . 0.0 110.758 174.182 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.31 -29.36 70.7 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 118.174 -0.917 . . . . 0.0 112.749 176.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 mp -93.0 -34.69 13.63 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 175.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -90.77 92.02 8.62 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.723 1.209 . . . . 0.0 110.606 -178.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -169.11 141.12 2.07 Favored Pre-proline 0 N--CA 1.47 0.575 0 C-N-CA 127.487 2.315 . . . . 0.0 107.361 -169.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . 0.432 ' HG2' ' H ' ' B' ' 22' ' ' THR . 58.8 Cg_endo -45.74 -82.07 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.848 1 C-N-CA 125.475 4.117 . . . . 0.0 113.272 -167.647 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.432 ' H ' ' HG2' ' B' ' 21' ' ' PRO . 29.5 m -85.32 -22.39 28.53 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.777 1.231 . . . . 0.0 111.179 -173.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . 0.476 ' HB2' ' HD1' ' B' ' 54' ' ' HIS . 24.5 ttp-105 -68.38 -37.35 80.32 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 120.779 1.627 . . . . 0.0 112.274 176.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 40.2 t -57.52 -46.84 83.34 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 167.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . 0.401 HH12 HD23 ' B' ' 94' ' ' LEU . 0.0 OUTLIER -61.29 -41.06 96.32 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 117.895 -1.05 . . . . 0.0 113.47 178.924 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 5.4 mm -57.47 -45.7 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 CA-C-N 120.903 1.683 . . . . 0.0 110.767 171.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 85.6 mt -60.78 -49.83 75.91 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 118.008 -0.996 . . . . 0.0 111.378 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 m -65.36 -31.04 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 CA-C-N 119.481 1.037 . . . . 0.0 111.951 -177.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.07 -26.67 48.3 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.412 1.085 . . . . 0.0 111.611 178.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 tp -66.49 -40.67 89.4 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 117.647 -1.168 . . . . 0.0 112.712 168.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.49 -53.42 11.26 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.357 2.263 . . . . 0.0 112.168 -179.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -102.76 25.69 8.92 Favored 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 127.903 2.481 . . . . 0.0 111.334 177.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -126.01 -91.43 0.82 Allowed Glycine 0 N--CA 1.465 0.596 0 C-N-CA 127.52 2.486 . . . . 0.0 111.676 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 23.6 m 39.25 30.27 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 126.272 1.829 . . . . 0.0 114.12 -165.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 80.6 m -82.46 -150.83 0.09 Allowed 'General case' 0 N--CA 1.438 -1.059 0 CA-C-O 123.872 1.796 . . . . 0.0 107.617 168.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.64 162.2 75.4 Favored Pre-proline 0 C--N 1.311 -1.068 0 O-C-N 120.801 -1.187 . . . . 0.0 113.846 -166.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -61.1 -15.78 41.67 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.261 2.641 . . . . 0.0 114.9 -177.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.66 0.97 45.59 Favored Glycine 0 CA--C 1.536 1.396 0 CA-C-O 118.663 -1.076 . . . . 0.0 115.356 170.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . 0.568 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -63.5 -31.51 72.7 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.353 1.577 . . . . 0.0 113.783 -169.337 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mt -64.48 -16.98 63.41 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.803 0.841 . . . . 0.0 111.692 -176.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.89 -28.17 69.66 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.279 0.49 . . . . 0.0 112.22 173.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.04 -52.1 9.92 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.352 0.661 . . . . 0.0 111.069 171.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . 0.568 ' CD2' HE22 ' B' ' 39' ' ' GLN . 8.0 m-70 -58.77 -36.33 74.22 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 22.3 mt -98.11 -15.88 19.78 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -175.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.34 6.06 31.83 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-N 119.252 0.933 . . . . 0.0 113.345 -170.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 79.9 mt -102.2 156.6 17.46 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.81 1.244 . . . . 0.0 111.163 -172.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 31.0 p -65.48 154.69 37.82 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.034 0.534 . . . . 0.0 110.939 -170.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -55.34 -27.8 49.53 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.206 0.602 . . . . 0.0 112.181 171.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 4.1 m -70.42 -53.63 15.68 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.056 0.943 . . . . 0.0 111.032 171.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -58.2 -43.65 87.71 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 124.227 1.011 . . . . 0.0 112.232 177.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 7.7 t -60.68 -44.27 96.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 124.847 1.259 . . . . 0.0 111.947 170.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 65.0 m -64.19 -38.44 91.05 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 120.49 1.495 . . . . 0.0 112.968 175.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -57.01 -57.99 10.12 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.32 1.448 . . . . 0.0 110.611 176.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . 0.476 ' HD1' ' HB2' ' B' ' 23' ' ' ARG . 63.4 m-70 -74.39 -18.81 60.61 Favored 'General case' 0 CA--C 1.553 1.068 0 CA-C-O 118.219 -0.896 . . . . 0.0 113.099 -179.4 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 28.7 mt -71.53 -37.92 71.12 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 121.059 1.754 . . . . 0.0 113.009 167.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 18.9 m -53.32 -52.66 58.44 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 120.652 1.569 . . . . 0.0 114.708 -171.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 3.3 t -68.56 -24.44 64.62 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 119.635 1.107 . . . . 0.0 112.924 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.4 tp -70.08 -43.06 71.91 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 127.057 2.143 . . . . 0.0 110.845 177.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 70.4 mtm180 -81.83 -9.67 59.54 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.934 1.694 . . . . 0.0 112.255 176.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.61 -52.68 2.42 Favored Glycine 0 C--N 1.34 0.776 0 C-N-CA 124.583 1.087 . . . . 0.0 111.314 174.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 91.0 m -76.53 0.45 19.92 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 125.635 1.574 . . . . 0.0 115.124 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.22 29.6 49.56 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.414 1.007 . . . . 0.0 114.666 174.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 86.9 mt -89.06 -24.52 22.28 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.251 -1.146 . . . . 0.0 113.007 172.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 5.8 m -136.71 150.39 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.221 1.409 . . . . 0.0 111.618 176.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 60.0 t -141.43 140.81 31.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.182 1.393 . . . . 0.0 110.381 -169.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -77.75 141.42 39.3 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.136 0.969 . . . . 0.0 112.146 175.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.8 m -162.33 167.3 24.03 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.689 1.996 . . . . 0.0 107.262 -173.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -90.91 149.04 22.06 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.885 1.675 . . . . 0.0 113.143 172.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -99.55 11.27 39.61 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 125.687 1.595 . . . . 0.0 110.078 165.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.76 -56.05 4.91 Favored Glycine 0 C--N 1.343 0.926 0 C-N-CA 126.061 1.791 . . . . 0.0 111.196 -176.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 22.5 mtp-105 -69.51 -21.14 63.69 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.845 1.658 . . . . 0.0 113.523 178.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -174.43 173.33 2.98 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.243 2.617 . . . . 0.0 108.788 -167.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 3.4 m -79.13 162.04 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 C-N-CA 123.616 0.766 . . . . 0.0 109.736 166.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 22.1 ptt180 -147.35 164.7 32.45 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.88 1.272 . . . . 0.0 111.694 -178.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -106.11 120.89 42.98 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 165.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -114.1 153.17 29.95 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.008 1.323 . . . . 0.0 110.947 177.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 77.9 mt -59.06 148.81 29.64 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.477 0.58 . . . . 0.0 110.02 169.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.52 -9.57 58.71 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 115.91 1.819 . . . . 0.0 115.91 -169.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -177.32 157.91 1.39 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.897 2.879 . . . . 0.0 110.865 168.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 98.0 p -44.78 -32.51 1.57 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 128.517 2.727 . . . . 0.0 114.065 166.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -54.96 -47.05 75.04 Favored 'General case' 0 C--N 1.343 0.288 0 C-N-CA 124.361 1.064 . . . . 0.0 112.202 171.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 16.4 mt -70.83 -44.3 66.78 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 118.402 -0.809 . . . . 0.0 109.135 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.9 -35.24 57.84 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.557 0.743 . . . . 0.0 112.501 177.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 3.5 mtt-85 -71.74 -63.26 1.16 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.25 1.02 . . . . 0.0 113.624 174.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.63 -19.07 65.48 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.474 1.488 . . . . 0.0 112.852 -175.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 56.0 tp -72.86 -49.37 30.5 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.177 1.791 . . . . 0.0 111.005 167.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -82.24 -40.74 9.88 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 128.221 2.82 . . . . 0.0 116.758 -168.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -64.51 -23.48 67.29 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.429 1.614 . . . . 0.0 111.48 169.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 37.2 tp 70.56 132.03 0.03 OUTLIER 'General case' 0 C--N 1.344 0.354 0 C-N-CA 129.719 3.208 . . . . 0.0 113.675 167.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 3.2 m -53.38 138.12 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-O 122.61 1.195 . . . . 0.0 110.173 176.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.426 ' C ' ' H ' ' B' ' 93' ' ' VAL . 12.2 mm-40 -69.72 -10.46 58.39 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 -163.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 2.6 p -62.79 24.35 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 127.244 2.218 . . . . 0.0 115.632 -177.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . 0.426 ' H ' ' C ' ' B' ' 91' ' ' GLN . 1.7 t 71.23 11.47 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 C-N-CA 125.073 1.349 . . . . 0.0 111.622 168.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . 0.401 HD23 HH12 ' B' ' 25' ' ' ARG . 1.8 tt 77.99 99.89 0.07 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 128.859 2.863 . . . . 0.0 109.342 -170.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -76.48 160.03 29.86 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.785 0.834 . . . . 0.0 112.732 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . 0.404 HG12 ' HG1' ' B' ' 98' ' ' THR . 57.5 t -57.22 143.96 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 124.795 1.238 . . . . 0.0 110.32 170.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 22.8 p30 -76.3 50.17 0.62 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.989 1.716 . . . . 0.0 112.904 173.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' THR . . . . . 0.404 ' HG1' HG12 ' B' ' 96' ' ' VAL . 6.3 p -119.22 163.38 17.18 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.147 1.779 . . . . 0.0 111.96 174.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -113.62 137.35 51.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 112.818 -1.992 . . . . 0.0 106.915 164.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -155.94 150.92 20.77 Favored Pre-proline 0 CA--C 1.545 0.754 0 C-N-CA 127.023 2.129 . . . . 0.0 109.051 -173.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -70.7 154.35 64.06 Favored 'Trans proline' 0 CA--C 1.534 0.481 0 C-N-CA 123.374 2.716 . . . . 0.0 116.353 -166.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 33.7 t -106.02 124.13 49.09 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 127.438 2.295 . . . . 0.0 106.707 168.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 6.5 p 166.21 -38.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 C-N-CA 127.242 2.217 . . . . 0.0 111.261 -168.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . 73.19 -48.67 0.69 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 127.565 2.346 . . . . 0.0 114.375 -177.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -81.91 -32.57 30.87 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -166.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? . . . . . 0 N--CA 1.465 0.299 0 O-C-N 121.402 -0.811 . . . . 0.0 109.573 169.289 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.723 0 CA-C-O 118.766 -0.635 . . . . 0.0 109.452 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 88.7 mt -35.89 -39.34 0.15 Allowed 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 127.601 2.361 . . . . 0.0 115.297 -178.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -45.89 -30.38 1.71 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.229 1.812 . . . . 0.0 114.824 174.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.5 mmt85 -68.09 -36.11 79.25 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 116.253 -1.832 . . . . 0.0 113.428 174.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -62.27 -48.29 80.59 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 121.807 2.094 . . . . 0.0 111.043 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.27 -40.03 98.55 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 111.728 -0.549 . . . . 0.0 111.728 176.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.2 ttt180 -62.55 -33.93 75.91 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.737 0.815 . . . . 0.0 111.413 170.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.05 -19.31 64.87 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.29 1.405 . . . . 0.0 112.302 175.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 mp -92.21 -28.07 17.27 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.417 1.008 . . . . 0.0 112.964 169.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -100.53 -12.57 19.18 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 -172.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -56.77 140.55 75.59 Favored Pre-proline 0 CA--C 1.549 0.93 0 CA-C-N 119.922 1.237 . . . . 0.0 107.989 168.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -52.83 -77.2 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.432 1 C-N-CA 126.36 4.707 . . . . 0.0 112.076 -167.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.419 ' HB ' ' CD2' ' A' ' 54' ' ' HIS . 21.9 m -58.84 -26.35 64.1 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-O 117.513 -1.232 . . . . 0.0 111.775 177.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.6 mtt85 -65.96 -44.34 85.25 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.693 1.588 . . . . 0.0 112.604 177.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.7 t -54.1 -51.16 65.05 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.173 1.351 . . . . 0.0 110.347 171.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.4 ttt85 -62.67 -40.7 97.9 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.921 -178.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.0 mm -53.14 -56.88 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 125.413 1.485 . . . . 0.0 109.22 168.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.33 -45.38 93.46 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.886 -0.578 . . . . 0.0 111.965 -172.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.1 p -69.85 -24.65 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 CA-C-N 119.333 0.97 . . . . 0.0 113.41 176.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.48 -8.56 59.74 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 121.153 -0.967 . . . . 0.0 113.441 170.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.4 mt -94.66 -9.53 34.64 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 172.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.37 -13.14 61.4 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 128.724 2.81 . . . . 0.0 111.902 165.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -141.08 -46.8 0.39 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.773 2.029 . . . . 0.0 113.963 -169.064 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.98 -66.17 2.31 Favored Glycine 0 C--N 1.339 0.746 0 C-N-CA 125.254 1.407 . . . . 0.0 112.955 -167.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 34.9 m 41.15 20.8 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 128.353 2.661 . . . . 0.0 117.418 171.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 67.0 m -85.28 -63.4 1.33 Allowed 'General case' 0 C--O 1.223 -0.31 0 O-C-N 120.486 -1.384 . . . . 0.0 111.899 -178.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -151.49 159.88 32.68 Favored Pre-proline 0 N--CA 1.473 0.723 0 N-CA-C 115.031 1.493 . . . . 0.0 115.031 -172.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -57.82 119.99 7.6 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.091 1.861 . . . . 0.0 107.56 168.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.57 0.17 84.48 Favored Glycine 0 CA--C 1.533 1.167 0 CA-C-O 117.297 -1.835 . . . . 0.0 115.483 -173.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -37.77 85.91 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 121.209 2.505 . . . . 0.0 109.971 168.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.9 mt -55.42 -27.29 46.91 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 125.962 1.705 . . . . 0.0 110.648 176.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.87 -30.3 68.9 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.301 -0.874 . . . . 0.0 113.071 -174.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.55 -53.68 7.73 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.661 0.784 . . . . 0.0 111.172 170.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -50.6 -35.39 30.03 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.2 mt -101.08 -13.87 18.02 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.86 1.264 . . . . 0.0 113.389 -173.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.15 13.05 66.61 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.337 0.97 . . . . 0.0 113.724 -173.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 53.9 mt -123.9 141.28 52.17 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.577 1.151 . . . . 0.0 110.114 -168.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.8 p -59.2 157.57 10.37 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -168.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -52.95 -28.63 24.51 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.909 0.884 . . . . 0.0 112.279 171.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.5 t -79.12 -36.68 40.23 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.06 -1.025 . . . . 0.0 112.832 175.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -68.33 -38.67 81.75 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.335 0.971 . . . . 0.0 111.888 171.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.8 t -57.12 -44.84 83.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.518 174.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.79 -39.17 93.16 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-N 120.483 1.492 . . . . 0.0 114.081 173.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -56.18 -32.96 64.84 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.214 1.005 . . . . 0.0 112.612 176.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.419 ' CD2' ' HB ' ' A' ' 22' ' ' THR . 19.2 m-70 -94.56 -19.64 20.32 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 115.146 1.535 . . . . 0.0 115.146 172.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 47.1 mt -70.47 -28.67 65.18 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 121.159 1.8 . . . . 0.0 113.948 169.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 p -52.0 -59.42 4.37 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 -169.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 2.9 t -64.95 -39.39 93.42 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 118.557 0.617 . . . . 0.0 110.901 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.2 tp -51.76 -32.44 30.83 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.499 1.92 . . . . 0.0 112.266 -178.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.2 mtm105 -72.63 -45.67 57.85 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 118.824 0.738 . . . . 0.0 112.915 174.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.34 -28.08 62.51 Favored Glycine 0 N--CA 1.474 1.203 0 C-N-CA 125.348 1.452 . . . . 0.0 112.433 -176.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.1 m -66.93 -5.57 13.14 Favored 'General case' 0 CA--C 1.566 1.568 0 C-N-CA 127.414 2.285 . . . . 0.0 111.115 165.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.02 -24.92 1.91 Allowed Glycine 0 C--N 1.343 0.924 0 C-N-CA 128.711 3.053 . . . . 0.0 113.809 -172.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 69.9 mt -43.27 -39.55 3.08 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 128.519 2.728 . . . . 0.0 115.549 -170.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -115.4 133.68 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 124.922 1.289 . . . . 0.0 113.231 173.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 71.7 t -124.59 136.99 58.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 126.369 1.868 . . . . 0.0 109.549 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.33 141.4 30.94 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.797 1.239 . . . . 0.0 111.095 169.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.0 m -164.0 163.56 23.36 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.947 1.699 . . . . 0.0 107.244 -169.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -84.34 148.43 26.65 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.222 1.374 . . . . 0.0 114.177 174.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -91.76 -18.54 23.75 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.453 0.701 . . . . 0.0 110.24 163.609 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 128.8 -37.81 2.16 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 127.188 2.328 . . . . 0.0 113.252 173.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 23.1 ttm180 -93.97 -34.49 13.04 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 128.646 2.778 . . . . 0.0 111.841 170.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -144.43 164.07 31.93 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.745 2.018 . . . . 0.0 110.166 -170.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 32.9 m -84.56 150.3 4.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 CA-C-O 121.585 0.707 . . . . 0.0 111.298 168.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -135.63 162.27 33.18 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 126.872 2.069 . . . . 0.0 109.304 -171.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -97.57 153.74 17.98 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 164.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -158.83 161.52 36.91 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.164 1.386 . . . . 0.0 109.366 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 57.3 mt -72.35 152.76 41.87 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.363 0.665 . . . . 0.0 111.479 175.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.09 -40.21 95.07 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 115.13 1.53 . . . . 0.0 115.13 -173.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -162.57 161.19 26.7 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 125.411 1.484 . . . . 0.0 110.553 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.58 -37.69 0.14 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 129.515 3.126 . . . . 0.0 112.766 165.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -56.23 -52.11 65.63 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 125.563 1.545 . . . . 0.0 113.398 178.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.9 mt -70.5 -45.7 65.12 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.182 0.901 . . . . 0.0 109.23 -178.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -51.79 -42.11 62.18 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.453 1.101 . . . . 0.0 111.059 177.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 -65.59 -59.74 3.64 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.689 1.196 . . . . 0.0 113.321 171.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.28 -24.46 55.04 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 119.551 1.069 . . . . 0.0 113.329 -178.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.22 -41.5 16.88 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.077 -1.014 . . . . 0.0 112.937 169.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.01 -55.46 4.83 Favored Glycine 0 N--CA 1.471 1.014 0 C-N-CA 126.485 1.993 . . . . 0.0 114.259 -173.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -72.1 -10.34 59.65 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 119.196 1.498 . . . . 0.0 110.895 167.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.457 ' C ' ' H ' ' A' ' 91' ' ' GLN . 64.5 tp 74.88 138.9 0.06 Allowed 'General case' 0 C--N 1.345 0.409 0 C-N-CA 129.568 3.147 . . . . 0.0 110.554 169.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 32.6 m -66.74 21.05 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 124.923 1.289 . . . . 0.0 113.584 176.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.457 ' H ' ' C ' ' A' ' 89' ' ' LEU . 48.0 mm-40 78.14 -12.3 1.09 Allowed 'General case' 0 N--CA 1.443 -0.782 0 O-C-N 120.238 -1.539 . . . . 0.0 112.058 161.144 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.6 p -65.84 34.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 128.881 2.872 . . . . 0.0 115.24 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . 0.271 34.8 m 51.27 15.49 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 130.028 3.331 . . . . 0.0 115.832 175.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 38.7 tp 107.25 101.88 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.659 1 C-N-CA 131.759 4.024 . . . . 0.0 110.501 178.116 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.36 76.49 0.26 Allowed 'General case' 0 CA--C 1.553 1.074 0 O-C-N 121.262 -0.899 . . . . 0.0 111.89 168.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.92 162.02 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 C-N-CA 126.818 2.047 . . . . 0.0 113.178 175.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -63.6 -1.37 1.23 Allowed 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 126.914 2.086 . . . . 0.0 115.008 173.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.2 p -62.61 111.44 2.07 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 126.178 1.791 . . . . 0.0 111.323 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -66.21 140.75 58.19 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 171.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -157.47 127.06 3.2 Favored Pre-proline 0 N--CA 1.443 -0.811 0 N-CA-C 106.125 -1.805 . . . . 0.0 106.125 174.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.408 ' C ' ' H ' ' A' ' 103' ' ' VAL 0.27 59.5 Cg_endo -73.42 117.13 4.95 Favored 'Trans proline' 0 C--N 1.352 0.713 0 CA-C-N 121.399 1.535 . . . . 0.0 114.149 -166.349 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 50.5 t 63.62 -65.59 0.11 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 130.221 3.408 . . . . 0.0 106.946 -160.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.408 ' H ' ' C ' ' A' ' 101' ' ' PRO . 1.9 p 160.13 -45.45 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.646 1 C-N-CA 132.439 4.296 . . . . 0.0 109.18 -173.003 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.02 -19.3 60.68 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 -170.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.11 -178.14 3.44 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.428 1.891 . . . . 0.0 112.579 -166.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 115.738 1.755 . . . . 0.0 115.738 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.898 0 CA-C-O 119.391 -0.338 . . . . 0.0 111.338 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 72.2 mt -29.09 -43.03 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 130.393 3.477 . . . . 0.0 116.33 -172.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -39.22 -33.86 0.16 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.302 2.241 . . . . 0.0 114.485 172.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 1.8 mmm-85 -63.09 -31.21 72.29 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.795 2.038 . . . . 0.0 114.482 178.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -60.93 -51.88 67.38 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 120.41 1.459 . . . . 0.0 111.033 173.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.61 -35.52 74.61 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.106 -0.798 . . . . 0.0 111.106 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 52.7 ttt180 -64.55 -31.84 73.23 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 123.76 0.824 . . . . 0.0 111.057 171.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.28 -27.51 65.48 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 120.714 1.597 . . . . 0.0 111.99 174.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 mp -87.95 -7.57 56.93 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 172.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -125.2 -14.55 6.49 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 117.235 2.309 . . . . 0.0 117.235 -175.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -54.93 143.8 50.48 Favored Pre-proline 0 CA--C 1.546 0.821 0 CA-C-N 120.671 1.578 . . . . 0.0 108.582 170.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -43.64 -80.69 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 1 C-N-CA 127.453 5.436 . . . . 0.0 113.992 -166.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.513 ' HB ' ' CD2' ' B' ' 54' ' ' HIS . 7.3 m -67.74 -14.23 62.78 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.664 -0.647 . . . . 0.0 111.553 176.102 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.68 -47.06 42.56 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.768 1.167 . . . . 0.0 112.712 -171.536 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 54.1 t -51.83 -47.33 64.41 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 167.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 13.9 ttt85 -61.22 -42.56 98.83 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 118.059 -0.972 . . . . 0.0 112.862 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -56.62 -47.78 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 CA-C-N 121.176 1.807 . . . . 0.0 111.176 171.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 40.7 mt -66.94 -50.68 61.59 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 118.919 -0.562 . . . . 0.0 111.397 -178.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 p -70.14 -25.38 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 CA-C-N 119.163 0.892 . . . . 0.0 111.265 -177.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.33 -43.87 63.47 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-O 117.566 -1.207 . . . . 0.0 110.414 167.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 9.7 mt -60.08 -27.09 66.71 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.539 1.518 . . . . 0.0 115.042 -178.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -44.71 -28.84 0.67 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 126.717 2.007 . . . . 0.0 111.925 168.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -120.08 -31.27 4.47 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 129.556 3.142 . . . . 0.0 113.784 169.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.79 16.43 4.23 Favored Glycine 0 N--CA 1.468 0.793 0 C-N-CA 130.019 3.676 . . . . 0.0 115.999 -163.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 20.0 m -58.49 30.39 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 127.609 2.364 . . . . 0.0 117.361 170.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 71.1 m -87.64 -69.06 0.71 Allowed 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.793 -1.192 . . . . 0.0 113.442 178.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -159.54 158.3 27.51 Favored Pre-proline 0 N--CA 1.475 0.781 0 CA-C-N 120.266 1.394 . . . . 0.0 114.341 -172.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -57.07 115.31 2.41 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 122.451 2.101 . . . . 0.0 109.28 170.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 93.66 1.45 65.92 Favored Glycine 0 CA--C 1.532 1.143 0 CA-C-O 117.348 -1.807 . . . . 0.0 115.313 -174.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . 0.494 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -63.56 -39.5 94.57 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 120.566 2.183 . . . . 0.0 110.007 168.91 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 9.9 mt -56.52 -24.29 45.51 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 124.69 1.196 . . . . 0.0 110.986 -177.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.8 -31.62 62.8 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.289 -0.882 . . . . 0.0 112.219 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.45 -55.97 5.05 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.96 0.904 . . . . 0.0 111.198 171.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . 0.494 ' CD2' HE22 ' B' ' 39' ' ' GLN . 3.2 m-70 -54.51 -29.27 49.95 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 19.5 mt -105.34 -14.58 15.29 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.197 1.399 . . . . 0.0 112.887 -175.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 65.51 14.17 59.68 Favored Glycine 0 CA--C 1.53 0.978 0 C-N-CA 124.323 0.963 . . . . 0.0 113.2 -173.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 39.9 mt -120.3 158.66 26.59 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.184 0.992 . . . . 0.0 112.214 -168.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 20.4 p -66.03 154.65 38.93 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.468 0.651 . . . . 0.0 111.151 -169.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -60.99 -19.76 61.62 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.701 -0.624 . . . . 0.0 111.806 173.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 13.6 m -72.27 -53.55 12.15 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.841 1.256 . . . . 0.0 110.931 168.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -59.22 -37.23 77.0 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.616 1.166 . . . . 0.0 112.024 176.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 10.5 t -63.79 -43.3 97.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 124.293 1.037 . . . . 0.0 112.348 169.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 18.1 m -61.02 -45.12 96.1 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 120.462 1.483 . . . . 0.0 112.069 173.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 -57.41 -28.11 62.97 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 127.31 2.244 . . . . 0.0 113.089 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . 0.513 ' CD2' ' HB ' ' B' ' 22' ' ' THR . 35.3 m-70 -99.29 -20.12 16.72 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 173.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 50.0 mt -77.71 -22.52 50.3 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 117.039 -1.458 . . . . 0.0 114.875 170.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -44.97 -69.89 0.12 Allowed 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 121.987 2.176 . . . . 0.0 113.888 175.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.5 t -63.9 -42.97 97.3 Favored 'General case' 0 C--O 1.215 -0.76 0 C-N-CA 124.384 1.074 . . . . 0.0 109.916 -178.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.04 -39.63 28.08 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.994 1.318 . . . . 0.0 113.531 176.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 49.1 mtm180 -87.36 -19.91 27.47 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.57 -31.46 10.32 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 125.323 1.439 . . . . 0.0 114.902 175.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 85.1 m -67.27 -10.77 54.04 Favored 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 128.365 2.666 . . . . 0.0 112.501 169.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.31 19.16 78.6 Favored Glycine 0 CA--C 1.529 0.952 0 C-N-CA 124.685 1.136 . . . . 0.0 113.54 -174.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 83.0 mt -78.3 -30.71 48.49 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.401 1.1 . . . . 0.0 112.704 175.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 19.6 t -133.5 137.0 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 125.485 1.514 . . . . 0.0 111.259 -170.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 42.4 t -133.97 144.84 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.034 1.334 . . . . 0.0 110.825 -169.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -86.81 137.85 32.07 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.124 1.37 . . . . 0.0 111.38 173.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 18.2 m -161.45 170.04 20.75 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.891 1.676 . . . . 0.0 107.652 -171.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -91.3 145.49 24.61 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 120.419 1.463 . . . . 0.0 113.434 171.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.262 0.0 OUTLIER -88.16 -16.81 32.38 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.492 0.717 . . . . 0.0 110.928 164.667 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 128.28 -35.55 2.68 Favored Glycine 0 CA--C 1.535 1.308 0 C-N-CA 127.407 2.432 . . . . 0.0 113.201 172.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 13.1 ttm180 -96.36 -35.75 11.09 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 129.07 2.948 . . . . 0.0 111.62 170.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -143.62 163.23 33.81 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 127.171 2.188 . . . . 0.0 109.827 -169.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 33.7 m -82.81 153.2 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-O 121.309 0.576 . . . . 0.0 111.652 169.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -136.35 159.02 43.03 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 127.071 2.148 . . . . 0.0 109.845 -171.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -99.54 147.37 25.4 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 162.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -147.42 156.12 42.58 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 123.679 0.792 . . . . 0.0 109.133 178.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 40.5 mt -60.58 154.13 21.87 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 168.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.59 -26.81 68.01 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -171.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -174.79 164.43 3.53 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.108 2.163 . . . . 0.0 110.673 169.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.2 m -35.59 -34.78 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 129.749 3.22 . . . . 0.0 113.213 165.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -61.88 -43.32 99.08 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.03 1.332 . . . . 0.0 111.767 -179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 11.6 mt -74.31 -44.3 53.16 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.985 1.266 . . . . 0.0 110.045 172.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.08 -28.11 16.35 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.661 1.184 . . . . 0.0 112.313 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 39.5 mtt180 -72.23 -63.32 1.17 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.013 1.725 . . . . 0.0 114.682 170.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.33 -13.93 9.89 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 120.129 -1.607 . . . . 0.0 113.303 175.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 5.3 tp -86.09 -44.34 12.34 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 127.5 2.32 . . . . 0.0 112.824 168.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -83.83 -58.26 2.28 Favored Glycine 0 N--CA 1.476 1.305 0 C-N-CA 127.428 2.442 . . . . 0.0 114.428 -174.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 9.4 pm0 -67.89 -14.73 63.19 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 119.882 1.841 . . . . 0.0 110.232 165.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . 0.556 ' C ' ' H ' ' B' ' 91' ' ' GLN . 43.3 tp 76.55 160.0 0.22 Allowed 'General case' 0 C--N 1.346 0.437 0 C-N-CA 129.63 3.172 . . . . 0.0 110.558 169.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 28.9 m -66.79 18.8 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 120.856 -1.152 . . . . 0.0 112.401 168.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.556 ' H ' ' C ' ' B' ' 89' ' ' LEU . 33.3 mm-40 72.48 -0.91 3.13 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.815 1.246 . . . . 0.0 113.268 166.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.9 p -60.57 34.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 130.107 3.363 . . . . 0.0 115.455 173.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.263 30.0 m 52.03 14.6 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 130.266 3.426 . . . . 0.0 116.201 175.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 41.9 tp 109.93 101.92 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 130.45 3.5 . . . . 0.0 109.697 -174.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.45 69.46 0.15 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.675 1.19 . . . . 0.0 111.592 168.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -63.56 161.9 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 125.715 1.606 . . . . 0.0 112.353 174.186 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -70.16 -0.65 8.22 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 127.026 2.13 . . . . 0.0 114.331 173.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 18.4 p -60.97 112.51 2.1 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.541 1.936 . . . . 0.0 110.872 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -72.26 137.21 46.62 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 172.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -156.79 130.3 4.63 Favored Pre-proline 0 N--CA 1.446 -0.638 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 175.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . 0.463 ' C ' ' H ' ' B' ' 103' ' ' VAL 0.282 51.7 Cg_endo -70.21 114.29 3.73 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 CA-C-N 121.489 1.568 . . . . 0.0 114.776 -165.935 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 37.9 t 66.38 -63.45 0.25 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 130.562 3.545 . . . . 0.0 108.164 -163.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . 0.463 ' H ' ' C ' ' B' ' 101' ' ' PRO . 2.1 p 153.17 -40.25 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.845 1 C-N-CA 134.995 5.318 . . . . 0.0 108.294 -168.855 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -75.12 4.91 5.99 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 116.947 2.202 . . . . 0.0 116.947 -168.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.07 -173.62 3.51 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 120.02 1.282 . . . . 0.0 110.656 -169.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.3 ttm-85 . . . . . 0 N--CA 1.467 0.415 0 N-CA-C 116.118 1.896 . . . . 0.0 116.118 -173.204 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.45 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.0 mp -62.03 -27.09 68.64 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.596 1.558 . . . . 0.0 113.117 -167.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.74 -50.07 33.47 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.421 -0.799 . . . . 0.0 111.139 169.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.4 mmt85 -60.13 -35.55 75.52 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.236 -1.54 . . . . 0.0 112.566 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -56.27 -56.92 15.03 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 126.55 1.94 . . . . 0.0 110.72 178.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -75.02 -30.76 58.7 Favored Glycine 0 CA--C 1.531 1.084 0 CA-C-N 119.28 0.946 . . . . 0.0 112.54 -178.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -61.62 -28.84 69.65 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 118.501 1.151 . . . . 0.0 112.027 169.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.465 ' CB ' HH21 ' A' ' 23' ' ' ARG . . . -85.77 -21.48 28.17 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.285 2.234 . . . . 0.0 114.356 173.182 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.9 tp -78.45 -28.84 46.68 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.101 1.76 . . . . 0.0 110.005 177.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -108.04 62.81 0.61 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.599 1.16 . . . . 0.0 112.197 168.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -125.46 141.58 39.34 Favored Pre-proline 0 CA--C 1.557 1.232 0 C-N-CA 127.686 2.394 . . . . 0.0 107.047 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -45.84 -90.46 0.0 OUTLIER 'Trans proline' 0 C--N 1.356 0.944 1 C-N-CA 127.634 5.556 . . . . 0.0 117.073 -163.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.507 ' HG1' ' CD2' ' A' ' 54' ' ' HIS . 6.2 m -46.96 -27.43 1.27 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.437 1.895 . . . . 0.0 111.987 169.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.503 ' HD3' ' HD1' ' A' ' 54' ' ' HIS . 1.8 ttp180 -73.3 -45.89 52.82 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 126.012 1.725 . . . . 0.0 113.644 -168.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.9 t -54.35 -48.82 71.01 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 120.229 1.377 . . . . 0.0 110.324 168.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 -52.45 -52.38 54.42 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-O 117.945 -1.026 . . . . 0.0 112.127 173.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.3 mt -50.52 -50.17 22.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 CA-C-N 121.03 1.741 . . . . 0.0 111.767 172.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 93.6 mt -69.55 -37.58 77.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 118.28 -0.866 . . . . 0.0 112.608 -170.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.3 p -74.74 -21.34 17.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 CA-C-N 119.19 0.904 . . . . 0.0 111.985 174.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.9 -44.29 27.53 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 118.077 -0.963 . . . . 0.0 110.764 168.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.4 mt -62.18 -18.96 62.52 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -176.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.6 mt -53.29 -22.11 6.57 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 124.528 1.131 . . . . 0.0 111.665 166.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -129.17 -29.11 2.29 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 128.815 2.846 . . . . 0.0 113.564 169.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.25 11.21 2.98 Favored Glycine 0 N--CA 1.473 1.156 0 C-N-CA 128.941 3.162 . . . . 0.0 116.057 -165.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 27.7 m -66.46 39.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 C-N-CA 128.21 2.604 . . . . 0.0 115.721 172.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 5.1 t -100.81 -60.42 1.53 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.416 1.086 . . . . 0.0 113.033 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 53.6 p90 -158.21 154.97 25.09 Favored Pre-proline 0 N--CA 1.478 0.927 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -178.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -61.01 116.88 3.65 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.525 2.15 . . . . 0.0 109.538 175.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.41 -12.19 59.94 Favored Glycine 0 C--O 1.22 -0.772 0 CA-C-O 115.986 -2.563 . . . . 0.0 114.75 -175.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -29.26 68.96 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-N 120.629 2.214 . . . . 0.0 111.838 175.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 17.9 mt -63.13 -18.97 64.02 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.311 0.644 . . . . 0.0 110.775 177.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.52 -42.37 96.31 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 119.444 1.02 . . . . 0.0 110.472 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.45 -51.16 66.86 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.517 1.053 . . . . 0.0 112.348 173.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -57.27 -36.69 71.32 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.6 mt -101.82 -14.49 17.26 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -170.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.08 10.97 36.24 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 114.676 0.63 . . . . 0.0 114.676 -172.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.0 mp -101.16 141.52 33.92 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 173.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.3 t -59.1 147.8 33.63 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 121.909 -0.495 . . . . 0.0 111.277 -176.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -57.09 -27.99 62.23 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.253 1.021 . . . . 0.0 113.439 -171.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.8 p -69.41 -55.44 10.32 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.261 -0.9 . . . . 0.0 112.767 170.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -54.57 -49.06 71.26 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.08 0.952 . . . . 0.0 112.12 177.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 84.9 t -59.56 -40.69 82.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 O-C-N 121.803 -0.561 . . . . 0.0 111.065 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 46.5 m -69.99 -27.24 64.54 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 178.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 32.0 t-20 -58.93 -45.36 90.57 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.019 0.827 . . . . 0.0 110.94 170.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.507 ' CD2' ' HG1' ' A' ' 22' ' ' THR . 40.0 m-70 -71.65 -22.65 61.66 Favored 'General case' 0 CA--C 1.551 1.019 0 O-C-N 120.146 -1.596 . . . . 0.0 114.268 170.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 73.6 mt -70.55 -25.35 63.05 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 120.62 1.555 . . . . 0.0 111.697 168.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.14 -42.1 63.07 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.121 0.873 . . . . 0.0 111.736 170.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 2.4 t -83.68 -39.45 20.18 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 119.483 1.038 . . . . 0.0 111.886 -178.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 tp -52.31 -42.33 63.71 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.609 1.564 . . . . 0.0 113.408 175.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.8 mtm180 -85.19 -1.07 56.49 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.493 1.117 . . . . 0.0 112.025 -179.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -109.17 -41.84 1.35 Allowed Glycine 0 N--CA 1.477 1.413 0 C-N-CA 126.159 1.838 . . . . 0.0 113.201 175.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.7 m -59.49 -16.62 25.45 Favored 'General case' 0 CA--C 1.561 1.394 0 C-N-CA 127.515 2.326 . . . . 0.0 112.785 169.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.98 20.0 74.02 Favored Glycine 0 C--N 1.343 0.953 0 C-N-CA 125.714 1.626 . . . . 0.0 113.987 -176.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.6 mt -71.12 -23.98 62.19 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.303 1.441 . . . . 0.0 113.13 171.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 13.7 t -142.6 144.97 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -166.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 9.6 t -133.42 141.63 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 C-N-CA 125.276 1.43 . . . . 0.0 109.479 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -96.67 148.52 22.78 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.377 1.071 . . . . 0.0 112.526 175.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.9 p -133.91 144.85 49.11 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.634 0.774 . . . . 0.0 109.674 172.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -94.96 107.97 20.02 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 125.376 1.47 . . . . 0.0 108.978 169.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.78 14.24 0.22 Allowed 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -176.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.2 -17.48 26.61 Favored Glycine 0 CA--C 1.529 0.933 0 C-N-CA 126.008 1.766 . . . . 0.0 113.189 -177.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 20.3 ttp-105 -158.17 -48.15 0.06 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.658 1.183 . . . . 0.0 112.103 -169.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -93.75 173.76 7.52 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.096 1.758 . . . . 0.0 110.317 171.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 20.6 m -122.77 149.28 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 125.014 1.325 . . . . 0.0 108.664 167.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.5 ptt85 -138.14 177.12 8.12 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.877 1.671 . . . . 0.0 109.372 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -117.03 174.69 5.96 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.035 0.934 . . . . 0.0 110.893 168.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -168.87 145.97 3.7 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 126.385 1.874 . . . . 0.0 109.859 177.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 91.0 mt -56.23 148.76 17.61 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 123.505 0.503 . . . . 0.0 110.589 169.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.15 -28.5 60.16 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.875 1.806 . . . . 0.0 115.875 -168.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -156.16 160.12 39.6 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 124.195 1.95 . . . . 0.0 112.988 170.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -40.32 -28.85 0.07 Allowed 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 130.49 3.516 . . . . 0.0 113.831 165.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -60.15 -62.16 2.07 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 126.484 1.914 . . . . 0.0 110.653 171.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.8 mt -62.31 -47.65 83.34 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -176.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.69 -48.06 66.82 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.7 ptp180 -75.55 -37.2 60.17 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -175.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -76.7 -39.41 52.07 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.455 1.025 . . . . 0.0 110.69 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.99 -32.32 70.74 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.216 -0.928 . . . . 0.0 110.163 169.177 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.86 -18.56 76.21 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 125.712 1.625 . . . . 0.0 115.401 171.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.38 -20.36 63.83 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 120.04 1.92 . . . . 0.0 110.259 166.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 13.5 tp 66.91 61.86 0.5 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 128.101 2.56 . . . . 0.0 109.877 -169.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 61.9 t -25.88 128.17 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 128.035 2.534 . . . . 0.0 114.557 -172.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.444 ' C ' ' H ' ' A' ' 93' ' ' VAL . 0.8 OUTLIER -94.3 6.86 47.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 112.758 -2.019 . . . . 0.0 111.269 -109.688 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.8 p -63.71 34.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 130.239 3.416 . . . . 0.0 113.382 169.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.444 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.5 t 69.63 18.18 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.983 0 C-N-CA 125.534 1.534 . . . . 0.0 112.004 168.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 5.4 tt 103.0 102.93 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 131.342 3.857 . . . . 0.0 108.749 -173.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.46 76.22 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 115.34 1.608 . . . . 0.0 115.34 176.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 99.2 t -58.73 153.51 3.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 127.419 2.288 . . . . 0.0 111.241 169.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -59.48 -0.24 0.15 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 127.752 2.421 . . . . 0.0 116.813 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 31.3 p -49.01 101.53 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.214 1.406 . . . . 0.0 113.394 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -99.21 141.08 32.44 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 164.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -138.34 141.8 32.86 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 -169.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -54.85 -29.44 63.22 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 123.325 2.684 . . . . 0.0 114.779 -171.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 10.4 t 74.74 -161.33 0.07 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 126.829 2.052 . . . . 0.0 112.189 169.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 2.6 t 54.21 28.03 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 C-N-CA 125.545 1.538 . . . . 0.0 111.02 -173.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . 0.271 . . 90.97 9.14 0.06 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 128.89 2.876 . . . . 0.0 114.951 -177.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -96.19 151.0 19.9 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.271 1.429 . . . . 0.0 111.67 168.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.547 0.836 0 C-N-CA 127.484 2.314 . . . . 0.0 110.715 -177.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.459 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 5.0 mp -72.88 -19.17 61.34 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -167.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -81.67 -43.96 17.8 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.945 0.793 . . . . 0.0 110.736 166.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 12.0 mmt85 -62.32 -32.06 72.77 Favored 'General case' 0 N--CA 1.473 0.7 0 O-C-N 120.394 -1.441 . . . . 0.0 112.394 178.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -46.04 -63.9 0.87 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 127.896 2.478 . . . . 0.0 110.725 170.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.76 -31.33 62.6 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 119.758 -1.211 . . . . 0.0 112.491 -174.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -66.79 -27.72 67.81 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.448 1.099 . . . . 0.0 112.285 174.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -86.43 -21.58 27.02 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 127.556 2.342 . . . . 0.0 113.727 175.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.0 mp -84.37 -45.19 13.0 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.045 0.838 . . . . 0.0 109.901 173.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.91 49.16 1.32 Allowed 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.204 -0.935 . . . . 0.0 112.162 169.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -117.75 134.57 23.22 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 128.587 2.755 . . . . 0.0 106.567 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -46.3 -90.13 0.0 OUTLIER 'Trans proline' 0 CA--C 1.537 0.672 1 C-N-CA 126.545 4.83 . . . . 0.0 115.682 -164.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.409 ' HB ' ' CD2' ' B' ' 54' ' ' HIS . 91.3 m -54.63 -26.79 35.1 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.764 1.226 . . . . 0.0 111.251 174.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . 0.549 ' HD3' ' HD1' ' B' ' 54' ' ' HIS . 6.6 mtp180 -74.13 -36.7 64.2 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 117.062 -1.447 . . . . 0.0 114.355 -171.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 41.4 t -58.04 -51.15 70.85 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.521 1.509 . . . . 0.0 109.364 168.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 38.8 mtp180 -51.89 -45.37 64.15 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 124.854 1.261 . . . . 0.0 111.825 173.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 7.0 mt -52.8 -67.05 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 CA-C-N 120.167 1.349 . . . . 0.0 110.099 169.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 87.4 mt -53.68 -37.99 63.75 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -168.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 7.2 p -72.29 -24.28 22.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-N 119.484 1.038 . . . . 0.0 113.75 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -95.35 -18.58 20.64 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.017 1.327 . . . . 0.0 113.461 173.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.04 -50.3 71.19 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.901 1.681 . . . . 0.0 109.102 175.046 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -39.11 -53.12 1.86 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 130.514 3.526 . . . . 0.0 113.639 -174.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -101.55 -15.48 17.09 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.556 1.942 . . . . 0.0 112.619 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.62 -65.31 2.17 Favored Glycine 0 C--N 1.341 0.808 0 C-N-CA 125.501 1.524 . . . . 0.0 112.005 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 29.6 m 27.21 40.14 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 N-CA-C 116.664 2.098 . . . . 0.0 116.664 -173.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -92.11 -73.71 0.54 Allowed 'General case' 0 N--CA 1.465 0.302 0 O-C-N 121.394 -0.816 . . . . 0.0 112.365 -167.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . 0.405 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 34.7 p90 -151.18 163.53 23.33 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 124.168 0.987 . . . . 0.0 113.441 -178.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -51.76 117.2 3.3 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 122.507 2.138 . . . . 0.0 110.953 170.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.06 -4.57 84.72 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-O 118.383 -1.232 . . . . 0.0 115.16 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . 0.405 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 0.0 OUTLIER -56.29 -18.53 10.91 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 120.371 2.085 . . . . 0.0 114.848 175.966 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.8 mt -75.46 -15.97 60.37 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 124.325 1.05 . . . . 0.0 110.894 178.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.76 -39.16 87.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 119.398 0.999 . . . . 0.0 112.698 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.77 -42.06 77.96 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.803 170.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -62.19 -36.79 82.98 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 176.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 27.0 mt -101.69 -17.37 16.32 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 -169.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.1 13.15 47.4 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-O 121.961 0.756 . . . . 0.0 113.844 -169.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mp -99.44 131.14 45.65 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 169.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 11.8 t -56.38 148.83 18.01 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -176.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -55.19 -23.87 24.08 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.482 1.513 . . . . 0.0 114.382 -175.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 60.7 p -72.98 -53.17 11.87 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.292 1.405 . . . . 0.0 112.339 169.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 63.7 t-20 -57.52 -47.19 82.64 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.357 1.063 . . . . 0.0 111.916 -178.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 27.4 t -63.11 -36.59 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 O-C-N 121.203 -0.935 . . . . 0.0 111.54 177.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 55.3 m -71.87 -29.72 64.67 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -55.48 -45.85 76.92 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 122.089 0.947 . . . . 0.0 110.54 170.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . 0.549 ' HD1' ' HD3' ' B' ' 23' ' ' ARG . 18.6 m-70 -71.73 -23.16 61.57 Favored 'General case' 0 CA--C 1.556 1.199 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 171.069 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 65.9 mt -74.85 -18.71 60.4 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-N 121.192 1.814 . . . . 0.0 112.175 168.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.36 -50.17 70.38 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.21 0.914 . . . . 0.0 110.581 172.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 6.1 t -76.01 -39.45 55.73 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 118.554 0.615 . . . . 0.0 112.236 -177.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 4.8 tp -56.05 -40.87 74.15 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.845 1.658 . . . . 0.0 112.361 -175.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 -81.32 -9.75 59.69 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.717 1.207 . . . . 0.0 112.33 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -93.17 -39.42 5.13 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 125.076 1.322 . . . . 0.0 111.827 169.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 43.5 m -58.07 -18.18 22.96 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 127.528 2.331 . . . . 0.0 113.216 169.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 81.51 -9.52 54.8 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 125.709 1.624 . . . . 0.0 113.838 -176.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 92.5 mt -51.41 -31.63 23.4 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 128.079 2.551 . . . . 0.0 114.315 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -129.91 138.87 52.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 C-N-CA 126.376 1.87 . . . . 0.0 109.44 177.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 51.2 t -122.02 135.9 60.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 C-N-CA 127.153 2.181 . . . . 0.0 108.713 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -87.54 136.05 33.1 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.589 0.756 . . . . 0.0 112.42 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 14.1 p -136.74 148.08 47.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.492 0.717 . . . . 0.0 110.566 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -100.09 107.25 19.1 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.964 1.306 . . . . 0.0 110.198 175.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.83 9.46 0.38 Allowed 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 116.2 1.926 . . . . 0.0 116.2 -177.405 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 116.24 -17.93 14.24 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.921 1.724 . . . . 0.0 113.083 -177.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 20.0 ttp-105 -157.88 -42.99 0.06 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.447 1.499 . . . . 0.0 111.957 -169.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -102.27 171.64 7.35 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.259 1.824 . . . . 0.0 111.136 175.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 23.8 m -120.01 143.06 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.017 1.327 . . . . 0.0 110.377 168.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.2 ptt180 -131.98 175.1 9.51 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.041 1.336 . . . . 0.0 110.808 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -122.65 125.65 46.03 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.556 1.142 . . . . 0.0 108.588 167.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -123.61 150.42 44.15 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.451 1.1 . . . . 0.0 110.365 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 tp -53.02 145.26 13.34 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.585 1.154 . . . . 0.0 110.326 172.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.27 -37.9 84.83 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 -173.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -169.11 161.41 10.37 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 123.698 1.713 . . . . 0.0 112.592 -174.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -34.96 -39.45 0.1 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 130.662 3.585 . . . . 0.0 113.162 165.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -50.79 -67.39 0.26 Allowed 'General case' 0 C--N 1.345 0.386 0 C-N-CA 127.033 2.133 . . . . 0.0 111.877 173.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 16.8 mt -62.35 -37.46 85.75 Favored 'General case' 0 C--O 1.223 -0.336 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.6 -41.89 98.3 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 118.471 -0.776 . . . . 0.0 112.276 -174.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -71.45 -52.06 20.49 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-O 117.878 -1.058 . . . . 0.0 111.772 174.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.79 -38.01 89.5 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 120.109 1.322 . . . . 0.0 112.311 -173.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.85 -29.16 64.09 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.39 -0.819 . . . . 0.0 112.109 173.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -87.09 -29.75 21.97 Favored Glycine 0 CA--C 1.543 1.796 0 C-N-CA 124.847 1.213 . . . . 0.0 116.022 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -89.04 -8.68 53.5 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.971 1.709 . . . . 0.0 112.82 171.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 13.7 tp 85.69 84.94 0.02 OUTLIER 'General case' 0 C--O 1.239 0.521 0 C-N-CA 128.801 2.84 . . . . 0.0 114.18 166.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 55.4 t -46.89 131.3 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-O 124.624 2.155 . . . . 0.0 110.172 169.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . 0.288 2.0 tp-100 -100.19 10.76 40.76 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 111.902 -2.408 . . . . 0.0 112.501 -120.021 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 6.7 p -67.32 42.39 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.71 1 C-N-CA 132.674 4.389 . . . . 0.0 110.853 166.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 56.73 9.24 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 C-N-CA 129.326 3.05 . . . . 0.0 116.247 177.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 7.3 tt 97.41 106.06 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 129.902 3.281 . . . . 0.0 104.415 -165.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.28 86.15 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 -177.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 57.1 t -64.47 147.3 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 125.608 1.563 . . . . 0.0 108.073 167.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -59.47 -3.28 0.42 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.852 2.061 . . . . 0.0 116.346 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 12.2 p -44.17 95.11 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.012 1.725 . . . . 0.0 113.201 176.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -99.88 145.1 28.17 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 168.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -148.12 144.3 18.69 Favored Pre-proline 0 C--N 1.322 -0.616 0 C-N-CA 125.878 1.671 . . . . 0.0 107.105 -168.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.7 -28.94 39.7 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 123.652 2.901 . . . . 0.0 115.793 -171.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 47.9 t 72.86 -161.24 0.1 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 127.296 2.239 . . . . 0.0 111.886 174.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.2 t 56.51 22.43 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 126.304 1.841 . . . . 0.0 111.661 -170.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . 0.278 . . 89.45 8.09 0.1 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 128.548 2.739 . . . . 0.0 115.251 -174.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -86.87 146.89 26.02 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.43 1.092 . . . . 0.0 111.252 169.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.558 0 C-N-CA 126.152 1.781 . . . . 0.0 110.23 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.651 0 CA-C-O 120.672 0.273 . . . . 0.0 111.72 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -65.98 -46.54 77.67 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -169.06 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.97 -60.3 3.5 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 118.249 -0.881 . . . . 0.0 112.43 -177.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.5 ptp85 -61.33 -35.41 77.31 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.658 1.117 . . . . 0.0 112.69 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -59.55 -63.11 1.42 Allowed 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.805 0.842 . . . . 0.0 110.793 174.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.83 -31.34 62.42 Favored Glycine 0 C--N 1.337 0.588 0 CA-C-O 118.222 -1.321 . . . . 0.0 112.388 -169.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.77 -8.1 32.86 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.032 1.916 . . . . 0.0 114.269 173.102 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.47 -6.23 14.47 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.153 1.381 . . . . 0.0 112.753 169.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.7 tp -96.07 -37.71 10.5 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.227 1.411 . . . . 0.0 110.381 176.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.61 34.69 0.33 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 128.149 2.58 . . . . 0.0 115.469 -172.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -103.0 165.76 13.06 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 129.785 3.234 . . . . 0.0 113.209 -168.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -69.57 -104.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.549 1.258 1 C-N-CA 126.206 4.604 . . . . 0.0 110.832 168.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -46.9 -37.99 9.77 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 127.346 2.259 . . . . 0.0 112.877 176.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -32.7 73.95 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 117.964 -1.017 . . . . 0.0 113.505 -176.523 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.462 ' HG ' ' HB1' ' A' ' 95' ' ' ALA . 40.6 t -60.74 -52.14 66.36 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 119.041 0.837 . . . . 0.0 109.826 169.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 78.7 mtt-85 -52.61 -45.43 66.57 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.175 1.39 . . . . 0.0 113.239 175.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.8 mt -45.27 -63.94 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 C-N-CA 124.028 0.931 . . . . 0.0 110.887 169.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.9 mt -60.9 -42.23 97.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.774 -1.103 . . . . 0.0 112.462 -170.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -63.02 -25.61 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 CA-C-N 119.016 0.826 . . . . 0.0 112.354 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -89.2 -26.4 21.26 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.505 0.722 . . . . 0.0 112.867 175.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.31 -39.46 94.62 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.278 1.431 . . . . 0.0 112.639 -175.632 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 mt -41.13 -44.36 2.49 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 128.119 2.568 . . . . 0.0 111.809 173.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -112.59 11.63 19.68 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 126.966 2.106 . . . . 0.0 112.251 173.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.29 -4.91 19.94 Favored Glycine 0 N--CA 1.47 0.949 0 C-N-CA 127.61 2.528 . . . . 0.0 114.357 -170.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.6 m -40.95 67.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 C-N-CA 127.85 2.46 . . . . 0.0 117.344 166.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 52.0 m -133.25 -61.16 0.83 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.844 1.257 . . . . 0.0 114.168 -178.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -161.69 163.02 20.2 Favored Pre-proline 0 N--CA 1.479 0.993 0 CA-C-N 120.647 1.567 . . . . 0.0 115.143 -177.159 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -57.65 131.33 43.59 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.633 2.222 . . . . 0.0 108.159 168.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.87 1.72 59.69 Favored Glycine 0 CA--C 1.528 0.896 0 CA-C-O 116.993 -2.004 . . . . 0.0 114.928 -176.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -35.96 73.33 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 121.143 2.471 . . . . 0.0 110.766 170.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 mt -59.32 -20.9 58.3 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 125.838 1.655 . . . . 0.0 112.071 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.5 -35.09 76.7 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.931 -0.481 . . . . 0.0 111.833 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.71 -45.62 61.26 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.586 0.754 . . . . 0.0 111.18 171.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.4 m-70 -59.21 -37.39 77.34 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 177.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 21.0 mt -99.33 -16.47 18.44 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.441 1.096 . . . . 0.0 113.676 -173.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.68 8.02 71.05 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-N 119.105 0.866 . . . . 0.0 113.803 -170.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.7 mt -110.91 147.75 33.95 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.695 1.198 . . . . 0.0 111.276 -173.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.8 t -58.37 136.77 57.49 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.568 0.699 . . . . 0.0 112.089 -173.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 38.6 ptt180 -57.73 -33.66 68.68 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.428 1.091 . . . . 0.0 112.912 -176.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.8 m -61.88 -43.08 99.58 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.606 0.762 . . . . 0.0 111.509 174.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -80.08 -39.42 29.7 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 59.9 t -60.33 -38.63 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-N 119.521 1.055 . . . . 0.0 110.773 173.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 14.9 m -70.02 -21.11 63.23 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 177.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -57.01 -45.22 83.2 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-O 123.301 1.524 . . . . 0.0 110.806 174.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -69.94 -14.16 62.58 Favored 'General case' 0 CA--C 1.561 1.388 0 C-N-CA 125.857 1.663 . . . . 0.0 114.63 170.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 95.5 mt -81.11 -26.98 35.77 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 120.662 -1.274 . . . . 0.0 112.353 172.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.8 t -47.23 -50.89 20.19 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.204 0.911 . . . . 0.0 111.94 -178.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 41.5 t -86.8 -23.29 25.43 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 178.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.6 tp -58.49 -39.33 79.7 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 121.031 1.741 . . . . 0.0 111.199 171.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -77.88 -24.93 48.33 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.526 1.53 . . . . 0.0 112.021 176.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.55 -52.22 4.27 Favored Glycine 0 CA--C 1.534 1.264 0 C-N-CA 124.951 1.263 . . . . 0.0 113.462 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 17.5 m -64.75 -2.05 2.28 Favored 'General case' 0 CA--C 1.562 1.415 0 C-N-CA 125.903 1.681 . . . . 0.0 113.278 171.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.26 6.67 87.81 Favored Glycine 0 C--N 1.344 1.011 0 C-N-CA 124.987 1.279 . . . . 0.0 114.375 170.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.6 mt -66.68 -36.89 83.6 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 118.175 0.988 . . . . 0.0 111.818 -177.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.5 m -113.22 135.8 51.59 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.101 0 C-N-CA 125.881 1.672 . . . . 0.0 110.818 170.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 46.9 t -116.71 141.84 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 125.614 1.566 . . . . 0.0 108.784 176.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.11 142.32 49.16 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.753 0.821 . . . . 0.0 113.063 174.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.0 m -134.21 144.81 48.66 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 169.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -83.54 103.84 13.2 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 118.697 0.68 . . . . 0.0 109.536 168.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.269 1.3 pp20? -70.79 -161.11 0.05 OUTLIER 'General case' 0 CA--C 1.558 1.267 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 168.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -60.59 -28.32 67.54 Favored Glycine 0 CA--C 1.535 1.31 0 O-C-N 119.695 -1.878 . . . . 0.0 115.801 -169.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.0 tpt85 -158.03 14.5 0.21 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 174.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.29 174.0 11.28 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.618 1.567 . . . . 0.0 110.075 -177.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 9.1 p -87.49 139.16 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 167.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.25 165.41 16.24 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 125.334 1.453 . . . . 0.0 109.002 173.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -114.35 152.91 30.71 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 123.116 0.566 . . . . 0.0 109.735 170.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -144.38 143.32 30.88 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 125.777 1.631 . . . . 0.0 109.552 -177.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.01 143.28 22.36 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 168.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.12 -60.94 2.69 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.589 0.631 . . . . 0.0 112.479 -175.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -146.87 165.66 29.06 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.971 1.367 . . . . 0.0 112.02 -175.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -31.91 -36.29 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 130.736 3.614 . . . . 0.0 113.139 166.33 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -48.59 -66.26 0.43 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 127.208 2.203 . . . . 0.0 113.608 172.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 10.7 mt -70.24 -31.9 69.52 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 119.434 1.015 . . . . 0.0 110.179 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.49 -40.64 97.62 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.894 0.77 . . . . 0.0 111.123 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -68.99 -55.46 10.81 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 117.664 -1.16 . . . . 0.0 111.585 169.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.93 -31.6 72.72 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 120.64 1.564 . . . . 0.0 113.36 -172.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.5 tt -71.8 -54.76 9.17 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.765 0.826 . . . . 0.0 109.307 168.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.39 -24.48 75.01 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 124.708 1.147 . . . . 0.0 115.475 -167.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 -74.33 -25.17 59.38 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 126.713 2.005 . . . . 0.0 111.908 168.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.3 tp 76.73 108.71 0.08 Allowed 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 129.336 3.054 . . . . 0.0 110.553 -178.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.8 m -54.17 2.79 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 129.016 2.926 . . . . 0.0 117.099 -176.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 74.73 -5.3 2.16 Favored 'General case' 0 C--O 1.218 -0.577 0 O-C-N 120.21 -1.556 . . . . 0.0 113.217 162.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 p -64.88 43.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 127.951 2.501 . . . . 0.0 113.424 168.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER 59.55 10.34 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.887 0 C-N-CA 128.332 2.653 . . . . 0.0 113.882 174.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 18.9 tp 77.47 107.0 0.08 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 127.254 2.222 . . . . 0.0 107.639 -165.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.462 ' HB1' ' HG ' ' A' ' 24' ' ' CYS . . . -51.4 141.87 14.65 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.834 0.854 . . . . 0.0 112.872 172.534 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.4 m -149.92 165.01 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 127.693 2.397 . . . . 0.0 108.79 -176.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -75.2 26.97 0.09 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.707 2.403 . . . . 0.0 114.593 -172.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 18.2 p -114.46 44.54 1.7 Allowed 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.581 1.953 . . . . 0.0 109.967 168.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 16.4 p30 -68.59 38.93 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 129.232 3.013 . . . . 0.0 113.668 176.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.22 135.81 68.57 Favored Pre-proline 0 CA--C 1.556 1.198 0 C-N-CA 125.778 1.631 . . . . 0.0 110.788 172.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -75.58 -156.11 0.05 OUTLIER 'Trans proline' 0 CA--C 1.544 0.984 1 C-N-CA 126.155 4.57 . . . . 0.0 115.587 -164.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 16.5 t -69.86 -161.18 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 127.825 2.45 . . . . 0.0 114.341 -177.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 45.4 t -153.94 -78.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 128.2 2.6 . . . . 0.0 109.439 -169.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -85.77 40.17 0.84 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.501 1.52 . . . . 0.0 113.967 -176.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -172.98 -176.54 1.43 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.523 2.329 . . . . 0.0 110.708 179.028 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.6 ptt180 . . . . . 0 N--CA 1.476 0.861 0 C-N-CA 125.462 1.505 . . . . 0.0 113.788 172.274 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.544 0 CA-C-O 120.877 0.37 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.78 -46.23 79.5 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-O 118.148 -0.93 . . . . 0.0 113.496 -169.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.77 -61.08 2.53 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.923 -178.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 7.4 ptp85 -61.31 -33.3 73.35 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.613 1.097 . . . . 0.0 112.889 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.54 -65.87 0.62 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.605 0.762 . . . . 0.0 110.233 174.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.57 -28.37 69.53 Favored Glycine 0 C--O 1.22 -0.736 0 CA-C-O 117.288 -1.84 . . . . 0.0 112.395 -169.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.56 -13.03 61.7 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 120.926 2.363 . . . . 0.0 114.343 173.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -108.58 -8.29 15.52 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.438 1.495 . . . . 0.0 112.746 170.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 4.7 tp -93.39 -37.13 12.15 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.848 1.259 . . . . 0.0 110.456 176.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.16 37.42 0.44 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 128.335 2.654 . . . . 0.0 115.324 -176.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.411 ' CG ' ' HE ' ' B' ' 23' ' ' ARG . 0.2 OUTLIER -104.72 165.48 13.2 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 129.141 2.976 . . . . 0.0 112.045 -169.865 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.58 -105.8 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.355 1 C-N-CA 125.975 4.45 . . . . 0.0 111.011 169.377 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -45.89 -36.64 5.52 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 127.194 2.197 . . . . 0.0 113.516 175.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . 0.411 ' HE ' ' CG ' ' B' ' 20' ' ' ASP . 0.0 OUTLIER -66.94 -33.56 75.85 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 -178.377 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 43.8 t -62.2 -49.34 76.17 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.1 0.864 . . . . 0.0 110.109 169.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 80.2 mtt-85 -53.26 -46.91 69.41 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.495 1.118 . . . . 0.0 113.119 174.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 3.5 mt -44.57 -63.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 123.975 0.91 . . . . 0.0 110.504 169.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.44 -39.46 93.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 117.917 -1.039 . . . . 0.0 113.128 -169.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -64.56 -25.23 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.294 0.952 . . . . 0.0 112.418 176.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -89.59 -27.17 20.4 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 174.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.3 -39.6 91.08 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.892 1.277 . . . . 0.0 112.872 -175.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -43.79 -45.51 7.32 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 128.709 2.804 . . . . 0.0 112.116 176.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -108.76 9.56 26.9 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 127.614 2.365 . . . . 0.0 111.569 175.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.19 -33.53 3.67 Favored Glycine 0 C--O 1.222 -0.626 0 CA-C-O 117.015 -1.992 . . . . 0.0 114.395 -169.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 34.3 m -10.88 51.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 N-CA-C 121.787 3.995 . . . . 0.0 121.787 170.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 35.8 m -119.94 -60.51 1.7 Allowed 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.189 -1.569 . . . . 0.0 112.532 -176.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -162.58 165.4 15.37 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 -174.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -58.06 128.82 30.26 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 122.564 2.176 . . . . 0.0 107.879 167.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.13 2.65 73.21 Favored Glycine 0 CA--C 1.528 0.875 0 CA-C-O 116.912 -2.049 . . . . 0.0 114.895 -176.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -39.08 80.58 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 121.44 2.62 . . . . 0.0 110.255 169.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 9.7 mt -58.85 -20.86 54.66 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 126.193 1.797 . . . . 0.0 112.561 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.9 -35.56 80.46 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.703 0.401 . . . . 0.0 111.593 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.95 -46.72 64.67 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.243 0.617 . . . . 0.0 111.15 170.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -58.27 -38.59 77.26 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 114.128 1.158 . . . . 0.0 114.128 178.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 27.8 mt -97.13 -16.55 20.41 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.4 1.08 . . . . 0.0 113.545 -173.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.07 5.14 64.81 Favored Glycine 0 CA--C 1.537 1.445 0 CA-C-N 119.249 0.931 . . . . 0.0 113.931 -169.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 96.5 mt -108.33 146.11 33.45 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.926 1.29 . . . . 0.0 111.251 -173.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 10.3 t -57.83 139.16 54.75 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.485 0.66 . . . . 0.0 112.448 -173.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -58.6 -32.19 68.76 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.208 1.003 . . . . 0.0 112.911 -176.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 4.1 m -62.26 -44.8 95.72 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.636 0.653 . . . . 0.0 111.862 173.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -77.79 -39.99 42.11 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -178.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 61.2 t -60.46 -38.44 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 118.992 0.815 . . . . 0.0 110.695 173.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 18.4 m -69.21 -24.2 63.99 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 177.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -56.09 -43.95 78.53 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 122.916 1.341 . . . . 0.0 111.232 173.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 -74.11 -17.26 60.96 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 125.11 1.364 . . . . 0.0 114.525 170.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 96.0 mt -76.65 -28.99 56.23 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 120.394 1.452 . . . . 0.0 112.297 169.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 7.6 t -46.67 -56.19 6.53 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.95 0.796 . . . . 0.0 111.901 -179.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 52.7 t -78.4 -28.98 47.02 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 118.321 -0.847 . . . . 0.0 113.262 177.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.4 tp -52.2 -41.03 62.34 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 120.84 1.654 . . . . 0.0 111.461 175.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 30.4 mtm180 -81.94 -21.64 37.16 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.283 1.433 . . . . 0.0 112.521 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.71 -39.96 11.4 Favored Glycine 0 N--CA 1.477 1.402 0 C-N-CA 124.969 1.271 . . . . 0.0 113.024 174.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 20.9 m -72.12 -11.79 60.91 Favored 'General case' 0 CA--C 1.561 1.371 0 C-N-CA 126.185 1.794 . . . . 0.0 111.883 169.086 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.96 11.8 85.04 Favored Glycine 0 N--CA 1.472 1.085 0 C-N-CA 124.818 1.199 . . . . 0.0 114.593 169.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 20.7 mt -67.71 -33.87 75.75 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.991 1.316 . . . . 0.0 111.492 -178.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -112.02 145.43 18.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 C-N-CA 127.865 2.466 . . . . 0.0 110.314 170.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.07 143.94 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.902 1.281 . . . . 0.0 110.796 177.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.09 136.67 52.62 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.015 0.926 . . . . 0.0 112.293 171.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 2.8 m -134.28 144.63 48.45 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 106.02 -1.845 . . . . 0.0 106.02 168.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -82.14 103.82 12.03 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.948 0.795 . . . . 0.0 110.13 169.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.27 1.1 pp20? -71.65 -160.49 0.06 Allowed 'General case' 0 CA--C 1.559 1.298 0 CA-C-N 118.249 0.477 . . . . 0.0 111.83 168.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -60.48 -27.54 66.03 Favored Glycine 0 CA--C 1.536 1.373 0 O-C-N 119.53 -1.982 . . . . 0.0 115.607 -169.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 3.4 tpt85 -157.93 11.44 0.19 Allowed 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 174.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.24 176.83 8.68 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.734 1.613 . . . . 0.0 110.724 -177.021 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 7.1 p -90.15 134.45 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 168.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.18 161.99 17.67 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.098 1.759 . . . . 0.0 110.184 174.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -117.29 118.71 33.02 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 121.853 -0.529 . . . . 0.0 110.306 175.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -106.3 149.04 27.31 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.674 1.59 . . . . 0.0 110.724 177.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 tp -58.23 151.86 18.43 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 166.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.14 -66.76 0.47 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.926 0.87 . . . . 0.0 112.923 -174.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -142.07 163.4 32.97 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.953 1.359 . . . . 0.0 111.049 -178.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -32.51 -35.2 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 130.681 3.592 . . . . 0.0 113.159 166.587 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -48.54 -69.77 0.11 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.312 2.245 . . . . 0.0 113.56 170.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.92 -32.35 74.02 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 120.097 1.317 . . . . 0.0 110.266 179.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.08 -41.97 98.73 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.782 0.719 . . . . 0.0 110.896 -177.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 19.0 tpp85 -68.27 -54.17 19.45 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.628 1.171 . . . . 0.0 111.863 171.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.02 -33.78 75.0 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 120.325 1.421 . . . . 0.0 113.347 -173.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 4.7 tt -70.12 -54.49 12.76 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.613 0.765 . . . . 0.0 109.522 168.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.68 -25.12 75.88 Favored Glycine 0 CA--C 1.54 1.609 0 C-N-CA 124.982 1.277 . . . . 0.0 115.282 -167.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -70.78 -29.25 65.4 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 126.461 1.904 . . . . 0.0 111.07 167.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . 0.419 ' C ' ' H ' ' B' ' 91' ' ' GLN . 20.6 tp 81.46 121.21 0.05 OUTLIER 'General case' 0 C--N 1.341 0.222 0 C-N-CA 130.147 3.379 . . . . 0.0 109.581 -172.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 12.0 m -62.01 3.72 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.242 0 C-N-CA 125.208 1.403 . . . . 0.0 114.739 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.419 ' H ' ' C ' ' B' ' 89' ' ' LEU . 21.8 mm-40 71.75 -9.79 0.92 Allowed 'General case' 0 C--O 1.217 -0.612 0 C-N-CA 125.404 1.482 . . . . 0.0 114.605 165.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 7.9 p -59.39 45.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 C-N-CA 129.35 3.06 . . . . 0.0 115.242 171.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.3 t 63.29 5.97 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 128.865 2.866 . . . . 0.0 113.742 173.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 18.6 tp 80.66 109.38 0.07 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 127.608 2.363 . . . . 0.0 106.308 -164.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -50.92 142.96 10.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.506 0.722 . . . . 0.0 112.863 171.062 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 3.7 m -152.22 163.25 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 127.317 2.247 . . . . 0.0 108.766 -175.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -73.98 24.43 0.08 Allowed 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 127.744 2.417 . . . . 0.0 114.697 -173.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 19.5 p -113.68 40.76 2.34 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 126.621 1.968 . . . . 0.0 109.874 168.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 19.2 p-10 -71.23 46.69 0.11 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 129.436 3.094 . . . . 0.0 112.49 177.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.15 138.73 84.09 Favored Pre-proline 0 CA--C 1.556 1.203 0 C-N-CA 126.884 2.074 . . . . 0.0 110.565 175.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -72.1 -162.08 0.11 Allowed 'Trans proline' 0 C--N 1.356 0.95 1 C-N-CA 126.802 5.001 . . . . 0.0 117.401 -163.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 13.0 t -64.49 -158.07 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 125.826 1.65 . . . . 0.0 113.786 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -169.1 -29.29 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 117.042 2.238 . . . . 0.0 117.042 -165.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -139.13 42.06 2.08 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.817 1.19 . . . . 0.0 111.137 -175.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 178.65 -167.77 0.07 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 130.52 3.528 . . . . 0.0 108.138 -169.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.478 0.929 0 C-N-CA 127.225 2.21 . . . . 0.0 112.91 169.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.86 -36.01 77.62 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 117.672 -1.156 . . . . 0.0 113.158 -169.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.6 -58.19 7.03 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 120.72 1.6 . . . . 0.0 111.711 176.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -54.73 -40.09 68.9 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.076 1.35 . . . . 0.0 112.856 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -75.34 -53.89 7.99 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.823 1.249 . . . . 0.0 111.55 177.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.18 -17.98 70.64 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-O 118.103 -1.387 . . . . 0.0 112.895 -175.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.425 HH21 ' CG ' ' B' ' 99' ' ' ASP . 66.2 mtt-85 -56.92 -19.59 18.68 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 119.844 1.822 . . . . 0.0 113.45 168.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.18 -6.53 15.54 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.576 1.151 . . . . 0.0 114.051 169.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.6 tp -101.34 -32.11 10.63 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.728 1.149 . . . . 0.0 111.638 -175.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -87.0 65.8 9.13 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 127.503 2.321 . . . . 0.0 111.133 -178.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -138.07 167.73 18.93 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 125.769 1.628 . . . . 0.0 110.541 -174.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -66.31 -103.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.553 1.432 1 C-N-CA 125.622 4.215 . . . . 0.0 111.059 169.037 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.57 ' HG1' ' CD2' ' A' ' 54' ' ' HIS . 18.0 p -37.56 -45.89 0.79 Allowed 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 128.347 2.659 . . . . 0.0 113.175 169.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.406 ' HA ' HG13 ' A' ' 26' ' ' ILE . 5.1 ttm180 -62.83 -42.45 99.74 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.108 0.867 . . . . 0.0 111.621 -171.579 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 19.5 t -58.27 -53.5 57.6 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 118.324 0.511 . . . . 0.0 110.385 168.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 -53.84 -36.38 62.5 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 178.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.406 HG13 ' HA ' ' A' ' 23' ' ' ARG . 1.5 mt -48.75 -58.43 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 CA-C-N 119.593 1.088 . . . . 0.0 109.039 170.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 79.0 mt -66.21 -37.45 85.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.435 -171.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -69.33 -31.9 51.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 122.719 0.407 . . . . 0.0 111.934 177.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.02 -30.47 31.47 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.356 1.062 . . . . 0.0 112.709 177.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.47 -35.51 81.13 Favored 'General case' 0 C--O 1.224 -0.243 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 177.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.3 mt -46.18 -21.59 0.17 Allowed 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 117.3 -1.333 . . . . 0.0 114.55 169.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -122.38 -35.04 3.18 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 126.392 1.877 . . . . 0.0 113.815 178.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.9 -76.54 0.94 Allowed Glycine 0 N--CA 1.475 1.253 0 C-N-CA 127.043 2.259 . . . . 0.0 113.172 -170.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 1.4 m 45.44 31.29 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 C-N-CA 125.283 1.433 . . . . 0.0 114.82 178.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 32.8 m -88.16 -79.3 0.3 Allowed 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.141 0.976 . . . . 0.0 112.888 -178.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -140.54 154.86 69.74 Favored Pre-proline 0 N--CA 1.478 0.961 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -168.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -66.41 16.05 0.11 Allowed 'Trans proline' 0 CA--C 1.55 1.322 0 C-N-CA 124.668 3.579 . . . . 0.0 115.068 171.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -124.21 -10.37 5.16 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 125.885 1.707 . . . . 0.0 113.688 168.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.59 -39.75 70.33 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.695 1.747 . . . . 0.0 111.115 -174.301 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.7 mt -57.18 -19.2 19.21 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 123.925 0.89 . . . . 0.0 112.915 173.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.19 -30.99 71.94 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 120.019 1.281 . . . . 0.0 112.036 -179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.81 -49.96 11.22 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.565 0.746 . . . . 0.0 111.304 173.114 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -53.89 -31.11 48.79 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 60.0 mt -102.52 -7.6 21.74 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.848 1.659 . . . . 0.0 112.995 -177.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.27 0.72 8.17 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.272 1.415 . . . . 0.0 114.069 -173.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.5 mp -110.76 144.21 40.08 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 124.334 1.054 . . . . 0.0 111.864 -169.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.9 t -59.42 149.22 29.99 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 121.932 0.873 . . . . 0.0 111.205 177.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -63.42 -16.24 59.96 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.966 1.098 . . . . 0.0 113.966 -170.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.8 p -71.34 -48.3 51.18 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.065 1.302 . . . . 0.0 112.043 168.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -60.67 -43.1 98.06 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.219 0.918 . . . . 0.0 111.48 172.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 69.6 t -62.84 -40.95 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 O-C-N 121.827 -0.546 . . . . 0.0 111.34 176.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 73.8 m -62.14 -36.93 83.3 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 178.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -56.39 -41.54 76.45 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.138 0.575 . . . . 0.0 111.778 172.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.57 ' CD2' ' HG1' ' A' ' 22' ' ' THR . 94.2 m-70 -73.66 -35.23 65.22 Favored 'General case' 0 CA--C 1.558 1.288 0 O-C-N 121.264 -0.897 . . . . 0.0 112.805 174.202 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.1 mt -69.88 -37.02 75.91 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 120.607 1.549 . . . . 0.0 114.127 176.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 38.9 m -54.61 -39.72 68.17 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.926 1.239 . . . . 0.0 113.094 -177.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 9.0 t -67.63 -43.53 80.16 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 118.578 0.626 . . . . 0.0 112.021 175.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.3 tp -61.96 -37.33 84.35 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 127.94 2.496 . . . . 0.0 112.823 -175.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.0 mtm105 -82.35 2.45 32.25 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.34 1.856 . . . . 0.0 112.721 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -112.63 -45.16 0.79 Allowed Glycine 0 N--CA 1.475 1.241 0 C-N-CA 126.582 2.039 . . . . 0.0 112.352 173.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 98.6 m -66.01 3.31 0.86 Allowed 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 127.2 2.2 . . . . 0.0 113.751 171.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 58.21 35.89 79.99 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 125.625 1.583 . . . . 0.0 113.687 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.6 mt -86.56 -29.07 22.92 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.563 1.145 . . . . 0.0 112.698 173.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.1 m -140.17 143.84 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 125.39 1.476 . . . . 0.0 112.115 -175.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.4 t -131.12 142.81 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 125.98 1.712 . . . . 0.0 110.236 -174.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.08 158.35 35.88 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.475 1.91 . . . . 0.0 113.961 176.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.3 m -156.67 174.71 15.05 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 168.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -111.07 119.34 38.7 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.481 0.712 . . . . 0.0 110.519 169.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -77.42 -157.32 0.09 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.248 0.619 . . . . 0.0 110.767 167.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.86 -24.9 68.74 Favored Glycine 0 CA--C 1.537 1.465 0 O-C-N 119.479 -2.013 . . . . 0.0 115.819 -171.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -157.18 2.0 0.12 Allowed 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.298 1.549 . . . . 0.0 114.861 172.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -125.39 164.23 20.87 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 126.017 1.727 . . . . 0.0 109.584 -179.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 30.7 m -79.21 150.75 5.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 166.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -125.57 179.86 4.95 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.411 1.485 . . . . 0.0 110.205 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -142.87 132.06 23.24 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 124.443 1.097 . . . . 0.0 110.849 174.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.78 162.01 29.42 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.793 2.037 . . . . 0.0 110.079 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.0 mp -57.47 149.52 20.77 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 119.026 0.83 . . . . 0.0 110.293 169.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.5 -21.03 66.18 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 114.684 1.364 . . . . 0.0 114.684 -172.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -170.92 173.44 5.16 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 122.416 1.103 . . . . 0.0 113.223 168.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 52.9 p -40.5 -31.3 0.14 Allowed 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 128.958 2.903 . . . . 0.0 112.284 165.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -44.16 -76.27 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 127.379 2.272 . . . . 0.0 112.762 168.047 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.4 ' H ' HD23 ' A' ' 82' ' ' LEU . 0.0 OUTLIER -71.17 -28.69 64.43 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -171.635 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.5 -45.51 93.9 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.125 0.97 . . . . 0.0 111.586 177.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . 0.281 3.1 ppt_? -72.66 -46.12 55.51 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.618 177.112 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.09 -42.51 90.64 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 179.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 tt -73.54 -43.46 59.87 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.534 -0.729 . . . . 0.0 110.408 175.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.88 -35.92 57.94 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.261 0.934 . . . . 0.0 113.753 -172.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -78.21 -3.56 43.29 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.858 1.263 . . . . 0.0 112.353 169.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.459 ' C ' ' H ' ' A' ' 91' ' ' GLN . 54.8 tp 67.48 107.73 0.04 OUTLIER 'General case' 0 C--N 1.342 0.275 0 C-N-CA 129.028 2.931 . . . . 0.0 111.579 169.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.7 m -66.59 23.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 125.999 1.72 . . . . 0.0 114.424 178.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.459 ' H ' ' C ' ' A' ' 89' ' ' LEU . 28.1 mm-40 83.07 -13.93 0.77 Allowed 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.399 -1.438 . . . . 0.0 112.116 152.338 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 14.4 p -54.77 32.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.525 1 C-N-CA 133.166 4.587 . . . . 0.0 116.475 169.007 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.1 t 58.48 31.32 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 128.193 2.597 . . . . 0.0 111.533 168.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 79.37 113.87 0.07 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 127.589 2.356 . . . . 0.0 105.715 -165.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.51 64.68 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 127.201 2.2 . . . . 0.0 114.803 -179.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -51.57 161.16 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 127.631 2.372 . . . . 0.0 113.008 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.03 16.67 7.93 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 128.542 2.737 . . . . 0.0 114.422 -172.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 10.2 p -86.98 150.19 24.24 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.229 1.411 . . . . 0.0 112.402 176.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -140.7 139.99 34.83 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.904 1.682 . . . . 0.0 110.623 176.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -163.05 158.61 18.4 Favored Pre-proline 0 CA--C 1.541 0.609 0 O-C-N 120.32 -1.488 . . . . 0.0 111.727 -166.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -73.6 174.66 11.86 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 122.478 2.118 . . . . 0.0 108.275 165.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 48.9 t -50.97 143.46 10.24 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 123.182 1.468 . . . . 0.0 114.033 -171.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 85.9 t -54.62 -31.98 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 C-N-CA 126.016 1.726 . . . . 0.0 111.669 178.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.5 -23.47 63.62 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 177.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -112.93 11.67 19.19 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.186 1.794 . . . . 0.0 113.557 177.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.536 0.422 0 C-N-CA 124.804 1.242 . . . . 0.0 113.3 -172.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.137 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.64 -34.4 72.01 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 117.479 -1.248 . . . . 0.0 113.437 -168.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.24 -57.73 9.5 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.858 1.663 . . . . 0.0 111.425 174.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 13.9 mtp85 -54.46 -38.96 66.97 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.173 1.389 . . . . 0.0 112.398 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -76.22 -54.01 7.42 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.319 1.448 . . . . 0.0 112.497 177.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -73.42 -14.75 79.24 Favored Glycine 0 CA--C 1.53 1.009 0 CA-C-O 117.907 -1.496 . . . . 0.0 112.704 -174.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 62.1 mtt-85 -57.9 -12.79 3.5 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 119.947 1.873 . . . . 0.0 113.658 168.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -122.41 -1.44 9.12 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.026 1.73 . . . . 0.0 113.978 170.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 3.9 tp -106.91 -30.3 8.95 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.615 1.098 . . . . 0.0 111.566 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.22 66.61 9.81 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.405 2.282 . . . . 0.0 110.331 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.61 162.93 50.34 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 125.724 1.61 . . . . 0.0 111.343 -171.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -69.65 -100.54 0.01 OUTLIER 'Trans proline' 0 CA--C 1.551 1.337 0 C-N-CA 125.184 3.922 . . . . 0.0 109.584 169.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.6 ' HG1' ' CD2' ' B' ' 54' ' ' HIS . 22.7 p -36.74 -46.4 0.6 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 129.028 2.931 . . . . 0.0 113.458 168.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . 0.423 ' HA ' HG13 ' B' ' 26' ' ' ILE . 7.4 ttm180 -70.9 -37.06 72.95 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.582 1.083 . . . . 0.0 112.947 -171.109 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 12.1 t -60.03 -52.47 65.24 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.853 0.835 . . . . 0.0 109.254 167.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 3.9 mmt85 -55.65 -36.75 67.39 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 177.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . 0.423 HG13 ' HA ' ' B' ' 23' ' ' ARG . 1.7 mt -49.9 -60.1 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 CA-C-N 119.756 1.162 . . . . 0.0 108.945 171.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 87.9 mt -63.78 -38.8 92.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 118.144 -0.932 . . . . 0.0 111.748 -173.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -68.93 -33.72 60.54 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-N 119.149 0.886 . . . . 0.0 111.881 177.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.44 -23.99 27.64 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.664 0.786 . . . . 0.0 113.028 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.06 -45.05 94.02 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 117.749 -1.12 . . . . 0.0 112.27 171.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -42.61 -43.16 3.68 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.719 2.408 . . . . 0.0 113.573 -174.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -100.47 -31.85 11.09 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.104 1.762 . . . . 0.0 112.67 177.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.04 -61.03 2.17 Favored Glycine 0 C--N 1.343 0.937 0 C-N-CA 124.542 1.068 . . . . 0.0 113.933 -171.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 30.91 46.59 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 C-N-CA 127.598 2.359 . . . . 0.0 115.192 178.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 3.3 m -107.73 -67.91 0.93 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.665 1.586 . . . . 0.0 112.777 -176.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -143.17 152.77 58.77 Favored Pre-proline 0 N--CA 1.476 0.839 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -167.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -68.27 8.93 0.44 Allowed 'Trans proline' 0 CA--C 1.55 1.289 0 C-N-CA 124.689 3.593 . . . . 0.0 113.764 168.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -122.43 -10.18 6.17 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 125.811 1.672 . . . . 0.0 113.754 168.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.51 -40.11 80.98 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 119.717 1.758 . . . . 0.0 110.331 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 47.7 mt -63.14 -11.34 19.64 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 124.05 0.94 . . . . 0.0 112.355 -179.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -73.2 -33.69 65.53 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 119.743 -0.783 . . . . 0.0 111.003 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.56 -53.46 10.48 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.173 0.989 . . . . 0.0 110.34 169.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -52.62 -30.86 33.69 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 -178.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 65.5 mt -102.4 -18.78 15.22 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.319 1.447 . . . . 0.0 113.349 -178.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.51 -1.54 56.92 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.555 1.074 . . . . 0.0 113.854 -170.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 8.5 mp -110.95 146.94 35.71 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 119.222 1.511 . . . . 0.0 112.313 -174.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 8.9 t -56.37 150.52 14.68 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 122.291 1.043 . . . . 0.0 112.383 176.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -63.98 -14.18 52.05 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -171.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 13.5 p -72.66 -44.01 62.39 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 120.144 1.338 . . . . 0.0 112.235 169.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -61.27 -44.7 96.8 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.673 0.669 . . . . 0.0 111.506 170.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 52.6 t -57.73 -47.54 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.831 174.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 75.5 m -59.53 -40.3 86.72 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.86 0.864 . . . . 0.0 113.155 -177.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -54.32 -46.26 72.81 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.921 0.888 . . . . 0.0 112.086 171.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . 0.6 ' CD2' ' HG1' ' B' ' 22' ' ' THR . 86.0 m-70 -73.67 -28.22 61.64 Favored 'General case' 0 CA--C 1.558 1.27 0 O-C-N 121.141 -0.974 . . . . 0.0 112.682 176.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 45.3 mt -73.66 -33.98 64.72 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 120.864 1.665 . . . . 0.0 113.613 174.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 33.6 m -52.78 -40.67 63.39 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.447 1.022 . . . . 0.0 113.461 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.2 t -70.16 -39.64 75.22 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.208 0.913 . . . . 0.0 112.329 177.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 2.3 tp -60.95 -47.47 86.27 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 128.071 2.548 . . . . 0.0 111.688 -174.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 33.1 mtm105 -80.17 4.75 16.42 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.827 1.651 . . . . 0.0 112.214 177.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -106.22 -47.62 1.06 Allowed Glycine 0 CA--C 1.532 1.112 0 C-N-CA 125.958 1.742 . . . . 0.0 112.02 169.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 92.8 m -76.56 13.74 0.92 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 126.514 1.925 . . . . 0.0 114.431 177.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.03 29.06 69.92 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 125.731 1.634 . . . . 0.0 114.418 174.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 24.9 mt -80.78 -26.49 37.17 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.377 -1.072 . . . . 0.0 112.943 176.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.5 m -147.17 152.3 13.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 126.152 1.781 . . . . 0.0 112.572 -171.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -130.13 158.12 42.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.783 1.633 . . . . 0.0 111.187 173.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.53 161.08 30.1 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.04 1.336 . . . . 0.0 112.267 167.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.1 m -156.56 176.71 12.35 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.583 1.553 . . . . 0.0 107.046 168.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -117.52 118.88 33.36 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.928 0.891 . . . . 0.0 111.344 172.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.25 1.2 pp20? -77.32 -151.96 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.457 0.703 . . . . 0.0 111.233 167.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -66.98 -24.79 73.2 Favored Glycine 0 CA--C 1.54 1.594 0 O-C-N 119.572 -1.955 . . . . 0.0 116.035 -173.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 5.4 ttp85 -158.71 0.32 0.09 Allowed 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 119.263 1.532 . . . . 0.0 114.528 174.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -124.98 162.93 23.43 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 126.11 1.764 . . . . 0.0 109.327 -178.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 20.8 m -80.29 152.44 4.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 O-C-N 121.709 -0.619 . . . . 0.0 109.415 165.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 8.0 ptt180 -124.62 172.47 9.22 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.263 1.425 . . . . 0.0 110.331 174.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -120.7 143.79 48.56 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.321 1.048 . . . . 0.0 110.027 167.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -142.02 149.45 40.0 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.566 1.546 . . . . 0.0 110.566 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 6.1 mp -52.93 146.78 10.25 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 119.216 0.916 . . . . 0.0 109.138 169.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.17 -16.22 63.27 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -172.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -169.91 172.4 6.63 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 123.055 1.407 . . . . 0.0 112.51 171.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 86.4 p -49.73 -26.13 3.55 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.408 2.283 . . . . 0.0 111.282 163.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 8.5 t60 -60.26 -58.06 10.11 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 128.298 2.639 . . . . 0.0 112.032 179.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.11 -33.15 71.49 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 120.579 1.536 . . . . 0.0 110.25 174.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.13 -37.41 82.74 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.949 0.9 . . . . 0.0 112.318 -176.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.26 -44.02 63.45 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-O 117.506 -1.235 . . . . 0.0 111.683 174.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.09 -43.72 95.32 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 120.017 1.281 . . . . 0.0 113.518 177.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 5.0 tt -67.02 -49.78 64.18 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.084 0.954 . . . . 0.0 110.312 174.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.81 -33.04 47.78 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.84 1.21 . . . . 0.0 114.623 -167.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -74.11 -10.96 60.14 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 118.958 1.379 . . . . 0.0 112.201 169.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . 0.48 ' C ' ' H ' ' B' ' 91' ' ' GLN . 57.9 tp 69.66 110.3 0.05 Allowed 'General case' 0 C--O 1.235 0.303 0 C-N-CA 129.59 3.156 . . . . 0.0 110.939 171.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 21.0 m -66.32 23.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 C-N-CA 126.295 1.838 . . . . 0.0 114.286 177.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.48 ' H ' ' C ' ' B' ' 89' ' ' LEU . 24.6 mm-40 78.22 -9.63 1.48 Allowed 'General case' 0 C--N 1.327 -0.402 0 O-C-N 120.43 -1.419 . . . . 0.0 113.166 156.323 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 11.2 p -54.22 26.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.25 1 C-N-CA 132.226 4.21 . . . . 0.0 115.993 167.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . 0.444 ' H ' ' C ' ' B' ' 91' ' ' GLN . 1.8 t 60.29 31.71 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 127.044 2.138 . . . . 0.0 111.589 167.52 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 80.86 112.33 0.07 Allowed 'General case' 0 C--N 1.347 0.485 0 C-N-CA 127.697 2.399 . . . . 0.0 106.338 -167.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.0 64.05 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 128.38 2.672 . . . . 0.0 114.861 176.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -54.54 150.48 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 126.723 2.009 . . . . 0.0 112.481 -177.3 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.61 13.5 0.35 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 130.042 3.337 . . . . 0.0 116.092 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 12.5 p -86.01 147.34 26.25 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.998 0.919 . . . . 0.0 112.122 173.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . 0.425 ' CG ' HH21 ' A' ' 16' ' ' ARG . 48.9 t0 -139.67 136.59 34.43 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.219 1.807 . . . . 0.0 111.587 175.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -164.47 155.05 12.94 Favored Pre-proline 0 CA--C 1.536 0.42 0 O-C-N 120.449 -1.407 . . . . 0.0 111.675 -167.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -73.29 172.38 15.73 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 122.244 1.963 . . . . 0.0 108.885 166.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 43.5 t -51.83 143.0 14.03 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 126.358 2.98 . . . . 0.0 114.187 -169.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 19.1 m -70.64 -18.78 21.31 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-N 109.752 -3.385 . . . . 0.0 112.47 -172.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.81 -24.11 61.67 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.127 0.971 . . . . 0.0 113.003 169.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -118.88 12.8 12.99 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 126.506 1.922 . . . . 0.0 114.205 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.536 0.429 0 C-N-CA 124.824 1.25 . . . . 0.0 113.399 -174.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.826 0 CA-C-O 122.635 1.207 . . . . 0.0 110.169 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -102.09 -37.81 8.0 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-O 117.287 -1.34 . . . . 0.0 113.568 -169.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.72 -37.99 63.87 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 121.611 2.005 . . . . 0.0 113.663 -172.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.45 HH21 ' HB3' ' A' ' 61' ' ' CYS . 0.0 OUTLIER -53.68 -23.26 10.87 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.645 0.979 . . . . 0.0 113.645 177.599 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -56.14 -41.82 75.96 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.29 1.836 . . . . 0.0 111.92 174.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.38 -35.8 92.54 Favored Glycine 0 CA--C 1.53 0.993 0 CA-C-N 120.388 1.449 . . . . 0.0 112.114 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.66 -45.71 61.17 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.803 0.841 . . . . 0.0 110.986 170.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.92 -24.17 67.63 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.728 1.149 . . . . 0.0 112.862 -178.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.7 mp -82.26 -28.39 31.85 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.014 0.825 . . . . 0.0 112.712 169.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -87.91 67.23 8.98 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.559 1.944 . . . . 0.0 112.831 173.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.551 ' HB3' HH11 ' A' ' 23' ' ' ARG . 31.3 t70 -143.55 135.86 13.33 Favored Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 128.241 2.616 . . . . 0.0 107.353 -176.615 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -52.68 -102.74 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.902 1 C-N-CA 127.26 5.307 . . . . 0.0 116.722 -163.677 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.4 m -56.0 -30.72 62.25 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.573 1.149 . . . . 0.0 110.511 -177.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.551 HH11 ' HB3' ' A' ' 20' ' ' ASP . 0.0 OUTLIER -50.33 -42.08 52.26 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 172.717 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 36.8 t -58.7 -43.48 90.07 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.314 -0.866 . . . . 0.0 111.346 175.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.5 tpt180 -63.67 -29.47 70.7 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 118.051 -0.976 . . . . 0.0 112.118 174.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.6 mt -62.56 -53.57 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 120.756 1.616 . . . . 0.0 110.999 167.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.482 ' CD1' HH21 ' A' ' 23' ' ' ARG . 8.5 mt -60.17 -39.47 86.54 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 117.704 -1.141 . . . . 0.0 112.608 -177.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -68.73 -27.35 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 CA-C-N 120.292 1.406 . . . . 0.0 112.825 175.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.25 1.5 36.36 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 126.167 1.787 . . . . 0.0 114.222 169.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.64 -20.0 14.59 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 120.651 -1.281 . . . . 0.0 111.853 168.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.2 mt -66.79 -44.64 80.75 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.375 1.47 . . . . 0.0 109.218 165.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -132.49 95.94 3.73 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.666 1.986 . . . . 0.0 110.99 168.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -179.22 -83.48 0.06 OUTLIER Glycine 0 N--CA 1.468 0.769 0 C-N-CA 125.999 1.761 . . . . 0.0 110.592 171.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 19.5 m 43.06 25.37 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 116.881 2.178 . . . . 0.0 116.881 171.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 99.1 m -83.61 -76.48 0.29 Allowed 'General case' 0 C--O 1.223 -0.307 0 O-C-N 121.047 -1.033 . . . . 0.0 109.919 178.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -139.38 159.71 64.84 Favored Pre-proline 0 CA--C 1.54 0.578 0 CA-C-O 118.549 -0.739 . . . . 0.0 112.902 -170.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -57.27 -18.8 31.81 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.183 2.588 . . . . 0.0 114.819 175.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -97.18 -6.48 57.74 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 118.175 -1.347 . . . . 0.0 115.766 172.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -28.7 65.31 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.43 2.115 . . . . 0.0 113.143 -170.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 23.4 mt -63.75 -18.67 64.29 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 123.839 0.856 . . . . 0.0 111.717 178.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.24 -45.03 68.58 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.273 0.629 . . . . 0.0 111.496 177.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.46 -41.02 69.92 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.786 0.834 . . . . 0.0 112.151 176.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -64.04 -21.37 66.48 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.903 1.446 . . . . 0.0 114.903 176.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 86.8 mt -115.32 -15.59 11.56 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.803 1.641 . . . . 0.0 114.029 -172.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.7 4.14 57.0 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.021 0.82 . . . . 0.0 113.405 -170.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 71.9 mt -102.31 172.86 6.64 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.814 1.246 . . . . 0.0 111.286 -176.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.1 p -86.27 158.34 19.72 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.503 -0.748 . . . . 0.0 110.065 175.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -61.92 -21.33 64.66 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 174.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.0 p -73.52 -52.58 13.05 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.078 -1.013 . . . . 0.0 109.712 168.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -69.77 -30.05 67.53 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.009 0.924 . . . . 0.0 112.505 -173.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 80.0 t -67.25 -30.26 48.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 O-C-N 120.681 -1.262 . . . . 0.0 111.769 167.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 74.3 m -70.52 -16.11 62.85 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.607 -1.308 . . . . 0.0 114.091 -175.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -54.2 -58.95 5.44 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.761 0.824 . . . . 0.0 110.635 169.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -77.02 -14.81 59.79 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-O 117.837 -1.078 . . . . 0.0 113.78 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 92.9 mt -70.81 -26.99 63.56 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 121.241 1.837 . . . . 0.0 111.668 169.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 65.1 p -59.26 -47.32 85.79 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 -175.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.9 t -72.97 -38.12 66.83 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.766 0.712 . . . . 0.0 111.829 172.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.5 tp -51.1 -48.86 61.58 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.202 1.001 . . . . 0.0 112.397 176.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 43.8 mtm180 -88.96 -5.54 57.89 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.627 1.571 . . . . 0.0 113.56 -176.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -100.9 -41.48 2.65 Favored Glycine 0 N--CA 1.474 1.2 0 C-N-CA 125.538 1.542 . . . . 0.0 112.811 175.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.45 ' HB3' HH21 ' A' ' 13' ' ' ARG . 3.8 m -77.44 8.73 3.87 Favored 'General case' 0 CA--C 1.552 1.051 0 O-C-N 120.832 -1.393 . . . . 0.0 113.297 169.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 58.41 34.65 75.92 Favored Glycine 0 CA--C 1.533 1.191 0 O-C-N 120.904 -1.123 . . . . 0.0 114.045 176.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 26.2 mt -82.38 -25.88 33.38 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.275 1.538 . . . . 0.0 111.989 171.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.5 m -133.98 149.3 30.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 127.34 2.256 . . . . 0.0 109.366 176.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.6 t -129.08 135.82 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 C-N-CA 124.995 1.318 . . . . 0.0 109.883 -176.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.72 148.23 44.87 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.671 1.189 . . . . 0.0 112.863 171.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 34.2 m -160.0 162.77 34.37 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.498 1.919 . . . . 0.0 106.584 -178.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -87.65 138.74 31.2 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.136 1.334 . . . . 0.0 110.917 169.072 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.98 -20.2 39.01 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 118.318 0.508 . . . . 0.0 112.239 169.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 139.76 -47.31 0.9 Allowed Glycine 0 CA--C 1.528 0.906 0 C-N-CA 126.009 1.766 . . . . 0.0 112.237 175.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 19.8 ttp180 -101.0 -29.67 12.05 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.562 1.945 . . . . 0.0 112.027 171.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.13 171.21 13.93 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.662 1.985 . . . . 0.0 110.913 -170.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 13.0 p -87.35 144.46 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 124.011 0.924 . . . . 0.0 109.438 169.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -128.8 174.22 9.66 Favored 'General case' 0 CA--C 1.522 -0.126 0 C-N-CA 126.244 1.818 . . . . 0.0 109.718 178.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -117.23 170.85 8.36 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.373 1.069 . . . . 0.0 109.08 166.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -164.97 154.97 13.5 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.46 1.904 . . . . 0.0 109.246 177.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 tp -56.71 142.44 40.22 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.315 0.961 . . . . 0.0 111.683 171.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -83.39 11.34 6.97 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 116.224 1.935 . . . . 0.0 116.224 -169.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.2 t0 165.65 144.87 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 128.69 2.796 . . . . 0.0 110.874 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 83.8 p -45.67 -29.87 1.39 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.924 2.089 . . . . 0.0 114.074 167.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -61.93 -49.74 74.93 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 124.062 0.945 . . . . 0.0 112.744 174.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 54.0 mt -60.85 -42.71 98.36 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 176.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.97 -34.08 65.38 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.617 1.167 . . . . 0.0 112.014 -174.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.7 mtt-85 -71.79 -60.68 2.11 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.417 1.087 . . . . 0.0 113.212 177.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.45 -34.6 75.69 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 120.309 1.413 . . . . 0.0 112.543 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 70.0 tp -62.46 -49.73 74.28 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.659 1.584 . . . . 0.0 110.795 169.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -67.93 -39.82 89.23 Favored Glycine 0 N--CA 1.475 1.239 0 C-N-CA 126.616 2.055 . . . . 0.0 113.926 -176.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 51.9 tp10 -64.79 -8.23 14.21 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 127.763 2.425 . . . . 0.0 112.713 168.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.417 ' C ' ' H ' ' A' ' 91' ' ' GLN . 8.3 tp 67.69 36.38 3.64 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 128.721 2.808 . . . . 0.0 110.6 169.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 3.8 m 48.63 -18.05 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 131.483 3.913 . . . . 0.0 117.366 -168.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.417 ' H ' ' C ' ' A' ' 89' ' ' LEU . 56.2 mm-40 69.94 -7.39 0.94 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 128.271 2.628 . . . . 0.0 114.076 -174.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -66.61 -10.38 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 C-N-CA 126.39 1.876 . . . . 0.0 114.467 170.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 79.5 42.57 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.043 0 C-N-CA 129.937 3.295 . . . . 0.0 113.158 168.071 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 tt 78.09 95.85 0.06 Allowed 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 123.614 1.673 . . . . 0.0 109.09 -168.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -49.55 70.72 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 128.355 2.662 . . . . 0.0 116.336 169.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 94.1 t -58.73 130.97 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 N-CA-C 106.09 -1.818 . . . . 0.0 106.09 165.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -60.93 -80.3 0.03 OUTLIER 'General case' 0 C--O 1.235 0.33 0 O-C-N 123.905 0.753 . . . . 0.0 112.294 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 5.7 p 66.24 132.59 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 128.785 2.834 . . . . 0.0 108.777 -169.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -84.92 83.67 7.97 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 120.974 1.715 . . . . 0.0 110.011 178.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.52 151.23 76.94 Favored Pre-proline 0 CA--C 1.551 1.007 0 CA-C-N 114.042 -1.435 . . . . 0.0 109.717 177.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -86.17 -102.39 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 124.083 3.189 . . . . 0.0 108.196 174.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 34.9 t -65.51 141.05 58.6 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 123.438 1.589 . . . . 0.0 109.784 165.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 19.2 m -104.85 6.04 10.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 112.657 -2.065 . . . . 0.0 111.541 -171.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.59 -37.15 85.81 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.897 1.279 . . . . 0.0 111.445 168.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -104.18 11.64 34.78 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.344 1.858 . . . . 0.0 111.437 -175.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.349 0.55 0 O-C-N 120.738 -1.226 . . . . 0.0 111.448 -177.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.294 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -73.31 4.0 5.16 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 -169.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.22 -39.82 22.54 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 121.016 1.734 . . . . 0.0 111.154 166.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -59.07 -21.37 59.06 Favored 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 124.583 1.153 . . . . 0.0 111.518 176.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -47.78 -47.07 30.87 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.976 2.511 . . . . 0.0 111.668 165.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.07 -15.0 69.1 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-O 119.139 -0.812 . . . . 0.0 112.557 -175.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.39 -56.25 4.59 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 166.303 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.24 -27.81 68.72 Favored 'General case' 0 CA--C 1.549 0.914 0 N-CA-C 115.583 1.698 . . . . 0.0 115.583 -173.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 5.8 mp -84.19 -20.05 33.01 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 119.284 0.947 . . . . 0.0 113.458 171.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.6 51.88 1.95 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.092 1.357 . . . . 0.0 110.995 169.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -117.21 146.85 39.14 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 127.511 2.325 . . . . 0.0 107.808 176.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -59.78 -94.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.929 1 C-N-CA 126.248 4.632 . . . . 0.0 113.663 -168.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.3 m -58.54 -24.23 60.17 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 120.773 -1.204 . . . . 0.0 111.213 175.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . 0.424 ' HD3' ' CD1' ' B' ' 58' ' ' LEU . 13.1 ttm-85 -70.72 -41.22 72.18 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 113.977 1.102 . . . . 0.0 113.977 -178.538 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 38.1 t -56.02 -42.62 76.76 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.84 1.2 . . . . 0.0 109.449 169.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -64.66 -33.87 76.95 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 116.936 -1.507 . . . . 0.0 113.179 174.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.5 mt -56.8 -62.75 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 CA-C-N 121.317 1.871 . . . . 0.0 108.419 168.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 41.2 mt -54.88 -43.13 72.9 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.155 -0.926 . . . . 0.0 112.204 -170.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.9 p -74.59 -19.49 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-N 119.535 1.061 . . . . 0.0 113.197 -178.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.57 -27.46 21.36 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.486 1.515 . . . . 0.0 112.629 172.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.82 -47.02 83.83 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 125.5 1.52 . . . . 0.0 109.523 170.43 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.36 -61.11 1.8 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 129.946 3.298 . . . . 0.0 112.252 179.342 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -95.53 34.73 1.43 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.929 2.492 . . . . 0.0 110.395 174.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -128.92 -80.75 0.27 Allowed Glycine 0 C--N 1.337 0.613 0 C-N-CA 125.281 1.42 . . . . 0.0 113.532 -173.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 27.5 m 27.79 24.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 N-CA-C 119.651 3.204 . . . . 0.0 119.651 -174.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 76.1 m -83.7 -67.28 0.8 Allowed 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 121.331 1.878 . . . . 0.0 112.138 -178.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -147.15 162.57 32.24 Favored Pre-proline 0 CA--C 1.54 0.566 0 CA-C-O 117.919 -1.039 . . . . 0.0 111.231 -173.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -55.65 -27.5 61.12 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 122.7 2.267 . . . . 0.0 112.983 169.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -83.83 -3.9 89.08 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 117.432 -1.76 . . . . 0.0 115.521 175.011 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . 0.481 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -76.62 -36.92 57.14 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.953 2.376 . . . . 0.0 112.856 -172.419 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 14.7 mt -62.45 -22.31 66.11 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 123.431 0.693 . . . . 0.0 111.458 -179.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.87 -38.34 64.63 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.553 0.741 . . . . 0.0 111.904 176.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -52.61 13.38 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.618 0.767 . . . . 0.0 111.198 176.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . 0.481 ' CD2' HE22 ' B' ' 39' ' ' GLN . 8.9 m-70 -57.41 -24.16 53.77 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 65.9 mt -108.44 -11.23 15.19 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.603 1.561 . . . . 0.0 113.245 -176.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.36 8.04 42.66 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.292 0.948 . . . . 0.0 113.803 -170.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 53.4 mt -103.81 164.56 11.6 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.773 1.229 . . . . 0.0 112.066 -171.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 68.0 p -70.58 146.42 50.1 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.286 -0.884 . . . . 0.0 109.992 174.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 39.8 ptt180 -60.75 -17.07 46.45 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 172.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 47.6 p -73.6 -61.03 1.98 Allowed 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 166.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -66.57 -25.26 66.55 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.425 1.011 . . . . 0.0 113.124 -170.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 74.7 t -68.95 -31.11 49.2 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 CA-C-N 118.687 0.676 . . . . 0.0 111.896 169.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 75.8 m -61.28 -30.3 70.39 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.989 -1.069 . . . . 0.0 112.351 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -57.0 -13.68 2.94 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 128.053 2.541 . . . . 0.0 114.717 173.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -119.23 -8.01 10.19 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 120.325 -1.484 . . . . 0.0 114.411 170.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 71.4 mt -81.13 -25.06 37.21 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.067 0.947 . . . . 0.0 111.542 168.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 4.4 p -55.63 -49.63 72.33 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 7.3 t -72.76 -35.32 67.45 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.765 1.166 . . . . 0.0 111.889 176.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . 0.424 ' CD1' ' HD3' ' B' ' 23' ' ' ARG . 1.4 tp -56.91 -52.61 64.47 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.261 2.224 . . . . 0.0 111.726 -176.258 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 28.7 mtm105 -84.4 14.48 4.42 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.747 1.619 . . . . 0.0 111.863 178.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -110.17 -50.48 0.67 Allowed Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.712 1.149 . . . . 0.0 111.231 169.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 81.1 m -73.47 3.93 5.46 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 125.99 1.716 . . . . 0.0 113.748 -178.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.56 24.17 70.86 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 118.759 -1.023 . . . . 0.0 113.57 -176.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 63.3 mt -73.46 -21.57 60.4 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.545 1.672 . . . . 0.0 112.522 170.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -145.31 154.5 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 126.982 2.113 . . . . 0.0 110.109 175.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 89.8 t -135.23 141.89 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 127.118 2.167 . . . . 0.0 109.331 -177.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.12 155.21 22.73 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 123.102 1.429 . . . . 0.0 114.004 174.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 29.5 m -160.27 172.28 17.66 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.711 2.004 . . . . 0.0 107.082 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -92.51 152.39 19.68 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 119.958 1.254 . . . . 0.0 111.72 168.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -96.34 -4.69 41.55 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.151 0.981 . . . . 0.0 112.034 167.528 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 121.0 -34.81 3.89 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 127.14 2.305 . . . . 0.0 112.802 176.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 23.8 ttp180 -120.42 -29.92 4.68 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 130.419 3.487 . . . . 0.0 111.822 -176.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -135.38 171.96 13.7 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 128.425 2.69 . . . . 0.0 110.896 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 8.3 p -87.52 150.23 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.797 1.239 . . . . 0.0 110.283 169.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 31.3 ptt85 -137.25 172.27 13.24 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 126.552 1.941 . . . . 0.0 109.814 -174.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -114.69 171.98 7.31 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.534 0.734 . . . . 0.0 110.201 167.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -160.95 151.05 17.57 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 127.0 2.12 . . . . 0.0 107.919 179.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.3 tp -60.45 157.8 13.3 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.618 1.167 . . . . 0.0 113.193 172.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.84 -30.92 58.68 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 116.366 1.988 . . . . 0.0 116.366 -177.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 42.0 t0 173.49 153.12 0.09 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.345 2.258 . . . . 0.0 109.091 -166.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 90.8 p -44.23 -30.91 0.86 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.191 1.796 . . . . 0.0 112.917 166.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -53.55 -59.01 5.15 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 126.236 1.814 . . . . 0.0 113.763 171.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 21.6 mt -60.77 -44.96 96.11 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.482 1.037 . . . . 0.0 108.202 176.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.6 -33.7 64.2 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.766 1.226 . . . . 0.0 112.262 -172.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 7.6 mtt-85 -70.78 -56.81 5.52 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.352 1.061 . . . . 0.0 113.342 175.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.84 -37.08 83.79 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 120.005 1.275 . . . . 0.0 112.697 -178.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 36.1 tp -63.57 -34.76 78.52 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.424 1.89 . . . . 0.0 111.781 169.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.68 -29.4 29.57 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 126.845 2.164 . . . . 0.0 114.646 -174.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -11.24 60.26 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.126 1.463 . . . . 0.0 111.568 167.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.5 tp 73.77 133.79 0.05 OUTLIER 'General case' 0 C--N 1.347 0.482 0 C-N-CA 130.903 3.681 . . . . 0.0 106.54 -169.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 79.0 t -67.75 5.5 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 -167.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.437 ' C ' ' H ' ' B' ' 93' ' ' VAL . 2.3 tp-100 86.91 -25.18 0.1 Allowed 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.032 -1.042 . . . . 0.0 111.615 138.238 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 7.2 p -52.85 25.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.83 1 C-N-CA 134.702 5.201 . . . . 0.0 115.264 166.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . 0.437 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.2 OUTLIER 62.37 14.22 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 126.305 1.842 . . . . 0.0 113.689 171.961 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 4.7 tt 91.65 104.27 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 128.349 2.659 . . . . 0.0 108.735 -168.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.03 65.44 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 115.862 1.801 . . . . 0.0 115.862 176.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 15.5 t -55.24 130.56 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 CA-C-N 119.43 1.014 . . . . 0.0 108.588 166.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -59.04 -89.45 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 125.545 1.538 . . . . 0.0 111.825 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 12.1 p 82.1 157.56 0.13 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 129.645 3.178 . . . . 0.0 112.498 169.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -82.88 36.75 0.51 Allowed 'General case' 0 CA--C 1.544 0.721 0 O-C-N 120.973 -1.079 . . . . 0.0 111.686 172.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -133.04 87.08 40.8 Favored Pre-proline 0 CA--C 1.547 0.835 0 O-C-N 120.373 -1.455 . . . . 0.0 111.395 174.149 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -75.31 4.6 4.76 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 124.508 3.472 . . . . 0.0 114.162 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -158.19 153.51 25.82 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 129.396 3.079 . . . . 0.0 108.276 170.133 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 10.1 m -131.04 11.12 1.93 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 117.534 2.42 . . . . 0.0 117.534 -164.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.98 -21.46 58.77 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 118.88 0.763 . . . . 0.0 112.547 168.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -133.82 16.34 3.91 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 127.698 2.399 . . . . 0.0 112.421 -170.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.132 0 O-C-N 119.888 -1.757 . . . . 0.0 113.154 -172.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.349 0 CA-C-O 121.609 0.719 . . . . 0.0 112.601 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -12.47 2.81 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 167.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.64 -31.27 24.77 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.951 1.3 . . . . 0.0 112.332 166.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.7 mtm105 -84.18 -32.37 24.63 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.991 1.316 . . . . 0.0 113.458 173.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -54.72 -49.75 69.99 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.834 1.254 . . . . 0.0 109.992 172.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.82 -24.92 70.25 Favored Glycine 0 N--CA 1.473 1.158 0 O-C-N 121.202 -0.937 . . . . 0.0 113.476 176.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.86 1.27 15.49 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.896 1.278 . . . . 0.0 112.336 173.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -118.41 -38.59 3.14 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.234 1.414 . . . . 0.0 111.848 167.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mp -86.18 -8.76 57.58 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -175.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -128.09 35.53 4.43 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.337 1.455 . . . . 0.0 110.698 167.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -114.59 144.42 31.81 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 127.379 2.271 . . . . 0.0 106.38 176.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -54.29 -94.41 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.791 1 C-N-CA 126.15 4.567 . . . . 0.0 114.314 -166.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.401 ' HG1' HD13 ' A' ' 46' ' ' LEU . 15.3 t -60.25 -23.86 64.42 Favored 'General case' 0 C--O 1.223 -0.342 0 O-C-N 121.375 -0.828 . . . . 0.0 111.51 175.014 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -69.73 -34.87 74.44 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.253 1.388 . . . . 0.0 113.783 -178.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.6 t -70.05 -36.82 75.28 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 121.44 1.927 . . . . 0.0 110.53 169.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.1 mtm180 -59.35 -46.98 87.14 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-O 117.65 -1.166 . . . . 0.0 112.532 172.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.1 mt -44.89 -56.88 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 CA-C-N 121.137 1.789 . . . . 0.0 110.307 172.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 94.8 mt -61.8 -41.39 97.69 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 117.702 -1.142 . . . . 0.0 111.545 -175.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.8 p -75.21 -27.76 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-N 120.793 1.633 . . . . 0.0 112.833 176.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.37 -30.26 63.18 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.423 1.489 . . . . 0.0 112.441 173.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 mp -63.44 -47.04 83.52 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.425 167.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.51 -45.89 56.81 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.112 1.765 . . . . 0.0 112.469 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -107.29 40.53 1.66 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.103 1.761 . . . . 0.0 111.102 174.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -150.56 -78.3 0.02 OUTLIER Glycine 0 C--N 1.339 0.731 0 O-C-N 120.555 -1.34 . . . . 0.0 115.267 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 27.6 m 31.37 31.01 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 C-N-CA 128.055 2.542 . . . . 0.0 117.6 -168.075 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 36.1 m -84.65 -67.66 0.78 Allowed 'General case' 0 N--CA 1.469 0.481 0 O-C-N 120.551 -1.343 . . . . 0.0 113.933 -173.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -143.64 164.03 32.83 Favored Pre-proline 0 CA--C 1.54 0.565 0 CA-C-O 118.054 -0.974 . . . . 0.0 112.541 -171.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -66.19 -25.49 50.31 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 121.99 1.794 . . . . 0.0 113.061 -169.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.16 11.34 48.14 Favored Glycine 0 CA--C 1.53 0.979 0 CA-C-O 117.913 -1.493 . . . . 0.0 114.439 173.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.572 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -64.23 -34.27 77.72 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.501 2.151 . . . . 0.0 111.126 179.826 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 46.0 mt -56.36 -21.54 25.36 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 124.901 1.28 . . . . 0.0 112.647 175.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.43 -28.4 69.78 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.189 -0.944 . . . . 0.0 112.194 -178.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.2 -57.05 3.99 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.769 0.828 . . . . 0.0 111.099 169.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.572 ' CD2' HE22 ' A' ' 39' ' ' GLN . 5.7 m-70 -53.41 -31.48 45.25 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -179.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 70.4 mt -98.09 -22.93 15.97 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.147 0.979 . . . . 0.0 113.44 -175.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.56 -0.73 48.07 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 124.787 1.184 . . . . 0.0 113.484 -169.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.401 HD13 ' HG1' ' A' ' 22' ' ' THR . 94.9 mt -97.32 149.21 22.34 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.276 1.43 . . . . 0.0 110.326 -176.285 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.7 p -66.2 152.05 45.68 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 121.233 -0.917 . . . . 0.0 110.975 -174.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -56.14 -44.05 78.86 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.495 0.718 . . . . 0.0 111.988 -178.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.6 m -64.24 -35.56 81.22 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.588 1.155 . . . . 0.0 112.782 173.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -73.89 -44.54 54.94 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 178.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 67.9 t -60.6 -30.65 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 119.409 1.004 . . . . 0.0 112.447 176.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.8 m -53.16 -38.54 62.85 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 119.825 1.193 . . . . 0.0 113.683 174.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 64.3 m-80 -58.63 -48.02 82.43 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.236 1.014 . . . . 0.0 111.718 175.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 34.6 m80 -65.79 -31.73 72.86 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.569 1.148 . . . . 0.0 112.343 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 60.1 mt -74.46 -32.48 62.61 Favored 'General case' 0 C--O 1.222 -0.395 0 C-N-CA 124.088 0.955 . . . . 0.0 112.767 169.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.3 m -61.97 -33.97 75.28 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 120.798 1.636 . . . . 0.0 115.375 -170.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 38.5 t -77.04 -34.12 57.27 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.717 1.144 . . . . 0.0 111.512 170.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.3 tp -64.14 -38.28 90.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.37 2.268 . . . . 0.0 112.271 -177.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 66.4 mtm-85 -75.23 -13.51 60.45 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.905 1.682 . . . . 0.0 113.059 174.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.89 -34.99 4.71 Favored Glycine 0 N--CA 1.473 1.153 0 C-N-CA 126.317 1.913 . . . . 0.0 113.548 175.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 56.1 m -76.51 7.69 4.24 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.422 1.489 . . . . 0.0 111.425 168.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.48 -20.03 1.78 Allowed Glycine 0 CA--C 1.533 1.171 0 C-N-CA 126.71 2.1 . . . . 0.0 116.095 175.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.3 mt -55.63 -24.99 36.54 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 127.367 2.267 . . . . 0.0 115.675 -170.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.7 m -121.64 127.53 75.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 C-N-CA 124.27 1.028 . . . . 0.0 112.937 171.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 90.4 t -115.7 132.91 63.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 125.792 1.637 . . . . 0.0 109.513 -176.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -91.13 155.17 18.83 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 122.242 1.02 . . . . 0.0 112.684 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 26.3 m -147.79 152.09 37.11 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.301 1.44 . . . . 0.0 109.001 177.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -98.98 110.48 23.08 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.051 1.34 . . . . 0.0 111.14 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -87.52 68.37 9.6 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.036 2.135 . . . . 0.0 111.177 -179.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 63.01 -1.43 1.84 Allowed Glycine 0 CA--C 1.538 1.504 0 N-CA-C 117.72 1.848 . . . . 0.0 117.72 168.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.6 mtm-85 154.7 -25.83 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 131.533 3.933 . . . . 0.0 111.363 -172.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -94.43 179.16 5.38 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 166.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 24.5 m -128.43 168.89 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 O-C-N 121.042 -1.036 . . . . 0.0 108.838 168.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -137.63 -176.11 4.3 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.777 1.631 . . . . 0.0 111.14 172.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -135.43 151.33 50.31 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.769 2.027 . . . . 0.0 109.01 169.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -152.39 151.62 31.05 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.017 1.327 . . . . 0.0 110.58 -173.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -57.3 143.77 38.36 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.568 1.147 . . . . 0.0 109.711 173.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.49 -10.75 60.0 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 116.806 2.15 . . . . 0.0 116.806 -169.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -176.17 161.59 2.36 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.235 2.214 . . . . 0.0 109.563 173.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 90.2 p -41.59 -32.76 0.38 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 128.247 2.619 . . . . 0.0 112.711 166.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -42.07 -60.71 1.34 Allowed 'General case' 0 C--N 1.343 0.291 0 C-N-CA 126.666 1.986 . . . . 0.0 112.801 168.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.37 -34.96 36.05 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -170.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.69 -38.4 69.61 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 118.62 0.645 . . . . 0.0 112.664 169.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -71.78 -63.74 1.07 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.946 0.898 . . . . 0.0 113.245 173.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.47 -25.99 67.6 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.88 -1.137 . . . . 0.0 113.548 -171.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.77 -40.47 22.58 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 123.268 0.627 . . . . 0.0 111.779 169.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.12 -60.12 5.41 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 127.059 2.266 . . . . 0.0 115.045 -176.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.6 pm0 -66.44 -21.67 66.21 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.676 1.738 . . . . 0.0 111.406 168.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.474 ' C ' ' H ' ' A' ' 91' ' ' GLN . 2.8 tt 80.38 132.68 0.06 Allowed 'General case' 0 C--N 1.343 0.294 0 C-N-CA 128.565 2.746 . . . . 0.0 112.225 166.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 29.4 m -63.29 16.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 126.797 2.039 . . . . 0.0 114.732 178.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.474 ' H ' ' C ' ' A' ' 89' ' ' LEU . 14.1 mm-40 73.22 -11.0 0.94 Allowed 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 126.365 1.866 . . . . 0.0 113.212 169.177 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 2.9 p -55.73 22.78 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 C-N-CA 129.864 3.266 . . . . 0.0 117.698 175.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.41 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.9 t 68.7 9.75 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 126.771 2.028 . . . . 0.0 112.779 166.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 95.31 110.51 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 131.09 3.756 . . . . 0.0 107.665 -168.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.3 74.75 0.05 Allowed 'General case' 0 CA--C 1.553 1.089 0 O-C-N 121.446 -0.783 . . . . 0.0 113.05 169.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.8 t -70.77 146.59 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 126.082 1.753 . . . . 0.0 111.8 174.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.69 78.8 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 128.69 2.796 . . . . 0.0 112.401 170.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 19.7 p -141.02 121.67 14.26 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.036 1.335 . . . . 0.0 112.61 -172.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -111.84 134.41 53.42 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.858 1.263 . . . . 0.0 110.041 173.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -165.11 158.62 14.23 Favored Pre-proline 0 CA--C 1.548 0.866 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 -170.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -83.16 170.32 12.22 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.972 2.448 . . . . 0.0 113.203 -172.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.6 t -85.65 -179.87 6.96 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 125.395 1.478 . . . . 0.0 110.205 167.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 2.2 t -113.76 4.28 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.956 2.102 . . . . 0.0 111.412 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -128.31 -37.43 1.84 Allowed 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 125.795 1.638 . . . . 0.0 112.508 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -151.19 125.09 9.16 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.128 0.876 . . . . 0.0 112.268 173.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.407 ' CZ ' ' HA ' ' A' ' 106' ' ' ARG 0.255 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.257 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 166.487 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.59 0 CA-C-O 122.345 1.069 . . . . 0.0 113.548 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -8.99 1.66 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.567 1.947 . . . . 0.0 114.882 172.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.81 -21.4 11.07 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 120.671 -1.268 . . . . 0.0 112.691 168.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 38.0 mtm105 -83.6 -46.72 12.05 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.151 1.781 . . . . 0.0 111.798 169.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -51.17 -57.89 7.58 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.913 1.685 . . . . 0.0 110.262 173.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.5 -23.71 75.2 Favored Glycine 0 C--N 1.339 0.725 0 CA-C-O 117.908 -1.495 . . . . 0.0 112.757 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 25.8 ttm105 -63.99 -49.19 73.44 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 119.792 1.796 . . . . 0.0 110.386 169.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.19 -33.85 75.33 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 120.065 1.302 . . . . 0.0 114.093 175.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 7.6 mp -84.57 -2.04 56.8 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 178.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -119.87 -12.82 9.13 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 172.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.55 157.32 27.08 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 126.347 1.859 . . . . 0.0 111.384 169.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -65.23 -99.49 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 0.992 1 C-N-CA 126.009 4.473 . . . . 0.0 111.725 -176.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.424 ' HG1' ' CD1' ' B' ' 46' ' ' LEU . 12.1 t -58.48 -25.27 62.13 Favored 'General case' 0 N--CA 1.464 0.262 0 O-C-N 120.637 -1.29 . . . . 0.0 112.469 175.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.54 -39.91 85.0 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 119.707 1.14 . . . . 0.0 112.844 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 44.0 t -66.54 -37.19 84.47 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.72 1.6 . . . . 0.0 111.008 169.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 7.2 mtm180 -61.53 -35.88 78.99 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 172.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.8 mt -52.59 -59.9 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 CA-C-N 120.334 1.425 . . . . 0.0 108.851 169.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 96.9 mt -57.24 -45.95 83.45 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.75 -171.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 5.7 p -75.06 -31.3 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.58 -30.81 57.17 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.131 0.878 . . . . 0.0 112.387 174.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 12.1 tp -64.42 -37.09 86.3 Favored 'General case' 0 C--N 1.339 0.152 0 O-C-N 120.926 -1.109 . . . . 0.0 112.768 175.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.05 -31.75 8.28 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 128.907 2.883 . . . . 0.0 114.237 175.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.84 -33.17 18.67 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.663 1.985 . . . . 0.0 113.152 174.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -99.22 -65.02 0.84 Allowed Glycine 0 C--N 1.338 0.687 0 N-CA-C 115.465 0.946 . . . . 0.0 115.465 -165.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 16.1 m 34.5 38.8 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 125.969 1.708 . . . . 0.0 114.075 -167.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 30.0 m -86.47 -86.65 0.14 Allowed 'General case' 0 C--O 1.225 -0.23 0 C-N-CA 124.028 0.931 . . . . 0.0 110.944 -176.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -133.69 162.89 54.92 Favored Pre-proline 0 CA--C 1.544 0.72 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -169.127 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -63.91 -25.53 67.21 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 122.64 2.226 . . . . 0.0 113.843 -167.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.66 7.81 50.42 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-O 117.114 -1.937 . . . . 0.0 114.918 172.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.99 -31.97 71.55 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 121.083 2.442 . . . . 0.0 111.409 -175.084 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 31.4 mt -63.13 -18.75 63.77 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 125.32 1.448 . . . . 0.0 112.215 -179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.0 -32.18 70.61 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 119.731 1.15 . . . . 0.0 112.245 177.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.62 -54.88 6.08 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.491 0.716 . . . . 0.0 111.306 170.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -53.55 -31.37 46.21 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 70.3 mt -100.55 -27.13 13.58 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.558 1.143 . . . . 0.0 112.984 -174.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.56 4.97 88.0 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 124.998 1.285 . . . . 0.0 113.27 -169.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . 0.424 ' CD1' ' HG1' ' B' ' 22' ' ' THR . 96.6 mt -105.78 150.3 25.67 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.019 1.328 . . . . 0.0 111.207 -172.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 9.5 p -64.34 149.63 47.82 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.262 -0.899 . . . . 0.0 110.402 -175.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -58.57 -35.56 72.57 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.654 0.612 . . . . 0.0 112.654 -177.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.7 m -66.82 -44.01 82.3 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.356 -0.84 . . . . 0.0 112.018 170.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -65.81 -45.31 82.81 Favored 'General case' 0 CA--C 1.548 0.884 0 O-C-N 121.162 -0.961 . . . . 0.0 112.215 177.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 94.8 t -59.59 -31.72 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 120.335 -1.478 . . . . 0.0 111.692 169.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 69.7 m -65.13 -26.99 68.43 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.02 1.282 . . . . 0.0 113.728 175.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -62.97 -55.58 24.6 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.104 0.866 . . . . 0.0 109.557 169.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 33.9 m80 -59.04 -39.86 83.29 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.594 1.158 . . . . 0.0 113.18 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 56.0 mt -66.59 -33.75 76.36 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 124.59 1.156 . . . . 0.0 112.709 172.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 59.9 m -63.7 -35.55 80.94 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 120.484 1.493 . . . . 0.0 114.293 -169.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 34.1 t -72.05 -34.69 68.95 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.597 0.635 . . . . 0.0 112.07 169.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.4 tp -68.41 -32.05 71.83 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.556 2.342 . . . . 0.0 112.581 -175.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 51.3 mtm-85 -82.09 -19.64 39.76 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.39 1.476 . . . . 0.0 112.239 171.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -88.88 -37.85 7.14 Favored Glycine 0 N--CA 1.476 1.325 0 C-N-CA 124.811 1.196 . . . . 0.0 113.398 177.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 97.0 m -81.39 15.34 2.05 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 126.332 1.853 . . . . 0.0 111.364 169.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.93 -26.3 1.16 Allowed Glycine 0 CA--C 1.534 1.259 0 C-N-CA 126.265 1.888 . . . . 0.0 116.525 172.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 21.3 mt -50.86 -29.41 11.78 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 127.664 2.386 . . . . 0.0 116.592 -168.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -118.03 122.44 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 124.915 1.286 . . . . 0.0 111.301 169.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 80.4 t -107.45 130.65 59.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 125.507 1.523 . . . . 0.0 108.656 -176.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -96.86 146.46 24.91 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 124.624 1.17 . . . . 0.0 111.395 -177.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 96.4 m -154.09 147.35 24.81 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 124.432 1.093 . . . . 0.0 109.001 -172.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -97.62 93.23 6.3 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.36 1.064 . . . . 0.0 111.719 -176.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -69.3 74.88 0.36 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.815 1.646 . . . . 0.0 114.078 173.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 63.15 -5.69 0.56 Allowed Glycine 0 N--CA 1.475 1.257 0 C-N-CA 126.808 2.147 . . . . 0.0 118.313 167.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 4.1 mtm-85 161.04 -24.98 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 130.36 3.464 . . . . 0.0 111.759 -175.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -100.6 170.4 8.39 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 166.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 11.1 m -115.1 163.32 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 119.036 0.834 . . . . 0.0 109.134 168.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 10.3 ptt-85 -129.63 172.93 11.09 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 122.2 1.0 . . . . 0.0 110.784 170.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -127.93 140.34 52.06 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 167.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -146.52 154.75 41.9 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 123.753 0.821 . . . . 0.0 110.675 -178.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 1.2 mp -57.25 142.96 41.24 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.593 0.757 . . . . 0.0 110.614 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.13 0.44 1.97 Allowed 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 118.751 2.871 . . . . 0.0 118.751 -167.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 11.8 t70 169.02 158.33 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 129.835 3.254 . . . . 0.0 109.832 173.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 88.7 p -40.58 -35.39 0.46 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.806 2.442 . . . . 0.0 112.756 167.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -38.66 -63.16 0.53 Allowed 'General case' 0 C--N 1.342 0.278 0 C-N-CA 127.242 2.217 . . . . 0.0 113.013 167.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.2 -34.16 61.49 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -170.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.17 -30.22 71.41 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.857 0.863 . . . . 0.0 112.3 177.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.8 mmt85 -71.17 -65.74 0.71 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.645 1.178 . . . . 0.0 110.905 168.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.97 -25.83 63.93 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.599 1.333 . . . . 0.0 114.599 -173.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -87.26 -34.3 18.97 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.374 -0.829 . . . . 0.0 112.647 169.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.35 -58.33 5.11 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 127.27 2.367 . . . . 0.0 113.645 -175.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 14.0 pm0 -70.21 -17.72 63.15 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 119.22 1.51 . . . . 0.0 111.165 166.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . 0.513 ' C ' ' H ' ' B' ' 91' ' ' GLN . 26.5 tp 82.07 146.44 0.08 Allowed 'General case' 0 C--N 1.343 0.321 0 C-N-CA 129.989 3.315 . . . . 0.0 112.904 167.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 5.8 m -57.34 5.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 127.513 2.325 . . . . 0.0 114.122 168.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.513 ' H ' ' C ' ' B' ' 89' ' ' LEU . 7.3 mm-40 69.0 -9.27 0.6 Allowed 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 127.111 2.164 . . . . 0.0 114.228 176.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 1.2 p -56.26 26.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 130.174 3.39 . . . . 0.0 117.765 179.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 73.05 10.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 126.672 1.989 . . . . 0.0 112.496 168.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 78.99 101.27 0.06 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 127.716 2.407 . . . . 0.0 108.986 -171.224 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.12 139.77 22.49 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.14 1.376 . . . . 0.0 114.681 177.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 5.3 t -123.71 156.4 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 126.867 2.067 . . . . 0.0 108.426 175.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.68 25.42 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.364 0 C-N-CA 128.118 2.567 . . . . 0.0 115.567 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 18.2 p -96.86 127.05 42.46 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.647 1.579 . . . . 0.0 114.621 -170.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -93.5 141.13 28.81 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.13 1.772 . . . . 0.0 108.873 167.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -162.25 144.83 8.65 Favored Pre-proline 0 CA--C 1.544 0.738 0 O-C-N 120.086 -1.634 . . . . 0.0 108.445 -176.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -70.72 165.73 31.08 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 122.559 2.173 . . . . 0.0 112.549 -175.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 53.7 t -85.01 177.16 8.03 Favored 'General case' 0 CA--C 1.557 1.231 0 C-N-CA 125.449 1.5 . . . . 0.0 111.311 169.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 11.4 t -101.59 -10.29 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 127.129 2.172 . . . . 0.0 111.142 173.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -114.3 -57.16 2.31 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.38 1.872 . . . . 0.0 110.941 -178.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -147.06 124.78 11.83 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 119.374 0.988 . . . . 0.0 113.552 177.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . 0.455 ' CZ ' ' HA ' ' B' ' 106' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.397 0 C-N-CA 124.058 0.943 . . . . 0.0 113.15 166.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.821 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 pp -56.88 -40.83 76.95 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.198 0.599 . . . . 0.0 112.483 -173.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.44 1.26 8.29 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.372 1.469 . . . . 0.0 113.878 176.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.484 ' HE ' ' N ' ' B' ' 102' ' ' CYS . 1.6 mpt_? -112.21 -21.18 11.58 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.967 1.307 . . . . 0.0 112.478 169.042 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.08 -59.71 4.98 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.705 1.138 . . . . 0.0 109.534 168.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.08 -27.56 72.45 Favored Glycine 0 CA--C 1.538 1.473 0 O-C-N 121.292 -0.88 . . . . 0.0 113.234 -178.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -51.93 28.7 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.287 1.035 . . . . 0.0 111.478 172.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.44 -25.11 59.22 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.125 -0.984 . . . . 0.0 112.524 -175.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.1 mp -82.83 -6.96 59.67 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 118.138 -0.934 . . . . 0.0 111.362 168.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -92.34 -35.62 13.63 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 119.995 1.271 . . . . 0.0 112.28 166.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -47.56 127.81 10.51 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 125.309 1.443 . . . . 0.0 108.697 173.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -50.06 -85.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 1 C-N-CA 127.621 5.547 . . . . 0.0 113.516 -165.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.475 ' HG1' ' CD2' ' A' ' 54' ' ' HIS . 0.9 OUTLIER -56.36 -22.24 29.78 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 126.614 1.965 . . . . 0.0 113.747 174.351 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 37.8 mtt180 -74.19 -40.69 62.34 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 120.249 1.386 . . . . 0.0 112.215 178.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 6.9 t -60.18 -48.32 82.21 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.353 0.979 . . . . 0.0 110.09 169.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -62.18 -35.84 80.06 Favored 'General case' 0 CA--C 1.556 1.178 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 176.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -55.27 -53.47 34.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 CA-C-N 120.674 1.579 . . . . 0.0 108.719 167.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 25.0 mt -63.88 -45.61 88.63 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 117.483 -1.246 . . . . 0.0 112.664 -174.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.2 m -58.27 -27.22 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 CA-C-N 120.667 1.576 . . . . 0.0 112.378 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -95.63 -18.43 20.55 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.972 0.909 . . . . 0.0 113.312 179.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.9 mt -68.72 -41.28 79.25 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 118.247 -0.883 . . . . 0.0 112.482 168.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.8 tt -29.81 -62.32 0.14 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 130.4 3.48 . . . . 0.0 113.251 -178.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -98.55 -17.5 18.65 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.746 2.018 . . . . 0.0 112.684 174.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.39 -43.16 25.76 Favored Glycine 0 C--N 1.341 0.853 0 CA-C-O 116.153 -2.471 . . . . 0.0 115.833 -168.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.6 m 4.03 48.65 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 C-N-CA 131.125 3.77 . . . . 0.0 119.798 177.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 68.7 m -104.61 -63.17 1.24 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.975 1.71 . . . . 0.0 110.424 176.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -151.26 149.14 23.91 Favored Pre-proline 0 N--CA 1.474 0.762 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -173.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -55.99 -44.44 47.06 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 121.756 1.638 . . . . 0.0 111.082 175.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -69.04 -5.06 45.56 Favored Glycine 0 CA--C 1.535 1.288 0 CA-C-O 118.276 -1.291 . . . . 0.0 114.678 177.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.464 ' C ' ' H ' ' A' ' 41' ' ' ALA . 3.9 pt20 -69.91 -34.97 74.19 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 118.965 1.382 . . . . 0.0 111.383 173.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.8 mt -64.56 -3.2 2.88 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 118.43 0.559 . . . . 0.0 111.9 -177.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.464 ' H ' ' C ' ' A' ' 39' ' ' GLN . . . -65.96 -44.3 85.41 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.724 -0.61 . . . . 0.0 110.264 172.49 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.58 -38.55 70.92 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.821 0.849 . . . . 0.0 111.813 173.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -62.9 -20.03 64.77 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 75.5 mt -121.24 -19.37 7.1 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.996 1.718 . . . . 0.0 114.285 -172.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.49 17.29 78.95 Favored Glycine 0 CA--C 1.535 1.289 0 CA-C-N 118.673 0.669 . . . . 0.0 112.438 -168.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 87.1 mt -111.09 157.3 20.15 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.693 1.246 . . . . 0.0 112.749 -173.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.3 t -62.97 147.47 50.45 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.466 -0.771 . . . . 0.0 109.904 168.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 19.3 ptt-85 -61.58 -13.63 23.38 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 174.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.6 m -66.7 -51.18 58.99 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.033 -1.042 . . . . 0.0 111.71 169.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -65.14 -44.92 87.05 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.036 0.935 . . . . 0.0 110.142 177.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.0 t -52.72 -48.38 49.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.266 171.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 66.5 m -60.84 -39.58 89.62 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 118.954 0.797 . . . . 0.0 112.487 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -57.89 -44.54 86.8 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.074 0.949 . . . . 0.0 111.858 173.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.475 ' CD2' ' HG1' ' A' ' 22' ' ' THR . 23.0 m170 -61.73 -41.59 97.84 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 120.895 -1.128 . . . . 0.0 112.149 172.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 54.8 mt -75.09 -20.5 59.46 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.2 t -49.81 -51.64 38.23 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.889 1.276 . . . . 0.0 113.508 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 40.0 t -77.87 -39.8 42.13 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.574 0.75 . . . . 0.0 111.904 175.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.7 tp -55.58 -36.61 67.07 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.456 1.503 . . . . 0.0 112.302 -176.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.423 ' HD3' ' CE2' ' A' ' 75' ' ' TYR . 69.0 mtm180 -74.13 -40.23 62.78 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 173.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.43 -39.03 31.7 Favored Glycine 0 N--CA 1.467 0.733 0 C-N-CA 123.798 0.713 . . . . 0.0 112.122 -170.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 67.6 m -81.18 12.33 3.55 Favored 'General case' 0 CA--C 1.562 1.417 0 C-N-CA 126.206 1.802 . . . . 0.0 112.315 171.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.88 -12.08 54.55 Favored Glycine 0 N--CA 1.473 1.133 0 C-N-CA 128.574 2.988 . . . . 0.0 118.946 167.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.7 mt -58.59 -29.82 66.73 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.45 1.5 . . . . 0.0 114.815 -175.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.6 m -132.0 132.33 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.7 t -118.85 135.23 59.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 127.871 2.468 . . . . 0.0 110.883 -168.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.68 126.55 31.42 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.29 0.636 . . . . 0.0 111.845 175.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -141.67 156.45 45.64 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.413 1.085 . . . . 0.0 109.395 174.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.35 124.43 28.41 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.55 1.068 . . . . 0.0 110.112 168.16 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.0 -32.57 57.3 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 121.28 -0.888 . . . . 0.0 112.758 173.488 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 166.33 -17.92 0.09 OUTLIER Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.569 1.557 . . . . 0.0 115.246 174.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.96 -16.65 0.26 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.16 2.184 . . . . 0.0 113.584 177.294 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.04 173.98 10.98 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.659 1.984 . . . . 0.0 109.729 175.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 8.4 p -81.26 136.95 22.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 C-N-CA 124.315 1.046 . . . . 0.0 111.072 169.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -110.24 160.4 16.55 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 126.553 1.941 . . . . 0.0 109.648 169.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.423 ' CE2' ' HD3' ' A' ' 59' ' ' ARG . 3.4 m-30 -107.99 100.76 10.08 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 107.027 -1.471 . . . . 0.0 107.027 170.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -93.61 142.15 27.67 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.32 1.048 . . . . 0.0 110.055 179.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 8.6 mt -55.33 153.19 7.46 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.667 0.787 . . . . 0.0 112.049 171.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.85 -32.89 66.25 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 115.054 1.502 . . . . 0.0 115.054 -169.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -167.35 161.69 14.31 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 125.071 1.348 . . . . 0.0 109.718 -175.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 68.6 m -48.35 -32.59 7.7 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.363 1.065 . . . . 0.0 112.332 168.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -47.84 -52.78 17.79 Favored 'General case' 0 C--N 1.345 0.397 0 C-N-CA 125.614 1.565 . . . . 0.0 112.829 171.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.3 mt -76.03 -46.08 31.13 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 117.926 -1.035 . . . . 0.0 108.808 -173.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.52 -33.69 46.38 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 172.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 -68.01 -67.36 0.47 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.982 1.713 . . . . 0.0 112.327 173.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.94 -30.14 71.25 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.74 1.155 . . . . 0.0 113.276 -174.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 47.1 tp -65.56 -38.82 90.65 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.249 1.42 . . . . 0.0 110.905 169.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.02 -51.52 6.89 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 128.548 2.975 . . . . 0.0 115.091 -175.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -71.53 -2.49 17.07 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.43 1.615 . . . . 0.0 113.23 172.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 32.9 tp 69.84 110.62 0.05 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 128.605 2.762 . . . . 0.0 113.288 167.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 29.5 m -64.9 17.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 127.097 2.159 . . . . 0.0 116.376 -169.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.449 ' C ' ' H ' ' A' ' 93' ' ' VAL . 43.1 mm-40 75.55 -11.01 1.16 Allowed 'General case' 0 C--O 1.216 -0.676 0 O-C-N 120.525 -1.359 . . . . 0.0 113.277 158.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.3 p -70.74 40.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 126.769 2.028 . . . . 0.0 111.271 166.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.449 ' H ' ' C ' ' A' ' 91' ' ' GLN . 2.2 t 72.0 -33.49 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 130.82 3.648 . . . . 0.0 114.657 176.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 51.4 tp 128.91 94.08 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.66 1 C-N-CA 132.044 4.138 . . . . 0.0 105.792 -166.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.14 138.61 37.65 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -174.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 25.5 t -114.0 154.26 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 126.556 1.943 . . . . 0.0 108.917 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.8 -4.76 0.49 Allowed 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 127.205 2.202 . . . . 0.0 114.885 173.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.1 p -84.73 109.85 18.35 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.857 1.663 . . . . 0.0 113.254 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -89.61 157.95 17.82 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.194 0.998 . . . . 0.0 108.89 166.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -160.21 147.34 12.42 Favored Pre-proline 0 CA--C 1.556 1.19 0 CA-C-O 117.365 -1.303 . . . . 0.0 109.362 -169.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -38.77 146.84 0.14 Allowed 'Trans proline' 0 C--N 1.357 1.017 1 C-N-CA 127.111 5.208 . . . . 0.0 121.349 -166.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -75.16 72.22 2.24 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-O 123.021 1.391 . . . . 0.0 108.645 168.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 1.2 p -54.74 -25.98 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 127.055 2.142 . . . . 0.0 112.875 -170.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.453 ' CB ' ' HA ' ' B' ' 57' ' ' CYS . . . -61.52 97.11 0.07 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.329 0.651 . . . . 0.0 112.202 168.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 119.33 -58.35 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 131.509 3.924 . . . . 0.0 112.019 169.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 13.6 ptt-85 . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 115.759 1.763 . . . . 0.0 115.759 -166.977 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.688 0 N-CA-C 105.651 -1.981 . . . . 0.0 105.651 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . 0.272 1.8 pp -42.69 -55.03 3.77 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 117.248 2.314 . . . . 0.0 117.248 -164.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.38 -23.63 63.76 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 120.398 1.454 . . . . 0.0 112.731 178.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -20.44 61.4 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 116.626 -1.654 . . . . 0.0 112.055 172.204 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.58 -67.77 0.3 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 120.778 1.626 . . . . 0.0 108.589 170.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -57.63 -38.7 88.96 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-O 119.512 -0.604 . . . . 0.0 112.721 -175.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -62.47 -50.99 69.25 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 118.105 0.952 . . . . 0.0 112.669 173.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.27 -11.71 60.83 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.364 0.983 . . . . 0.0 113.37 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.3 mp -96.42 -14.2 22.61 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.34 1.056 . . . . 0.0 112.145 168.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.95 -13.86 56.9 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.397 1.079 . . . . 0.0 112.282 166.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -79.98 133.05 58.65 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 128.414 2.686 . . . . 0.0 108.927 -177.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . 0.402 ' HG2' ' H ' ' B' ' 22' ' ' THR . 61.4 Cg_endo -52.88 -84.7 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.614 1 C-N-CA 126.819 5.013 . . . . 0.0 113.297 -167.845 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.455 ' HG1' ' CD2' ' B' ' 54' ' ' HIS . 0.8 OUTLIER -63.03 -23.29 67.38 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 126.251 1.821 . . . . 0.0 112.508 179.868 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 47.0 mtt85 -73.84 -43.44 58.7 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 120.248 1.385 . . . . 0.0 112.663 176.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 4.5 t -58.32 -44.87 88.83 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.918 1.235 . . . . 0.0 110.023 170.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 19.5 tpt180 -61.31 -33.86 74.28 Favored 'General case' 0 CA--C 1.559 1.301 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 172.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -63.83 -52.15 60.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 O-C-N 119.601 -1.937 . . . . 0.0 108.957 168.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 88.5 mt -59.47 -44.7 92.96 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 117.674 -1.155 . . . . 0.0 112.437 -177.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 3.8 m -59.32 -23.89 26.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 CA-C-N 120.427 1.467 . . . . 0.0 112.734 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -98.92 -8.18 25.97 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.4 1.08 . . . . 0.0 112.784 -179.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.8 mt -87.14 -25.17 24.23 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.005 1.322 . . . . 0.0 112.932 168.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.2 -30.17 10.93 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 127.991 2.516 . . . . 0.0 111.676 166.144 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -131.0 -37.72 1.27 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.436 1.894 . . . . 0.0 115.447 -170.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.26 -63.23 3.01 Favored Glycine 0 C--N 1.343 0.963 0 C-N-CA 125.022 1.296 . . . . 0.0 114.688 -165.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 4.3 m 41.01 36.2 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 173.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 60.0 m -98.76 -76.37 0.54 Allowed 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 125.587 1.555 . . . . 0.0 112.198 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -143.08 153.29 60.02 Favored Pre-proline 0 N--CA 1.478 0.933 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 -169.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -54.41 -35.52 84.89 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.253 2.635 . . . . 0.0 112.64 178.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -80.41 -8.84 87.17 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-O 117.849 -1.528 . . . . 0.0 115.102 175.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.17 -32.35 73.74 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 120.627 2.213 . . . . 0.0 112.879 -171.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 5.2 mt -67.71 -7.87 30.63 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 118.543 0.611 . . . . 0.0 111.634 -178.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.51 -39.15 89.97 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.299 -0.875 . . . . 0.0 111.162 169.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.81 -44.22 33.44 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.295 1.038 . . . . 0.0 112.187 175.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 25.6 m-70 -57.45 -25.04 59.08 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 178.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 66.5 mt -115.21 -19.71 10.69 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.374 1.87 . . . . 0.0 114.251 -173.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.89 17.9 77.22 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-N 119.137 0.881 . . . . 0.0 113.065 -169.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 85.9 mt -110.27 162.05 15.0 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.563 1.182 . . . . 0.0 112.889 -174.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.9 t -68.67 148.91 49.74 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.123 -0.986 . . . . 0.0 110.092 168.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 22.8 ptt-85 -60.29 -15.34 24.26 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 174.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 1.8 m -67.35 -50.79 58.44 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.986 -1.071 . . . . 0.0 111.68 169.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -65.92 -43.22 88.79 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.68 0.792 . . . . 0.0 110.398 176.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 16.6 t -54.6 -44.39 69.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 O-C-N 121.588 -0.695 . . . . 0.0 112.074 171.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.1 m -62.3 -39.91 94.57 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.51 1.05 . . . . 0.0 112.802 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -55.78 -44.8 78.09 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.45 1.1 . . . . 0.0 111.487 172.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . 0.455 ' CD2' ' HG1' ' B' ' 22' ' ' THR . 22.2 m80 -63.27 -40.6 97.86 Favored 'General case' 0 CA--C 1.549 0.906 0 O-C-N 121.179 -0.95 . . . . 0.0 112.305 172.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 82.7 mt -73.83 -28.36 61.57 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -176.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 68.1 m -50.68 -53.39 31.54 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 120.798 1.636 . . . . 0.0 113.785 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . 0.453 ' HA ' ' CB ' ' A' ' 104' ' ' ALA . 36.2 t -68.87 -42.85 76.47 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 118.551 0.614 . . . . 0.0 112.525 179.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 mp -49.0 -41.88 35.96 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.552 1.941 . . . . 0.0 114.287 174.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 85.7 mtm180 -91.4 -20.85 21.36 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -177.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -86.52 -45.72 5.44 Favored Glycine 0 N--CA 1.472 1.054 0 CA-C-N 119.921 1.237 . . . . 0.0 112.122 176.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 84.8 m -74.29 9.08 1.81 Allowed 'General case' 0 CA--C 1.561 1.399 0 C-N-CA 126.083 1.753 . . . . 0.0 113.612 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 84.81 -5.67 81.3 Favored Glycine 0 C--N 1.341 0.853 0 C-N-CA 128.797 3.094 . . . . 0.0 116.713 168.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 12.0 mt -64.26 -22.56 66.99 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 119.007 1.404 . . . . 0.0 114.6 -173.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 31.9 t -137.91 134.8 45.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 125.533 1.533 . . . . 0.0 112.284 -171.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 15.7 t -118.6 132.62 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 126.843 2.057 . . . . 0.0 111.281 -169.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -82.36 129.93 34.99 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.878 0.871 . . . . 0.0 110.8 169.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.01 159.76 42.03 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.111 0.964 . . . . 0.0 110.42 174.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.38 128.74 34.17 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.457 0.571 . . . . 0.0 109.912 166.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.65 -28.65 30.54 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.443 -0.786 . . . . 0.0 112.731 170.005 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 159.77 -39.79 0.47 Allowed Glycine 0 CA--C 1.531 1.038 0 C-N-CA 124.556 1.074 . . . . 0.0 115.005 172.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.31 -19.23 11.34 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.689 1.596 . . . . 0.0 113.103 172.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.85 171.74 13.8 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.485 1.914 . . . . 0.0 110.588 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 7.1 p -80.68 152.4 4.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 C-N-CA 124.328 1.051 . . . . 0.0 109.682 168.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 22.0 ptt180 -132.04 173.96 10.68 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.52 2.328 . . . . 0.0 110.749 177.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -120.09 120.93 37.67 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.643 166.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -109.87 164.04 12.96 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.159 1.384 . . . . 0.0 109.165 172.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 64.8 mt -70.02 166.35 19.91 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.725 -0.609 . . . . 0.0 111.018 172.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.8 -48.88 66.59 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 -177.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -161.99 164.66 28.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.988 2.115 . . . . 0.0 109.377 -171.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 73.2 m -51.53 -26.83 9.21 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.918 0.887 . . . . 0.0 112.58 168.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -52.26 -58.38 6.82 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 125.024 1.329 . . . . 0.0 112.292 170.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 8.9 mt -70.22 -42.62 72.03 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.563 1.074 . . . . 0.0 109.774 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.25 -35.77 50.69 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.242 1.017 . . . . 0.0 113.237 173.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 -67.01 -64.66 0.81 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.704 1.201 . . . . 0.0 112.337 175.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.63 -17.97 64.98 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 -176.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 43.0 tp -82.58 -30.94 29.26 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 127.104 2.162 . . . . 0.0 112.352 169.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -87.23 -59.71 1.73 Allowed Glycine 0 N--CA 1.473 1.102 0 C-N-CA 128.776 3.084 . . . . 0.0 114.252 -172.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -71.81 -16.57 62.18 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 119.045 1.422 . . . . 0.0 110.708 167.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . 0.496 ' C ' ' H ' ' B' ' 91' ' ' GLN . 23.5 tp 78.24 147.79 0.09 Allowed 'General case' 0 C--N 1.343 0.312 0 C-N-CA 129.16 2.984 . . . . 0.0 114.488 165.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 15.6 m -59.05 10.39 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 127.366 2.266 . . . . 0.0 114.46 168.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.496 ' H ' ' C ' ' B' ' 89' ' ' LEU . 8.6 mm-40 70.57 -17.2 0.29 Allowed 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 127.083 2.153 . . . . 0.0 115.571 172.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 2.5 p -59.06 31.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 C-N-CA 130.622 3.569 . . . . 0.0 116.803 -178.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.4 t 69.77 12.96 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 127.702 2.401 . . . . 0.0 113.086 168.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 46.6 tp 84.06 104.41 0.05 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 129.285 3.034 . . . . 0.0 108.743 -169.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.07 119.42 5.44 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.165 168.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 2.9 t -95.05 165.2 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 126.207 1.803 . . . . 0.0 109.798 171.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -62.02 18.39 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 128.576 2.75 . . . . 0.0 115.935 175.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 44.2 p -102.06 117.96 35.89 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.399 1.48 . . . . 0.0 113.392 -173.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -80.28 152.97 28.76 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 165.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -159.97 139.23 8.09 Favored Pre-proline 0 CA--C 1.545 0.757 0 CA-C-O 116.977 -1.487 . . . . 0.0 107.007 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -47.78 146.98 7.66 Favored 'Trans proline' 0 C--N 1.353 0.795 1 C-N-CA 125.753 4.302 . . . . 0.0 118.212 -167.031 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . 0.484 ' N ' ' HE ' ' A' ' 13' ' ' ARG . 7.5 t -77.9 57.05 1.65 Allowed 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 125.316 1.446 . . . . 0.0 110.669 169.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 1.5 p -28.13 -42.32 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.575 1 C-N-CA 132.278 4.231 . . . . 0.0 116.628 -168.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -50.88 154.93 1.3 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 122.25 1.024 . . . . 0.0 112.926 177.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 72.83 -40.09 0.47 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.263 1.825 . . . . 0.0 113.742 -177.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 6.8 ptt-85 . . . . . 0 N--CA 1.486 1.349 0 C-N-CA 128.782 2.833 . . . . 0.0 113.606 171.689 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.606 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 pp -60.56 -43.11 97.63 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.747 1.018 . . . . 0.0 113.747 -174.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.34 -20.76 66.54 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.973 0.909 . . . . 0.0 113.111 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.8 mmt180 -87.77 -43.03 12.18 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.141 0.977 . . . . 0.0 110.564 173.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -59.17 -43.34 92.11 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.55 1.14 . . . . 0.0 112.095 -178.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -56.13 -30.98 58.6 Favored Glycine 0 CA--C 1.533 1.205 0 CA-C-N 118.963 0.801 . . . . 0.0 112.586 176.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.6 ttp85 -90.69 -13.77 33.53 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 174.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.1 -30.05 62.15 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 121.033 1.742 . . . . 0.0 111.108 169.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.8 mp -81.96 -45.89 14.76 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.137 0.975 . . . . 0.0 110.298 169.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.19 64.98 5.19 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-O 122.459 1.123 . . . . 0.0 112.874 170.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -136.55 138.52 26.84 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 128.876 2.87 . . . . 0.0 109.523 -177.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -52.18 -89.26 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.807 1 C-N-CA 126.22 4.614 . . . . 0.0 114.159 -168.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 m -67.72 -24.22 65.35 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.833 0.853 . . . . 0.0 110.734 -177.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.9 ttm105 -74.74 -37.82 62.42 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.849 1.204 . . . . 0.0 112.601 -177.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 14.0 t -55.75 -46.48 77.82 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 120.126 1.33 . . . . 0.0 109.982 166.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 58.0 mmt-85 -58.95 -44.7 91.51 Favored 'General case' 0 C--O 1.217 -0.652 0 CA-C-O 117.801 -1.095 . . . . 0.0 112.809 174.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mm -53.26 -48.93 54.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 CA-C-N 120.867 1.667 . . . . 0.0 110.763 173.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 89.3 mt -61.88 -42.39 99.01 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 118.538 -0.744 . . . . 0.0 111.44 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -77.19 -26.26 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -179.2 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.82 -31.67 59.49 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.289 1.436 . . . . 0.0 111.056 173.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 tp -65.1 -45.11 86.54 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 116.567 -1.682 . . . . 0.0 111.882 169.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 mt -47.59 -45.3 27.2 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.58 1.952 . . . . 0.0 113.677 -178.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -98.3 -1.81 40.95 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 125.97 1.708 . . . . 0.0 113.193 177.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -107.7 -76.52 0.98 Allowed Glycine 0 C--N 1.341 0.85 0 C-N-CA 126.561 2.029 . . . . 0.0 113.636 -174.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.2 m 36.45 34.7 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 C-N-CA 127.576 2.351 . . . . 0.0 115.362 -169.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.56 -62.33 1.61 Allowed 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.247 -0.908 . . . . 0.0 112.814 -172.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -164.63 155.89 13.34 Favored Pre-proline 0 N--CA 1.476 0.835 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -169.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -57.79 129.88 35.72 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.075 1.85 . . . . 0.0 108.682 169.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.17 -2.67 83.77 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 117.486 -1.73 . . . . 0.0 114.312 -173.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.549 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -60.86 -36.08 78.26 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 120.828 2.314 . . . . 0.0 110.323 169.96 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.96 -19.67 63.02 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.601 1.161 . . . . 0.0 112.221 179.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.59 -25.58 68.3 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 118.393 0.542 . . . . 0.0 111.839 178.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.08 -54.76 5.48 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.98 0.912 . . . . 0.0 111.377 169.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.549 ' CD2' HE22 ' A' ' 39' ' ' GLN . 5.4 m-70 -55.01 -26.38 36.65 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 57.0 mt -108.39 -12.79 14.98 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.26 1.424 . . . . 0.0 113.432 -176.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.45 6.11 32.82 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 124.202 0.906 . . . . 0.0 113.935 -171.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 57.5 mt -108.1 138.8 43.75 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.399 1.08 . . . . 0.0 111.39 -169.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.7 t -60.37 151.63 27.4 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.654 0.74 . . . . 0.0 112.324 -173.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -50.53 -35.91 31.76 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.374 1.469 . . . . 0.0 113.484 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.03 -45.74 80.37 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.373 1.069 . . . . 0.0 111.944 175.077 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -66.55 -45.5 79.19 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.36 -0.837 . . . . 0.0 111.569 175.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.6 t -63.39 -28.6 45.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 O-C-N 120.748 -1.22 . . . . 0.0 112.153 175.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.8 m -63.51 -41.53 98.51 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.007 0.821 . . . . 0.0 112.726 171.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -59.48 -34.03 72.06 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.912 0.885 . . . . 0.0 112.463 172.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -70.69 -45.75 64.42 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 121.105 -0.997 . . . . 0.0 112.849 172.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 83.2 mt -69.76 -18.58 63.51 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.312 1.445 . . . . 0.0 113.81 176.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 t -57.2 -55.56 33.13 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.97 1.259 . . . . 0.0 111.303 -178.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 16.0 t -69.6 -34.63 74.37 Favored 'General case' 0 C--O 1.219 -0.537 0 O-C-N 121.749 -0.594 . . . . 0.0 111.858 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.3 tp -64.76 -37.36 87.35 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.994 0.918 . . . . 0.0 112.514 -176.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 88.5 mtm180 -85.16 -30.4 23.97 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.884 1.273 . . . . 0.0 110.979 175.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.61 -44.55 81.78 Favored Glycine 0 N--CA 1.474 1.195 0 C-N-CA 123.915 0.769 . . . . 0.0 112.532 176.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 20.6 m -72.95 -10.2 59.55 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.376 1.47 . . . . 0.0 112.816 169.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.71 2.59 61.12 Favored Glycine 0 CA--C 1.533 1.187 0 O-C-N 120.531 -1.356 . . . . 0.0 115.127 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.5 mt -53.94 -25.94 23.0 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 120.092 1.946 . . . . 0.0 113.391 173.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.9 m -124.47 141.92 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.833 1.653 . . . . 0.0 113.881 169.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 65.6 t -133.92 137.8 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 126.186 1.795 . . . . 0.0 110.508 -175.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -91.28 154.43 19.26 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 174.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.8 m -143.06 135.34 27.26 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.332 1.853 . . . . 0.0 110.065 -173.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -79.63 105.36 10.87 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.827 0.851 . . . . 0.0 112.333 169.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -83.59 174.34 10.64 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.555 1.142 . . . . 0.0 110.76 167.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -69.57 24.16 0.38 Allowed Glycine 0 N--CA 1.481 1.649 0 N-CA-C 117.891 1.916 . . . . 0.0 117.891 -168.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.82 -14.04 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 128.174 2.59 . . . . 0.0 113.913 179.024 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -140.77 171.37 14.19 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 126.777 2.031 . . . . 0.0 108.191 -175.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 34.2 m -118.06 148.14 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 123.581 0.752 . . . . 0.0 109.004 170.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.2 ptt85 -117.21 -178.73 3.52 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.319 0.648 . . . . 0.0 112.499 174.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -131.34 131.23 43.59 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.068 1.747 . . . . 0.0 106.886 166.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.88 163.73 25.7 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.673 1.589 . . . . 0.0 110.284 176.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.8 mp -59.3 146.25 40.23 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.763 0.825 . . . . 0.0 109.564 169.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -47.64 -40.86 20.76 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.808 1.243 . . . . 0.0 114.048 -178.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -167.92 167.24 12.97 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.737 1.615 . . . . 0.0 111.401 176.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -35.61 -35.79 0.06 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 130.399 3.479 . . . . 0.0 112.228 165.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -44.05 -61.23 1.54 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 126.587 1.955 . . . . 0.0 113.059 169.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.6 mt -74.75 -29.85 61.28 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.345 0.975 . . . . 0.0 110.24 -176.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.54 -26.83 68.88 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.633 -1.175 . . . . 0.0 111.69 178.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -67.67 -71.78 0.19 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 120.117 1.326 . . . . 0.0 111.688 172.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.48 -41.79 90.58 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.451 1.023 . . . . 0.0 112.262 -169.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.94 -35.42 74.52 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.846 1.259 . . . . 0.0 111.745 175.03 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.42 -45.6 94.57 Favored Glycine 0 CA--C 1.527 0.837 0 C-N-CA 126.064 1.792 . . . . 0.0 113.571 173.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . 0.328 16.4 pt-20 -85.25 21.12 1.78 Allowed 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.629 1.172 . . . . 0.0 112.953 169.655 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 33.9 tp 77.75 -43.71 0.4 Allowed 'General case' 0 N--CA 1.474 0.769 1 C-N-CA 131.856 4.062 . . . . 0.0 113.986 166.512 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.365 5.2 t 145.3 5.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.286 1 C-N-CA 134.787 5.235 . . . . 0.0 110.412 168.966 . . . . . . . . 3 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 87.47 -25.34 0.09 Allowed 'General case' 0 C--O 1.217 -0.658 0 O-C-N 120.119 -1.613 . . . . 0.0 111.115 137.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.32 48.1 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 130.391 3.476 . . . . 0.0 111.217 166.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER 68.54 -32.68 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 131.635 3.974 . . . . 0.0 115.145 175.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 50.1 tp 132.86 86.36 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.108 1 C-N-CA 132.417 4.287 . . . . 0.0 106.851 -167.57 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.22 16.22 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 118.708 2.855 . . . . 0.0 118.708 -168.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER 68.7 128.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 129.785 3.234 . . . . 0.0 114.508 176.2 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -72.8 2.52 6.54 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 127.333 2.253 . . . . 0.0 114.09 173.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 34.6 p -80.67 170.89 15.72 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.856 1.662 . . . . 0.0 111.446 172.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -134.61 126.69 29.7 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 165.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 48.1 mm-40 -151.05 170.06 8.35 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 126.968 2.107 . . . . 0.0 108.696 -167.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -73.6 -171.77 0.92 Allowed 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.657 2.238 . . . . 0.0 109.534 166.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 51.7 t -59.29 155.61 14.16 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 123.352 1.548 . . . . 0.0 113.028 -177.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -75.44 -3.52 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-N 113.754 -1.566 . . . . 0.0 111.947 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -75.38 -25.79 57.95 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.138 0.975 . . . . 0.0 111.735 166.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -96.04 -153.95 0.42 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.699 1.6 . . . . 0.0 111.588 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 31.2 ttm180 . . . . . 0 N--CA 1.469 0.518 0 C-N-CA 124.692 1.197 . . . . 0.0 112.239 -172.846 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.597 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 pp -55.76 -45.21 78.12 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -175.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.62 -25.55 68.01 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.398 1.079 . . . . 0.0 113.082 -178.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 15.9 mmt180 -84.0 -41.75 16.93 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.736 0.814 . . . . 0.0 110.498 176.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -57.95 -48.53 79.68 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.326 0.65 . . . . 0.0 111.523 177.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.75 -28.2 62.68 Favored Glycine 0 CA--C 1.533 1.165 0 CA-C-N 119.005 0.821 . . . . 0.0 113.046 -178.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -87.22 -21.53 25.79 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-O 118.028 -0.987 . . . . 0.0 113.651 171.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.45 -29.28 64.68 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 121.584 1.993 . . . . 0.0 112.205 172.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.2 mp -84.11 -44.74 13.73 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 118.089 -0.958 . . . . 0.0 110.489 169.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.68 66.68 5.23 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-O 122.804 1.288 . . . . 0.0 111.467 169.209 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -136.15 139.74 30.95 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 128.318 2.647 . . . . 0.0 109.242 -175.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . 0.404 ' HG2' ' H ' ' B' ' 22' ' ' THR . 56.0 Cg_endo -55.23 -79.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 125.179 3.92 . . . . 0.0 111.811 -171.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.404 ' H ' ' HG2' ' B' ' 21' ' ' PRO . 0.2 OUTLIER -68.88 -30.84 69.43 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 117.355 -1.307 . . . . 0.0 111.486 -178.046 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 64.5 mtt85 -72.95 -37.35 67.15 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 121.299 1.863 . . . . 0.0 112.715 -177.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 36.5 t -54.3 -48.69 71.0 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 121.438 1.926 . . . . 0.0 110.301 168.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 73.8 mmt-85 -58.59 -54.12 50.68 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.022 0.929 . . . . 0.0 112.949 175.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mm -49.78 -50.21 18.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 C-N-CA 125.939 1.696 . . . . 0.0 111.67 172.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 96.3 mt -65.56 -41.61 92.78 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.597 -175.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 p -78.08 -28.4 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 CA-C-N 119.102 0.865 . . . . 0.0 112.562 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.72 -31.73 69.9 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.494 1.118 . . . . 0.0 111.627 170.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 3.6 tp -63.58 -45.51 90.12 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 117.087 -1.435 . . . . 0.0 112.466 169.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.1 mt -47.63 -45.62 27.93 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 127.311 2.244 . . . . 0.0 113.856 -176.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -106.9 18.1 22.26 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 126.171 1.789 . . . . 0.0 112.317 179.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.67 -75.07 0.23 Allowed Glycine 0 N--CA 1.47 0.937 0 C-N-CA 125.94 1.734 . . . . 0.0 113.554 -175.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . 0.556 ' HB ' ' HE ' ' B' ' 74' ' ' ARG . 26.7 m 36.71 34.61 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 127.047 2.139 . . . . 0.0 116.477 -171.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.6 -59.58 2.39 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 -171.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 7.7 p90 -165.89 156.59 11.68 Favored Pre-proline 0 N--CA 1.473 0.684 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -170.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -57.51 129.97 36.57 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.209 1.939 . . . . 0.0 108.684 169.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.98 -0.83 81.94 Favored Glycine 0 CA--C 1.532 1.103 0 CA-C-O 117.252 -1.86 . . . . 0.0 114.559 -173.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . 0.597 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -61.1 -37.56 83.17 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 121.045 2.422 . . . . 0.0 109.818 169.546 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mt -60.59 -21.07 62.22 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 124.673 1.189 . . . . 0.0 111.948 179.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.75 -27.59 69.3 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.787 -0.57 . . . . 0.0 112.149 178.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.23 -52.53 7.62 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.177 0.991 . . . . 0.0 111.474 170.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . 0.597 ' CD2' HE22 ' B' ' 39' ' ' GLN . 2.6 m-70 -54.88 -27.55 43.64 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 179.44 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 53.1 mt -108.29 -14.92 14.59 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.967 1.307 . . . . 0.0 113.961 -174.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.57 5.26 49.67 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.309 0.957 . . . . 0.0 114.107 -170.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 75.7 mt -105.03 137.51 42.67 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.653 1.181 . . . . 0.0 111.309 -171.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 12.6 t -60.84 152.03 28.3 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.513 -0.742 . . . . 0.0 112.16 -173.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -50.45 -42.68 54.5 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.983 1.313 . . . . 0.0 112.81 -178.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 1.5 m -64.3 -38.95 92.85 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.138 -0.977 . . . . 0.0 112.547 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -70.48 -45.83 64.92 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.256 0.623 . . . . 0.0 111.308 174.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.2 t -63.13 -31.23 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 O-C-N 120.981 -1.075 . . . . 0.0 111.694 176.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 39.2 m -56.67 -44.39 81.36 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.956 1.253 . . . . 0.0 113.056 169.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -60.74 -28.13 68.46 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.228 0.922 . . . . 0.0 112.869 176.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -78.52 -41.76 31.38 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.878 -1.139 . . . . 0.0 112.616 173.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 89.5 mt -72.28 -17.64 61.86 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.747 1.219 . . . . 0.0 114.064 174.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.3 t -58.97 -58.54 8.18 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.449 1.022 . . . . 0.0 111.601 -177.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 9.1 t -64.59 -39.27 93.43 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.714 -0.616 . . . . 0.0 111.415 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 tp -55.8 -48.43 75.4 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.917 2.487 . . . . 0.0 113.1 -177.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -80.5 -12.53 59.53 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.118 0.967 . . . . 0.0 111.859 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -82.36 -47.05 6.23 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.205 0.907 . . . . 0.0 111.307 169.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 59.8 m -67.95 -3.26 9.37 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 127.358 2.263 . . . . 0.0 114.414 174.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 62.47 22.82 64.04 Favored Glycine 0 N--CA 1.471 0.999 0 CA-C-N 119.852 1.205 . . . . 0.0 114.006 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 85.1 mt -69.5 -24.32 63.74 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.188 1.494 . . . . 0.0 112.761 171.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 1.5 m -146.82 140.57 20.12 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 C-N-CA 126.223 1.809 . . . . 0.0 111.328 -169.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 9.3 t -138.25 140.64 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 O-C-N 124.115 0.884 . . . . 0.0 110.22 -169.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.94 147.74 26.1 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.852 1.261 . . . . 0.0 113.261 174.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 45.4 m -138.15 135.55 35.81 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.892 1.677 . . . . 0.0 109.544 -177.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -79.26 120.83 24.29 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 123.977 0.798 . . . . 0.0 110.525 168.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -106.05 173.73 6.19 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.003 1.721 . . . . 0.0 109.5 175.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -68.36 23.79 0.27 Allowed Glycine 0 N--CA 1.481 1.649 0 N-CA-C 118.366 2.107 . . . . 0.0 118.366 -168.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 170.15 -9.61 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 128.929 2.891 . . . . 0.0 114.076 177.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -142.77 172.89 12.08 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.169 1.788 . . . . 0.0 108.524 -177.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 35.6 m -116.39 148.02 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 169.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . 0.556 ' HE ' ' HB ' ' B' ' 34' ' ' VAL . 0.0 OUTLIER -122.38 -179.32 4.15 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.541 0.686 . . . . 0.0 111.871 178.558 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -128.88 136.27 50.2 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 166.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -134.6 161.59 34.67 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 124.6 1.16 . . . . 0.0 109.445 177.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.27 148.89 49.19 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 167.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.96 -27.97 69.2 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 115.873 1.805 . . . . 0.0 115.873 -169.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -172.94 162.42 4.69 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.234 1.813 . . . . 0.0 112.286 177.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.3 m -33.84 -38.57 0.06 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 129.524 3.13 . . . . 0.0 112.885 164.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -50.06 -58.15 6.12 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.588 1.955 . . . . 0.0 113.161 173.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 14.3 mt -72.66 -38.15 67.72 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.878 -1.139 . . . . 0.0 110.668 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -56.18 -31.37 63.35 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.975 1.31 . . . . 0.0 112.999 176.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -66.89 -66.24 0.58 Allowed 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 120.25 1.386 . . . . 0.0 111.5 171.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.48 -41.33 76.41 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.146 0.979 . . . . 0.0 112.527 -173.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -78.12 -32.47 50.46 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.27 1.828 . . . . 0.0 111.717 176.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.91 -45.59 91.99 Favored Glycine 0 N--CA 1.469 0.849 0 C-N-CA 125.637 1.589 . . . . 0.0 112.205 177.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . 0.313 19.6 pt-20 -92.05 20.0 6.26 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 167.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 24.8 tp 70.79 -42.87 0.54 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 131.057 3.743 . . . . 0.0 115.692 167.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.6 m 168.38 -21.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.956 1 C-N-CA 131.928 4.091 . . . . 0.0 110.581 -171.372 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 71.04 -15.73 0.39 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.454 2.302 . . . . 0.0 114.276 174.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 3.6 p -59.21 37.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 129.408 3.083 . . . . 0.0 115.51 170.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 80.38 -24.6 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 C-N-CA 127.909 2.484 . . . . 0.0 112.682 175.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 56.0 tp 117.05 95.04 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 131.347 3.859 . . . . 0.0 105.919 -167.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.8 122.57 18.87 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.422 -0.799 . . . . 0.0 108.891 171.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 2.7 t -51.9 139.08 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 124.736 1.215 . . . . 0.0 113.95 -178.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -67.04 12.7 0.07 Allowed 'General case' 0 CA--C 1.561 1.366 0 C-N-CA 127.72 2.408 . . . . 0.0 115.037 171.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 6.8 p -89.35 171.16 9.96 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.574 1.549 . . . . 0.0 110.801 173.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -126.56 122.5 35.27 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 168.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 50.7 mm-40 -147.96 165.24 19.01 Favored Pre-proline 0 CA--C 1.544 0.717 0 C-N-CA 127.014 2.126 . . . . 0.0 108.59 -168.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.34 -173.95 1.64 Allowed 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.466 2.777 . . . . 0.0 110.025 167.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 36.4 t -58.85 149.33 27.06 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-O 122.527 1.156 . . . . 0.0 112.975 179.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -74.77 1.52 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 CA-C-N 114.869 -1.06 . . . . 0.0 112.378 -177.049 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.15 -27.36 42.73 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.392 1.077 . . . . 0.0 111.938 166.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -89.72 -153.41 0.28 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 126.168 1.787 . . . . 0.0 111.864 175.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 . . . . . 0 N--CA 1.469 0.517 0 C-N-CA 124.94 1.296 . . . . 0.0 111.786 -174.428 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.069 0 CA-C-O 117.97 -1.014 . . . . 0.0 108.478 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 25.9 tp -52.36 -44.13 65.05 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.714 1.143 . . . . 0.0 110.964 173.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.81 -3.51 12.68 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 66.5 mtt-85 -124.46 -38.44 2.41 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.06 1.344 . . . . 0.0 111.265 178.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -50.9 -58.2 6.59 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.784 1.633 . . . . 0.0 107.941 166.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.12 -22.7 77.39 Favored Glycine 0 C--O 1.218 -0.856 0 CA-C-O 118.392 -1.227 . . . . 0.0 111.627 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.403 ' HG3' HH11 ' A' ' 16' ' ' ARG . 2.6 ttm-85 -68.75 -39.31 80.38 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 119.514 1.657 . . . . 0.0 111.688 171.57 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.88 -35.3 79.71 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.072 -1.018 . . . . 0.0 111.658 175.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.27 6.9 mp -87.53 10.42 17.85 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 123.536 0.734 . . . . 0.0 111.639 171.533 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -111.55 2.23 17.27 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 126.105 1.762 . . . . 0.0 113.52 166.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.425 ' CG ' ' HE ' ' A' ' 23' ' ' ARG . 7.4 t70 -105.07 136.3 19.19 Favored Pre-proline 0 CA--C 1.538 0.511 0 C-N-CA 126.08 1.752 . . . . 0.0 109.904 -172.012 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.516 ' HG2' ' H ' ' A' ' 22' ' ' THR . 55.2 Cg_endo -55.86 -62.94 0.21 Allowed 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 125.226 3.951 . . . . 0.0 111.201 -172.367 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.516 ' H ' ' HG2' ' A' ' 21' ' ' PRO . 85.3 m -62.6 -44.12 97.11 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 117.558 -1.211 . . . . 0.0 109.832 -174.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.425 ' HE ' ' CG ' ' A' ' 20' ' ' ASP . 30.1 mtm180 -68.51 -38.39 80.9 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 117.128 -1.415 . . . . 0.0 112.491 -175.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 88.1 m -57.97 -50.0 74.88 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 120.244 1.384 . . . . 0.0 111.02 170.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.3 ttm180 -62.54 -37.45 86.14 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 118.758 -0.639 . . . . 0.0 112.266 177.049 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.4 mt -54.04 -61.63 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 C-N-CA 125.059 1.344 . . . . 0.0 110.055 169.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 92.3 mt -56.15 -41.15 74.94 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.811 0.844 . . . . 0.0 111.501 -169.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.2 p -77.52 -32.43 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 175.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.79 -30.27 68.82 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 119.29 0.95 . . . . 0.0 112.507 174.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.0 tp -64.47 -43.46 94.16 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 121.094 -1.004 . . . . 0.0 112.244 177.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -44.28 -36.11 2.61 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.958 2.903 . . . . 0.0 113.916 174.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -90.9 -41.08 11.36 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.3 1.84 . . . . 0.0 112.723 176.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.38 -69.93 1.3 Allowed Glycine 0 C--N 1.337 0.587 0 C-N-CA 124.026 0.822 . . . . 0.0 112.449 -168.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.3 m 37.88 33.23 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 125.371 1.469 . . . . 0.0 114.692 -167.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -83.91 -64.46 1.16 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.016 -1.053 . . . . 0.0 112.177 -171.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -156.97 157.11 30.53 Favored Pre-proline 0 N--CA 1.473 0.688 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -169.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -58.98 118.97 5.95 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.24 1.96 . . . . 0.0 108.52 171.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 90.68 1.46 73.97 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 117.335 -1.814 . . . . 0.0 114.936 -175.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.469 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -61.47 -35.83 78.74 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 121.184 2.492 . . . . 0.0 110.468 169.429 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 33.7 mt -54.45 -22.53 12.95 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 126.135 1.774 . . . . 0.0 112.077 174.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.86 -27.26 69.05 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.348 -1.47 . . . . 0.0 112.2 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.54 -57.09 4.01 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 118.203 0.456 . . . . 0.0 110.267 169.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.469 ' CD2' HE22 ' A' ' 39' ' ' GLN . 3.0 m-70 -54.57 -31.0 55.9 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 -177.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 37.5 mt -103.05 -2.67 27.12 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.968 1.307 . . . . 0.0 113.417 -175.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.24 7.83 20.76 Favored Glycine 0 CA--C 1.535 1.324 0 CA-C-N 118.968 0.804 . . . . 0.0 114.441 -175.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 36.2 mt -107.25 160.19 15.78 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.61 1.164 . . . . 0.0 112.91 -171.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.2 t -62.49 144.54 55.88 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.124 -0.985 . . . . 0.0 111.768 170.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -55.46 -29.21 58.28 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 127.007 2.123 . . . . 0.0 111.602 175.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 29.8 p -72.03 -57.33 4.37 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.431 -0.793 . . . . 0.0 111.739 169.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -66.09 -26.43 67.47 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 120.075 -1.641 . . . . 0.0 113.94 -175.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 75.9 t -66.54 -35.47 74.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 CA-C-N 120.402 1.456 . . . . 0.0 111.439 167.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.9 p -77.11 -22.29 52.94 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.697 -1.252 . . . . 0.0 114.137 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 -39.64 -44.94 1.58 Allowed 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 126.239 1.815 . . . . 0.0 111.198 167.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . 0.264 11.6 m-70 -104.33 -11.02 17.39 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -173.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 80.7 mt -71.64 -21.63 61.8 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.735 -1.228 . . . . 0.0 112.695 168.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.6 t -50.96 -42.59 60.01 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.576 1.08 . . . . 0.0 113.809 178.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 48.4 t -89.85 -32.15 17.03 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 118.79 0.723 . . . . 0.0 111.771 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 tp -56.58 -40.36 75.11 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.79 0.836 . . . . 0.0 111.311 176.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -78.32 -16.43 57.73 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 175.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -88.69 -56.19 2.03 Favored Glycine 0 N--CA 1.47 0.954 0 C-N-CA 125.931 1.729 . . . . 0.0 111.883 -177.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 52.0 m -64.27 -6.66 7.29 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 125.309 1.444 . . . . 0.0 111.942 168.052 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.49 6.62 84.52 Favored Glycine 0 C--N 1.341 0.849 0 C-N-CA 124.979 1.276 . . . . 0.0 114.176 171.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.7 mt -48.41 -28.73 3.42 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.262 1.425 . . . . 0.0 113.15 170.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.7 m -132.12 143.73 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 126.173 1.789 . . . . 0.0 112.23 173.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 45.4 t -126.5 143.3 40.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 127.154 2.182 . . . . 0.0 110.047 -175.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -89.54 154.03 20.32 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.111 1.364 . . . . 0.0 113.795 173.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.4 m -163.01 161.59 25.55 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.702 1.601 . . . . 0.0 108.471 -174.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -80.47 156.63 26.49 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 119.672 1.124 . . . . 0.0 113.05 169.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -115.41 -152.5 0.5 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.04 1.336 . . . . 0.0 108.825 166.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.02 -22.19 60.07 Favored Glycine 0 CA--C 1.537 1.414 0 CA-C-N 121.01 1.732 . . . . 0.0 115.156 -175.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.74 -23.34 0.08 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.708 1.203 . . . . 0.0 113.871 169.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -95.14 -170.24 2.15 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.484 1.914 . . . . 0.0 109.982 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 35.1 m -109.9 166.09 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 124.61 1.164 . . . . 0.0 109.959 169.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.0 ptt180 -140.8 171.04 14.64 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 128.178 2.591 . . . . 0.0 110.319 -170.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -124.03 139.05 54.32 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.88 1.272 . . . . 0.0 108.008 167.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -131.98 161.4 33.22 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 126.314 1.846 . . . . 0.0 109.547 175.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.0 mt -60.77 159.53 10.87 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 118.732 0.696 . . . . 0.0 110.248 169.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -42.49 -44.37 4.05 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.436 1.494 . . . . 0.0 114.334 -176.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.527 ' CG ' ' H ' ' A' ' 80' ' ' SER . 17.4 t70 -177.55 -172.35 0.36 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 129.491 3.116 . . . . 0.0 109.576 169.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.527 ' H ' ' CG ' ' A' ' 79' ' ' ASP . 14.3 t -53.37 -20.92 5.0 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 127.32 2.248 . . . . 0.0 113.396 174.185 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -46.92 87.76 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.224 1.009 . . . . 0.0 111.692 176.406 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 8.8 mt -86.52 -31.99 20.98 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.193 0.906 . . . . 0.0 111.202 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.58 -28.6 65.69 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.036 0.835 . . . . 0.0 112.893 170.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.9 mmt180 -69.33 -65.68 0.68 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.256 1.422 . . . . 0.0 112.002 169.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.83 -19.54 64.18 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -175.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.34 -38.82 14.82 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.6 -1.312 . . . . 0.0 111.949 167.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.47 -52.71 20.16 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 126.361 1.934 . . . . 0.0 114.372 -177.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.26 -6.89 56.32 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.562 1.181 . . . . 0.0 112.56 169.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 18.8 tp 77.79 128.47 0.05 OUTLIER 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 129.393 3.077 . . . . 0.0 113.201 167.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.4 m -34.13 -21.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 131.129 3.771 . . . . 0.0 116.532 170.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 76.57 -9.9 1.41 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.287 1.835 . . . . 0.0 114.063 165.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 17.3 m -64.57 57.44 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.717 1 C-N-CA 132.497 4.319 . . . . 0.0 112.159 169.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . 0.396 0.5 OUTLIER 19.04 44.86 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.424 -1.762 0 CA-C-N 108.581 -3.918 . . . . 0.0 116.272 -162.805 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 50.8 tp 61.29 83.91 0.14 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.851 2.061 . . . . 0.0 111.674 -169.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.69 85.76 0.05 OUTLIER 'General case' 0 CA--C 1.55 0.948 0 O-C-N 121.057 -1.027 . . . . 0.0 111.712 170.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 89.9 t -59.04 153.94 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 127.829 2.452 . . . . 0.0 111.199 169.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -42.96 1.79 0.0 OUTLIER 'General case' 0 CA--C 1.565 1.524 1 C-N-CA 131.727 4.011 . . . . 0.0 117.162 169.885 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -97.17 146.82 24.7 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 128.23 2.612 . . . . 0.0 116.501 -169.42 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -89.21 73.29 8.11 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.967 1.707 . . . . 0.0 109.759 167.012 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -65.64 146.91 98.95 Favored Pre-proline 0 CA--C 1.549 0.907 0 O-C-N 120.845 -1.16 . . . . 0.0 109.93 169.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.67 97.17 0.78 Allowed 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.477 2.785 . . . . 0.0 112.746 -178.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -55.15 -6.16 0.14 Allowed 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 129.452 3.101 . . . . 0.0 116.155 -178.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 14.4 t 71.3 -51.05 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 128.853 2.861 . . . . 0.0 111.263 -173.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -77.96 -65.94 0.91 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.335 1.454 . . . . 0.0 111.881 -173.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -78.29 -31.52 48.95 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 117.835 0.289 . . . . 0.0 110.859 168.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 . . . . . 0 CA--C 1.548 0.878 0 C-N-CA 127.106 2.162 . . . . 0.0 110.583 175.991 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.058 0 CA-C-O 118.727 -0.654 . . . . 0.0 110.074 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 19.0 tp -51.31 -47.1 62.71 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.124 0.875 . . . . 0.0 110.691 170.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.48 -3.07 3.87 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 116.416 2.006 . . . . 0.0 116.416 178.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 66.2 mtt-85 -124.29 -42.21 2.13 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.004 1.321 . . . . 0.0 110.757 -179.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.73 -52.89 58.67 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.94 1.696 . . . . 0.0 108.763 168.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.52 -23.19 78.34 Favored Glycine 0 C--O 1.222 -0.649 0 CA-C-O 118.645 -1.086 . . . . 0.0 111.392 -178.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.1 ttm-85 -68.37 -44.51 75.04 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.214 1.507 . . . . 0.0 110.515 168.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.99 -30.13 70.63 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.987 0.812 . . . . 0.0 112.511 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 5.9 mp -93.42 9.56 35.97 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 124.335 1.054 . . . . 0.0 113.095 169.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -111.6 1.63 16.91 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.625 1.57 . . . . 0.0 112.16 165.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -75.19 146.3 81.61 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 126.034 1.734 . . . . 0.0 112.371 -169.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -59.31 -19.3 49.92 Favored 'Trans proline' 0 C--N 1.349 0.571 1 C-N-CA 125.479 4.119 . . . . 0.0 116.073 179.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -143.09 -30.57 0.51 Allowed 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.121 -176.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.11 -30.6 70.46 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.359 1.436 . . . . 0.0 112.744 176.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 88.0 m -53.4 -52.76 58.32 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.581 1.152 . . . . 0.0 111.134 168.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 12.5 ttm180 -61.53 -43.19 99.31 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.274 1.03 . . . . 0.0 112.413 173.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.5 mt -51.36 -57.65 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 C-N-CA 124.734 1.214 . . . . 0.0 110.839 174.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 86.4 mt -55.81 -44.34 77.75 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.501 1.12 . . . . 0.0 111.817 -175.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 8.8 p -76.45 -31.41 20.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 CA-C-N 119.373 0.988 . . . . 0.0 113.1 178.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.13 -31.51 66.07 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.716 -0.615 . . . . 0.0 111.985 174.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 10.7 tp -60.64 -41.27 94.6 Favored 'General case' 0 C--N 1.341 0.221 0 O-C-N 120.924 -1.11 . . . . 0.0 112.828 178.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -43.33 -36.74 1.98 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 129.377 3.071 . . . . 0.0 113.423 173.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -90.33 -34.17 15.81 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.447 1.899 . . . . 0.0 112.697 178.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -93.38 -68.27 1.09 Allowed Glycine 0 C--N 1.338 0.676 0 C-N-CA 123.706 0.669 . . . . 0.0 114.105 -168.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 31.2 m 36.78 33.98 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 C-N-CA 126.47 1.908 . . . . 0.0 115.311 -167.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.04 -63.6 1.35 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.456 -0.778 . . . . 0.0 113.064 -169.022 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 6.0 p90 -161.1 161.31 24.0 Favored Pre-proline 0 C--O 1.24 0.59 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 -169.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -58.65 127.16 23.52 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.288 1.992 . . . . 0.0 107.601 167.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.47 2.93 90.7 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-O 117.321 -1.822 . . . . 0.0 114.782 -175.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . 0.546 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -62.8 -41.07 99.12 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 121.279 2.539 . . . . 0.0 110.394 169.731 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 29.7 mt -54.66 -19.07 5.38 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 125.647 1.579 . . . . 0.0 112.958 176.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.89 -32.47 67.74 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.571 1.078 . . . . 0.0 112.553 172.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.81 -51.29 11.61 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.286 0.634 . . . . 0.0 111.96 170.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . 0.546 ' CD2' HE22 ' B' ' 39' ' ' GLN . 3.7 m-70 -56.03 -24.29 38.37 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.997 1.481 . . . . 0.0 114.997 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 56.4 mt -112.29 -4.16 14.39 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.845 1.658 . . . . 0.0 113.277 -177.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 61.05 7.81 9.62 Favored Glycine 0 CA--C 1.536 1.377 0 CA-C-O 119.013 -0.881 . . . . 0.0 114.818 -172.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 16.2 mt -102.04 162.44 12.91 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.703 1.601 . . . . 0.0 113.067 -169.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.5 t -61.57 138.5 58.3 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 121.237 -0.914 . . . . 0.0 111.24 172.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 66.7 mtt180 -49.93 -31.62 12.84 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.561 1.945 . . . . 0.0 111.936 173.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 60.7 p -72.47 -52.39 15.99 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 118.664 0.665 . . . . 0.0 112.724 173.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -69.5 -25.57 64.12 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 120.662 1.573 . . . . 0.0 113.259 -179.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 37.2 t -61.1 -51.87 68.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 O-C-N 121.514 -0.741 . . . . 0.0 109.436 167.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 78.0 p -75.77 -27.56 58.09 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 115.741 1.756 . . . . 0.0 115.741 -176.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -36.86 -56.15 0.87 Allowed 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 123.984 1.85 . . . . 0.0 109.895 168.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 27.4 m-70 -90.43 -4.33 57.08 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -178.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 86.9 mt -72.19 -16.64 61.96 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.73 -1.231 . . . . 0.0 108.979 164.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 21.3 t -49.92 -42.11 47.5 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.911 1.232 . . . . 0.0 112.64 168.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 7.2 t -84.34 -44.84 13.4 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 119.478 1.035 . . . . 0.0 112.03 178.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.9 tp -56.71 -34.61 67.64 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.382 0.673 . . . . 0.0 111.683 -176.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 38.3 mtm105 -81.68 -31.46 32.23 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.121 0.968 . . . . 0.0 113.551 174.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.5 -50.14 39.67 Favored Glycine 0 N--CA 1.473 1.116 0 CA-C-N 119.253 0.933 . . . . 0.0 111.931 177.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 56.9 m -65.95 -0.63 2.43 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 125.737 1.615 . . . . 0.0 113.115 172.013 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.04 -8.78 10.82 Favored Glycine 0 C--N 1.342 0.863 0 C-N-CA 125.67 1.605 . . . . 0.0 114.88 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 20.7 mt -52.33 -28.12 18.05 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.819 1.647 . . . . 0.0 113.59 -176.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 3.0 m -125.98 141.64 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 126.624 1.97 . . . . 0.0 112.036 167.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 64.7 t -132.58 141.73 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 127.376 2.27 . . . . 0.0 109.557 -174.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.67 164.43 22.83 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.971 1.309 . . . . 0.0 113.175 178.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -165.89 173.1 10.88 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.325 1.05 . . . . 0.0 108.671 178.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -94.9 157.15 16.04 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.21 0.604 . . . . 0.0 110.196 164.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -120.92 -151.03 0.47 Allowed 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.282 1.433 . . . . 0.0 109.321 167.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.6 -24.61 59.91 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-N 120.719 1.599 . . . . 0.0 115.105 -174.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.79 -21.94 0.08 Allowed 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 118.628 1.214 . . . . 0.0 113.93 168.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -97.1 -174.21 2.9 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.307 1.843 . . . . 0.0 109.78 -178.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 34.6 m -105.46 162.02 4.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.514 1.125 . . . . 0.0 109.482 168.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 6.7 ptt180 -137.54 175.45 9.59 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 126.928 2.091 . . . . 0.0 111.039 -171.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -129.14 141.41 51.19 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.435 1.094 . . . . 0.0 109.032 166.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -138.47 159.77 41.22 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 125.855 1.662 . . . . 0.0 110.113 178.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 50.0 mt -58.21 152.62 16.74 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 122.699 0.4 . . . . 0.0 111.362 172.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -46.89 -46.64 21.31 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.834 1.654 . . . . 0.0 114.01 -174.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -162.3 166.12 25.74 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 127.014 2.126 . . . . 0.0 108.58 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 8.0 t -52.12 -20.11 2.33 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.035 1.334 . . . . 0.0 113.322 168.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.54 -48.07 82.08 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.86 1.664 . . . . 0.0 113.428 170.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 18.2 mt -75.96 -35.37 59.69 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 119.578 1.081 . . . . 0.0 110.084 176.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.17 -28.59 66.75 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 118.848 0.749 . . . . 0.0 112.823 173.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 12.0 mmt180 -76.15 -64.31 1.13 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.679 1.591 . . . . 0.0 112.314 174.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.81 -22.46 64.18 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -178.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.35 -45.12 13.1 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.262 -0.899 . . . . 0.0 111.097 168.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.59 -49.21 45.4 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.895 1.712 . . . . 0.0 115.006 -173.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.9 -5.23 55.17 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.644 1.222 . . . . 0.0 112.292 169.345 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . 0.407 ' C ' ' H ' ' B' ' 91' ' ' GLN . 17.9 tp 77.49 127.58 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 128.825 2.85 . . . . 0.0 113.294 168.347 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.2 m -35.71 -19.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 131.234 3.814 . . . . 0.0 115.951 168.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.407 ' H ' ' C ' ' B' ' 89' ' ' LEU . 1.1 tt0 75.37 -7.48 1.77 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 127.272 2.229 . . . . 0.0 114.273 167.325 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 13.5 m -69.45 60.29 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.616 1 C-N-CA 131.715 4.006 . . . . 0.0 112.069 174.055 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.39 0.5 OUTLIER 21.79 38.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.425 -1.697 2 CA-C-N 107.302 -4.499 . . . . 0.0 116.461 -163.375 . . . . . . . . 4 3 . 1 . 017 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 37.8 tp 64.39 73.8 0.42 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.023 1.729 . . . . 0.0 111.511 -169.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.02 98.17 0.07 Allowed 'General case' 0 CA--C 1.55 0.955 0 O-C-N 120.764 -1.21 . . . . 0.0 111.91 169.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -74.56 160.08 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 C-N-CA 126.874 2.07 . . . . 0.0 112.412 174.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -44.06 -6.69 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.235 1 C-N-CA 131.802 4.041 . . . . 0.0 117.63 178.087 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.13 152.16 19.42 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 126.382 1.873 . . . . 0.0 115.21 -172.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -92.05 80.46 5.12 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.073 1.749 . . . . 0.0 109.544 167.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -64.5 162.87 30.65 Favored Pre-proline 0 CA--C 1.557 1.242 0 C-N-CA 124.812 1.245 . . . . 0.0 112.187 174.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -75.74 73.34 4.77 Favored 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 124.112 3.208 . . . . 0.0 113.945 -176.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 2.5 t -35.17 -17.89 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.178 1 C-N-CA 133.037 4.535 . . . . 0.0 119.842 175.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER 63.35 -26.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 130.939 3.696 . . . . 0.0 115.654 -170.577 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -103.18 -44.55 5.16 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 116.007 1.854 . . . . 0.0 116.007 -167.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -104.94 -62.7 1.31 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.322 0.965 . . . . 0.0 111.949 -176.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 . . . . . 0 CA--C 1.55 0.952 0 C-N-CA 126.804 2.041 . . . . 0.0 114.031 177.431 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.652 0 CA-C-O 120.871 0.367 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.1 tt -59.99 -41.86 92.97 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.653 0.781 . . . . 0.0 111.22 -175.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.41 -9.28 32.25 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.2 mmp_? -96.2 -58.53 2.05 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.376 -0.828 . . . . 0.0 108.983 165.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -59.94 -54.49 45.5 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.246 1.418 . . . . 0.0 111.878 -173.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.91 -28.79 73.96 Favored Glycine 0 CA--C 1.528 0.864 0 O-C-N 121.647 -0.658 . . . . 0.0 113.015 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 54.8 ttt-85 -74.9 -26.93 60.0 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.119 0.967 . . . . 0.0 111.78 174.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -87.21 -3.92 59.08 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.293 1.037 . . . . 0.0 113.616 172.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.1 mt -99.42 -24.22 14.86 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.747 1.219 . . . . 0.0 110.857 168.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.38 82.78 3.17 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.205 1.402 . . . . 0.0 114.166 -174.032 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -150.82 154.26 34.49 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 125.743 1.617 . . . . 0.0 111.229 -176.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -57.74 -67.4 0.07 OUTLIER 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 124.103 3.202 . . . . 0.0 112.025 175.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 55.9 m -74.2 -43.71 56.13 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.386 1.074 . . . . 0.0 111.241 -177.012 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -32.83 71.43 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 118.343 -0.837 . . . . 0.0 112.704 -175.486 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.5 t -56.54 -53.45 57.38 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.292 0.951 . . . . 0.0 111.072 168.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -57.76 -46.28 84.74 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.747 -0.596 . . . . 0.0 112.49 175.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.7 mt -45.33 -56.48 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-N 118.677 0.671 . . . . 0.0 110.075 173.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 21.5 mt -65.77 -32.78 74.51 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -169.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.6 m -66.85 -34.63 71.24 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 CA-C-N 120.435 1.471 . . . . 0.0 111.62 170.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.52 -6.15 57.77 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.078 1.351 . . . . 0.0 113.766 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -80.5 -48.11 13.28 Favored 'General case' 0 CA--C 1.519 -0.242 0 C-N-CA 125.262 1.425 . . . . 0.0 109.219 -178.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.0 mt -48.38 -59.36 3.52 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.913 2.485 . . . . 0.0 110.873 172.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -85.95 26.67 0.97 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.636 1.575 . . . . 0.0 111.827 174.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.07 -87.28 0.7 Allowed Glycine 0 C--N 1.337 0.601 0 C-N-CA 125.469 1.509 . . . . 0.0 111.274 -173.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 26.9 m 36.6 22.5 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 N-CA-C 118.826 2.899 . . . . 0.0 118.826 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 98.5 m -83.72 -67.08 0.82 Allowed 'General case' 0 N--CA 1.471 0.579 0 O-C-N 120.137 -1.602 . . . . 0.0 112.887 -177.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 45.4 p90 -156.57 162.15 28.11 Favored Pre-proline 0 CA--C 1.544 0.749 0 O-C-N 121.25 -0.906 . . . . 0.0 113.015 -172.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -56.79 109.98 0.52 Allowed 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.607 2.871 . . . . 0.0 111.304 175.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 90.99 7.75 65.62 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-O 117.464 -1.742 . . . . 0.0 115.532 -175.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.415 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -59.66 -37.22 78.15 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 120.582 2.191 . . . . 0.0 110.564 168.799 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 20.3 mt -50.76 -26.21 5.34 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 126.054 1.741 . . . . 0.0 112.562 173.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.64 -36.95 77.4 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.895 -0.574 . . . . 0.0 112.253 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -42.58 62.33 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.233 0.469 . . . . 0.0 111.527 175.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.415 ' CD2' HE22 ' A' ' 39' ' ' GLN . 7.4 m-70 -60.13 -32.58 71.15 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 176.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 16.8 mt -105.6 -21.28 13.23 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -172.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.79 2.51 64.98 Favored Glycine 0 CA--C 1.536 1.374 0 CA-C-N 119.323 0.965 . . . . 0.0 114.331 -171.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -98.13 142.28 30.02 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.282 1.433 . . . . 0.0 109.759 175.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.8 p -61.4 150.94 33.79 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.136 -0.977 . . . . 0.0 111.853 -173.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -59.43 -19.83 50.39 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 175.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -78.17 -46.25 21.04 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 118.937 0.79 . . . . 0.0 110.981 171.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -65.73 -45.08 83.99 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.363 1.065 . . . . 0.0 112.552 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 80.9 t -61.22 -39.17 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 CA-C-N 118.53 0.604 . . . . 0.0 111.504 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 69.6 m -66.26 -26.46 67.36 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -178.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -51.32 -37.27 46.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.902 1.281 . . . . 0.0 111.727 170.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -90.34 -12.38 37.86 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 176.202 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 95.0 mt -81.23 -27.71 35.14 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 117.922 -1.037 . . . . 0.0 111.675 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.42 -37.47 83.62 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 121.0 1.727 . . . . 0.0 113.467 -177.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 51.5 t -86.48 -15.33 40.47 Favored 'General case' 0 CA--C 1.558 1.265 0 O-C-N 120.827 -1.171 . . . . 0.0 111.718 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.4 tp -68.11 -41.79 81.23 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 119.579 -1.95 . . . . 0.0 108.895 167.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 45.5 mtm180 -78.44 -13.51 59.81 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.066 1.746 . . . . 0.0 112.292 176.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.442 ' C ' ' H ' ' A' ' 62' ' ' GLY . . . -96.07 -57.38 1.15 Allowed Glycine 0 N--CA 1.47 0.901 0 C-N-CA 125.97 1.748 . . . . 0.0 111.659 -178.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.7 m -74.48 23.63 0.09 Allowed 'General case' 0 CA--C 1.566 1.58 0 C-N-CA 125.098 1.359 . . . . 0.0 112.854 173.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.442 ' H ' ' C ' ' A' ' 60' ' ' GLY . . . 59.2 28.73 64.61 Favored Glycine 0 N--CA 1.476 1.313 0 C-N-CA 127.152 2.31 . . . . 0.0 117.482 167.062 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.6 mt -82.21 -30.14 31.02 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.187 0.995 . . . . 0.0 113.324 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.0 m -133.33 144.93 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.951 1.7 . . . . 0.0 111.092 -178.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 72.0 t -129.09 139.95 50.51 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 126.295 1.838 . . . . 0.0 109.179 -175.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.94 142.92 52.83 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.577 1.151 . . . . 0.0 112.267 172.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 16.8 m -155.58 155.38 33.24 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.438 1.095 . . . . 0.0 108.233 176.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.23 125.71 31.25 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 119.379 0.99 . . . . 0.0 109.144 167.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.42 -16.32 63.87 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.525 1.057 . . . . 0.0 113.525 175.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 154.71 -32.89 0.68 Allowed Glycine 0 CA--C 1.531 1.087 0 C-N-CA 126.804 2.145 . . . . 0.0 112.153 -179.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.48 -21.45 0.2 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.346 1.458 . . . . 0.0 113.376 172.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -104.59 169.26 8.56 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.393 2.277 . . . . 0.0 110.028 174.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 10.0 p -92.58 145.52 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.621 0.768 . . . . 0.0 110.948 173.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -131.27 164.4 25.67 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.139 1.775 . . . . 0.0 110.855 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -115.93 120.02 37.83 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.265 1.026 . . . . 0.0 108.547 167.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -121.76 155.37 35.42 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 118.59 0.632 . . . . 0.0 112.191 175.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 tp -52.82 140.71 23.42 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.855 1.262 . . . . 0.0 109.626 173.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.57 -31.55 72.66 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -171.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -164.79 179.56 6.46 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 -178.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 20.1 m -55.89 -33.03 64.24 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.088 1.755 . . . . 0.0 114.208 171.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -68.74 -45.02 72.56 Favored 'General case' 0 C--N 1.344 0.333 0 CA-C-N 119.926 1.239 . . . . 0.0 112.467 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.9 mt -69.94 -40.65 75.37 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 120.13 1.332 . . . . 0.0 109.881 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.9 -35.15 75.92 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.455 0.702 . . . . 0.0 109.877 -178.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -71.95 -50.2 31.02 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 126.377 1.871 . . . . 0.0 112.649 172.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.94 -46.63 77.48 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 121.115 1.779 . . . . 0.0 111.593 -177.266 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.4 -51.27 70.22 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.715 0.806 . . . . 0.0 109.647 171.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -79.99 21.69 4.71 Favored Glycine 0 CA--C 1.537 1.462 0 C-N-CA 126.465 1.983 . . . . 0.0 114.699 -179.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 23.5 tp10 -101.8 -65.49 0.98 Allowed 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 126.427 1.891 . . . . 0.0 108.782 167.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 7.7 tp 165.85 -29.34 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.95 1.7 . . . . 0.0 112.021 -167.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.293 22.9 t 58.39 11.59 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 127.514 2.326 . . . . 0.0 111.837 -166.22 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.462 ' C ' ' H ' ' A' ' 93' ' ' VAL . 1.8 tp-100 88.01 -19.32 0.23 Allowed 'General case' 0 C--O 1.218 -0.575 0 O-C-N 120.315 -1.49 . . . . 0.0 109.452 135.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.9 p -75.01 37.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 127.338 2.255 . . . . 0.0 110.268 163.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.462 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.6 t 71.19 -8.9 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 C-N-CA 127.776 2.43 . . . . 0.0 114.106 174.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 99.02 102.75 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 131.112 3.765 . . . . 0.0 107.865 -169.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.13 137.6 58.23 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.251 1.821 . . . . 0.0 115.179 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 25.4 m -74.97 162.39 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 126.53 1.932 . . . . 0.0 113.906 171.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.03 -41.13 97.53 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 128.738 2.815 . . . . 0.0 115.235 178.669 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 23.6 p -71.26 76.77 0.72 Allowed 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.767 1.167 . . . . 0.0 111.007 170.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . 0.267 1.8 p-10 -71.43 80.3 0.77 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 123.799 1.762 . . . . 0.0 109.473 169.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -61.2 138.42 94.45 Favored Pre-proline 0 CA--C 1.545 0.762 0 CA-C-N 114.205 -1.362 . . . . 0.0 109.894 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.76 160.49 49.52 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 123.97 3.114 . . . . 0.0 116.077 -166.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 8.1 t -44.6 116.4 1.05 Allowed 'General case' 0 C--N 1.347 0.476 0 C-N-CA 125.721 1.608 . . . . 0.0 111.303 -169.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 3.4 p -76.55 -8.95 12.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 -166.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.27 128.62 33.98 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.603 -0.686 . . . . 0.0 110.075 -175.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 24.9 mp0 48.87 24.06 0.78 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 125.763 1.625 . . . . 0.0 114.112 -173.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 . . . . . 0 C--O 1.237 0.439 0 N-CA-C 117.162 2.282 . . . . 0.0 117.162 -164.807 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.707 0 CA-C-O 121.476 0.655 . . . . 0.0 111.813 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 tt -55.66 -41.84 74.21 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.552 1.541 . . . . 0.0 111.235 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.28 -11.36 30.97 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 178.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 13.0 mmp_? -98.2 -56.2 2.55 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.227 1.011 . . . . 0.0 109.663 167.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -60.49 -51.58 68.84 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.369 1.468 . . . . 0.0 111.618 -173.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.97 -34.1 89.0 Favored Glycine 0 CA--C 1.529 0.952 0 C-N-CA 124.094 0.854 . . . . 0.0 112.976 175.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -70.19 -36.58 74.73 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.208 1.004 . . . . 0.0 111.109 175.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.3 -24.65 60.43 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.971 0.908 . . . . 0.0 112.745 175.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 11.7 mt -77.89 -29.87 50.48 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.414 1.086 . . . . 0.0 111.387 168.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -99.93 50.37 0.91 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.465 1.506 . . . . 0.0 114.436 -171.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -114.87 149.72 42.9 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 127.21 2.204 . . . . 0.0 108.593 174.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . 0.402 ' HG2' ' H ' ' B' ' 22' ' ' THR . 60.5 Cg_endo -61.48 -52.84 2.78 Favored 'Trans proline' 0 CA--C 1.534 0.485 0 C-N-CA 124.317 3.345 . . . . 0.0 111.888 -171.091 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.467 ' HB ' ' CD2' ' B' ' 54' ' ' HIS . 15.9 m -76.6 -41.63 45.43 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 117.866 -1.064 . . . . 0.0 110.759 177.124 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 22.3 mtm180 -59.51 -36.9 76.98 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 120.177 1.353 . . . . 0.0 112.963 -176.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 53.8 t -48.79 -55.92 10.17 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.547 0.739 . . . . 0.0 110.37 169.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -57.93 -51.86 67.9 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 118.502 -0.761 . . . . 0.0 113.027 172.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 3.8 mt -44.7 -55.69 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 CA-C-N 119.387 0.994 . . . . 0.0 109.6 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 29.2 mt -64.26 -38.11 89.87 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 116.701 -1.618 . . . . 0.0 114.374 -169.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -65.92 -35.44 75.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 CA-C-N 120.88 1.673 . . . . 0.0 111.296 172.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.58 -13.44 56.54 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.793 1.237 . . . . 0.0 113.821 179.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.45 -47.08 28.84 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.045 0.938 . . . . 0.0 109.748 -175.279 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 mt -48.46 -48.35 37.66 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 128.735 2.814 . . . . 0.0 112.382 172.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -94.79 18.81 11.06 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.052 1.741 . . . . 0.0 111.968 175.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.73 -85.46 1.08 Allowed Glycine 0 C--O 1.222 -0.609 0 C-N-CA 125.343 1.449 . . . . 0.0 111.16 -172.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 11.5 m 32.15 27.57 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 N-CA-C 118.761 2.874 . . . . 0.0 118.761 -174.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 73.1 m -81.82 -75.99 0.27 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 120.941 1.7 . . . . 0.0 111.497 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -155.72 166.52 16.13 Favored Pre-proline 0 CA--C 1.55 0.968 0 O-C-N 120.55 -1.344 . . . . 0.0 113.052 -170.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.18 89.73 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 124.756 3.637 . . . . 0.0 113.017 177.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 123.83 -4.97 9.14 Favored Glycine 0 C--O 1.221 -0.67 0 CA-C-O 117.309 -1.828 . . . . 0.0 115.624 -176.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . 0.499 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -57.75 -34.99 70.12 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 120.425 2.113 . . . . 0.0 112.426 175.563 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 23.2 mt -53.85 -22.68 10.32 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 124.669 1.188 . . . . 0.0 112.445 177.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.33 88.84 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 118.926 -0.559 . . . . 0.0 111.938 -177.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.3 -34.86 65.96 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 122.999 0.52 . . . . 0.0 112.02 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . 0.499 ' CD2' HE22 ' B' ' 39' ' ' GLN . 5.4 m-70 -65.54 -27.61 68.57 Favored 'General case' 0 CA--C 1.553 1.067 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 174.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 15.1 mt -114.7 -20.39 10.68 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.684 1.364 . . . . 0.0 114.684 -170.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.94 -2.1 61.19 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 125.204 1.383 . . . . 0.0 114.417 -171.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -93.96 143.72 26.1 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.693 1.197 . . . . 0.0 110.113 176.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.4 p -61.52 149.99 37.21 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 121.14 -0.975 . . . . 0.0 111.175 -177.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -60.8 -19.25 59.17 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 174.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 6.5 t -77.24 -37.66 52.74 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 118.752 0.705 . . . . 0.0 112.185 170.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -74.68 -47.91 29.03 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.751 0.821 . . . . 0.0 111.424 175.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 63.2 t -58.92 -38.1 71.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-N 119.643 1.11 . . . . 0.0 111.803 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 55.5 m -66.6 -21.52 66.13 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -56.38 -51.19 69.24 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 122.947 1.356 . . . . 0.0 109.835 174.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . 0.467 ' CD2' ' HB ' ' B' ' 22' ' ' THR . 55.4 m-70 -73.84 -8.92 57.89 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 172.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 95.6 mt -83.25 -22.69 33.0 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 117.358 -1.306 . . . . 0.0 112.285 173.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.34 -37.81 81.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 121.201 1.819 . . . . 0.0 112.627 178.243 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 48.5 t -91.06 -13.74 32.61 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 118.129 0.422 . . . . 0.0 111.32 176.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 4.9 tp -70.34 -42.99 71.14 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 119.461 -2.024 . . . . 0.0 109.286 167.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 37.1 mtm105 -83.07 -5.98 59.31 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.966 1.706 . . . . 0.0 112.519 174.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . 0.433 ' C ' ' H ' ' B' ' 62' ' ' GLY . . . -92.22 -65.11 1.12 Allowed Glycine 0 C--N 1.336 0.536 0 N-CA-C 109.409 -1.477 . . . . 0.0 109.409 174.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 60.6 m -72.22 26.43 0.05 Allowed 'General case' 0 CA--C 1.564 1.482 0 C-N-CA 126.517 1.927 . . . . 0.0 113.287 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . 0.433 ' H ' ' C ' ' B' ' 60' ' ' GLY . . . 60.95 20.76 58.07 Favored Glycine 0 N--CA 1.474 1.18 0 C-N-CA 127.515 2.483 . . . . 0.0 117.409 167.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 60.4 mt -77.65 -35.9 52.06 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.885 0.874 . . . . 0.0 113.205 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 1.7 m -126.64 142.07 44.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 126.273 1.829 . . . . 0.0 111.225 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 54.6 t -123.76 138.31 53.94 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 127.068 2.147 . . . . 0.0 108.85 -178.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.06 139.99 38.0 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 123.976 0.91 . . . . 0.0 111.317 176.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 41.1 m -152.48 159.58 43.33 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.584 1.554 . . . . 0.0 107.128 -174.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -87.86 135.69 33.28 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.497 1.499 . . . . 0.0 112.246 169.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -78.13 45.2 0.53 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.269 1.428 . . . . 0.0 109.808 167.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 76.51 -46.5 2.27 Favored Glycine 0 CA--C 1.534 1.262 0 O-C-N 120.204 -1.56 . . . . 0.0 113.011 -169.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -126.37 -46.43 1.62 Allowed 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.725 1.263 . . . . 0.0 114.073 -173.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -97.9 175.49 6.12 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.896 1.225 . . . . 0.0 110.504 173.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 14.9 p -93.34 141.29 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.255 1.022 . . . . 0.0 111.26 174.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 29.4 ptt180 -125.38 163.11 23.31 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 127.477 2.311 . . . . 0.0 110.853 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -113.19 118.82 35.76 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.993 0.917 . . . . 0.0 108.728 168.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -119.09 152.26 36.8 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.077 0.951 . . . . 0.0 111.355 178.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 tp -52.77 141.69 20.69 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.95 0.9 . . . . 0.0 109.989 171.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.54 -32.28 72.1 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -172.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -164.94 176.1 8.95 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 22.5 m -52.23 -31.66 33.22 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.104 1.762 . . . . 0.0 114.501 171.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 7.9 m-70 -72.19 -44.37 63.1 Favored 'General case' 0 C--N 1.345 0.37 0 CA-C-O 117.286 -1.34 . . . . 0.0 112.822 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 9.5 mt -69.13 -40.28 78.38 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 120.665 1.575 . . . . 0.0 109.701 174.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.23 -38.7 84.19 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.612 0.765 . . . . 0.0 109.874 -179.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 4.8 tpm_? -71.36 -50.13 35.3 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.571 1.549 . . . . 0.0 112.776 171.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.61 -44.36 86.76 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 121.589 1.995 . . . . 0.0 111.657 -173.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.67 -53.26 58.48 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.616 1.167 . . . . 0.0 109.45 170.545 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.46 -7.86 83.25 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.175 1.369 . . . . 0.0 115.63 -172.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 28.1 tp10 -69.07 -63.51 1.05 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 126.387 1.875 . . . . 0.0 109.016 169.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . 0.448 ' C ' ' H ' ' B' ' 91' ' ' GLN . 10.7 tp 163.22 -26.59 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.838 2.055 . . . . 0.0 113.232 -170.128 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . 0.305 42.1 t 58.17 11.97 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 126.827 2.051 . . . . 0.0 111.935 -164.065 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.452 ' C ' ' H ' ' B' ' 93' ' ' VAL . 3.0 tp-100 86.34 -23.06 0.15 Allowed 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 125.136 1.374 . . . . 0.0 110.818 135.613 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.6 p -69.01 33.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 C-N-CA 129.068 2.947 . . . . 0.0 112.444 168.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . 0.452 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.3 OUTLIER 67.88 11.56 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 126.966 2.106 . . . . 0.0 113.402 176.0 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 tt 91.97 101.23 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 130.228 3.411 . . . . 0.0 109.709 -176.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.28 127.27 31.28 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -178.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 26.8 m -69.08 159.39 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 125.915 1.686 . . . . 0.0 114.726 171.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.44 -37.56 80.37 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 128.435 2.694 . . . . 0.0 115.413 -178.471 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 61.2 p -78.02 91.64 4.27 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.714 1.143 . . . . 0.0 110.759 172.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -73.35 86.04 1.48 Allowed 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 122.945 1.355 . . . . 0.0 108.868 167.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 72.0 mm-40 -64.23 140.98 98.05 Favored Pre-proline 0 CA--C 1.55 0.95 0 O-C-N 120.887 -1.133 . . . . 0.0 109.091 174.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -69.73 152.95 69.57 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 123.748 2.965 . . . . 0.0 117.345 -165.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 35.5 t -46.27 108.75 0.15 Allowed 'General case' 0 C--N 1.345 0.409 0 C-N-CA 126.557 1.943 . . . . 0.0 111.592 -171.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 5.6 p -73.13 -6.29 7.88 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 -167.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.87 119.04 17.54 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.587 -0.696 . . . . 0.0 110.832 -175.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 46.5 mp0 50.4 25.79 2.04 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.413 1.885 . . . . 0.0 113.763 -175.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 . . . . . 0 CA--C 1.535 0.379 0 N-CA-C 116.318 1.97 . . . . 0.0 116.318 -164.544 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.305 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.17 -32.92 74.86 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.072 0.851 . . . . 0.0 111.482 -171.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.82 -44.15 90.8 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.652 1.115 . . . . 0.0 112.569 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -64.58 -61.21 2.35 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.704 -0.622 . . . . 0.0 111.312 172.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -52.67 63.99 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.757 1.623 . . . . 0.0 110.272 -171.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.63 -32.49 71.01 Favored Glycine 0 CA--C 1.529 0.942 0 CA-C-O 118.672 -1.071 . . . . 0.0 113.411 -170.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -33.87 66.18 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.412 1.606 . . . . 0.0 111.19 175.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.13 -31.25 71.57 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 118.648 0.658 . . . . 0.0 111.754 176.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.7 mp -84.48 -30.31 25.31 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 118.567 -0.73 . . . . 0.0 111.496 174.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.12 60.65 1.05 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.374 1.47 . . . . 0.0 113.961 171.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -153.26 155.14 31.59 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 124.663 1.185 . . . . 0.0 109.042 174.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -59.76 -95.24 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.76 1 C-N-CA 126.156 4.571 . . . . 0.0 113.733 -166.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.548 ' HG1' ' CD2' ' A' ' 54' ' ' HIS . 10.6 p -44.92 -30.09 0.94 Allowed 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 127.386 2.274 . . . . 0.0 113.436 169.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.3 ttm105 -73.74 -43.16 59.89 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.076 0.853 . . . . 0.0 112.407 -175.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 8.2 t -54.21 -51.96 62.77 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.547 0.739 . . . . 0.0 109.346 166.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -52.17 -50.78 61.15 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.35 1.06 . . . . 0.0 113.2 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.7 mm -50.76 -48.12 28.19 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 124.049 0.94 . . . . 0.0 111.736 174.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 77.4 mt -65.22 -48.23 74.06 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 118.726 0.694 . . . . 0.0 112.278 -176.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.1 p -69.42 -27.42 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 123.483 0.713 . . . . 0.0 112.301 179.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.21 -38.46 66.08 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.75 0.82 . . . . 0.0 111.697 169.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 tp -64.61 -28.75 69.84 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 120.308 1.413 . . . . 0.0 114.569 -175.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 mt -42.32 -30.02 0.29 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.88 1.672 . . . . 0.0 112.614 169.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -110.74 -32.43 6.86 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 126.987 2.115 . . . . 0.0 111.446 167.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.22 8.06 34.01 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 128.711 3.053 . . . . 0.0 116.034 -166.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 23.5 m -58.87 26.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.029 0 C-N-CA 127.215 2.206 . . . . 0.0 116.583 168.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 73.6 m -82.44 -81.86 0.15 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.425 1.09 . . . . 0.0 111.464 172.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.23 156.54 78.01 Favored Pre-proline 0 N--CA 1.47 0.568 0 CA-C-O 118.11 -0.948 . . . . 0.0 111.461 -172.112 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -56.92 -36.31 99.01 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.035 2.49 . . . . 0.0 113.448 -174.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -85.3 1.52 88.52 Favored Glycine 0 CA--C 1.533 1.217 0 CA-C-O 118.554 -1.137 . . . . 0.0 115.327 177.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.29 -30.4 66.22 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.807 1.804 . . . . 0.0 113.28 -170.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mt -60.3 -16.9 38.66 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.091 0.557 . . . . 0.0 111.81 -179.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.32 -36.87 76.42 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.812 0.845 . . . . 0.0 111.702 175.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -51.73 16.57 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.01 0.924 . . . . 0.0 111.313 175.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -55.94 -33.35 64.66 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 21.7 mt -105.37 -15.68 14.96 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -174.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.75 11.19 68.86 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-N 119.657 1.117 . . . . 0.0 114.035 -170.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.9 mp -95.11 155.63 16.65 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 117.996 0.898 . . . . 0.0 112.492 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.7 p -64.84 151.81 44.51 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.245 0.618 . . . . 0.0 110.308 170.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -40.84 81.58 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.941 -0.475 . . . . 0.0 111.148 176.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.1 m -63.38 -38.5 91.41 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.353 0.661 . . . . 0.0 112.219 176.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 44.4 t-20 -70.99 -49.26 47.23 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.807 -0.558 . . . . 0.0 111.199 176.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.587 ' HA ' ' HD1' ' A' ' 54' ' ' HIS . 1.3 t -55.98 -35.88 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 120.338 -1.476 . . . . 0.0 112.765 172.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 72.0 m -66.69 -32.78 74.31 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -57.64 -38.63 75.35 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.759 0.708 . . . . 0.0 111.616 171.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.587 ' HD1' ' HA ' ' A' ' 51' ' ' VAL . 23.3 m80 -69.72 -39.5 76.8 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.396 -0.815 . . . . 0.0 112.577 175.486 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.8 mt -75.28 -12.92 60.38 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.771 0.828 . . . . 0.0 113.137 177.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.6 t -60.4 -55.36 34.52 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.404 1.002 . . . . 0.0 110.675 168.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.8 t -67.69 -39.67 84.43 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.326 -0.859 . . . . 0.0 111.739 177.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.4 tp -62.02 -37.69 85.86 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -175.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 45.0 mtm105 -82.46 -7.3 59.64 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.865 0.866 . . . . 0.0 111.9 177.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -102.13 -45.24 1.76 Allowed Glycine 0 CA--C 1.535 1.283 0 C-N-CA 126.036 1.779 . . . . 0.0 114.685 178.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 7.2 m -67.36 4.41 1.0 Allowed 'General case' 0 CA--C 1.563 1.447 0 C-N-CA 126.008 1.723 . . . . 0.0 112.229 168.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.97 21.21 78.24 Favored Glycine 0 C--N 1.343 0.955 0 C-N-CA 126.018 1.771 . . . . 0.0 114.36 170.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.1 mt -85.13 -22.92 28.65 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.121 1.368 . . . . 0.0 113.61 -174.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -137.28 147.4 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 C-N-CA 125.795 1.638 . . . . 0.0 111.286 -178.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 88.5 t -130.37 144.63 37.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.82 1.648 . . . . 0.0 109.849 -179.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.59 134.36 34.81 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.91 0.884 . . . . 0.0 111.769 172.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.9 166.6 24.34 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.483 0.713 . . . . 0.0 109.596 171.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -80.39 127.48 32.45 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 165.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.265 0.0 OUTLIER -78.73 -16.22 57.5 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 120.038 1.29 . . . . 0.0 114.313 171.706 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 130.65 -21.74 4.71 Favored Glycine 0 N--CA 1.477 1.4 0 C-N-CA 125.602 1.572 . . . . 0.0 113.987 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.1 -19.78 1.49 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.558 2.743 . . . . 0.0 112.62 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 -148.28 173.14 13.32 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 129.564 3.146 . . . . 0.0 111.071 -177.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 14.1 p -88.97 145.13 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 167.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 -126.98 165.83 18.68 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.978 1.711 . . . . 0.0 111.224 -179.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 17.2 m-30 -112.49 120.75 42.71 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 164.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -121.44 154.36 36.66 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.932 1.293 . . . . 0.0 109.819 -178.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 81.6 mt -57.58 151.01 17.85 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.994 0.815 . . . . 0.0 110.226 169.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.51 -37.21 75.12 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 -168.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -162.18 167.8 23.52 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 126.288 1.835 . . . . 0.0 109.064 175.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 51.1 m -44.76 -32.16 1.44 Allowed 'General case' 0 C--O 1.214 -0.775 0 CA-C-O 117.604 -1.189 . . . . 0.0 110.998 167.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -37.58 -65.03 0.34 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.702 1.601 . . . . 0.0 114.026 169.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 15.3 mt -73.46 -41.0 63.72 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.749 1.613 . . . . 0.0 110.826 -176.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.67 -26.55 65.64 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 177.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -79.22 -59.79 2.63 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 126.793 2.037 . . . . 0.0 109.469 178.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.88 -37.72 85.6 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.83 -42.9 85.04 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.74 -0.6 . . . . 0.0 109.483 169.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.51 -34.17 73.3 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 126.296 1.903 . . . . 0.0 117.043 -174.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.77 -11.97 59.91 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 121.533 2.666 . . . . 0.0 112.261 167.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 41.2 tp 64.08 113.33 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 127.85 2.46 . . . . 0.0 109.225 -174.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 19.3 m -66.61 26.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 126.281 1.832 . . . . 0.0 114.907 -175.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.424 ' C ' ' H ' ' A' ' 93' ' ' VAL . 39.2 mm-40 79.98 -2.96 2.01 Favored 'General case' 0 N--CA 1.442 -0.856 0 O-C-N 119.911 -1.743 . . . . 0.0 111.271 157.371 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 13.5 p -60.63 31.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 131.153 3.781 . . . . 0.0 113.871 166.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.424 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.3 t 56.87 18.96 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 127.987 2.515 . . . . 0.0 113.99 169.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 tt 99.59 105.74 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 129.891 3.276 . . . . 0.0 107.099 -169.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.29 61.5 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.992 2.117 . . . . 0.0 116.078 -176.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.5 t -64.35 152.51 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 125.165 1.386 . . . . 0.0 108.427 167.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.93 -72.45 0.38 Allowed 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.796 1.638 . . . . 0.0 113.186 178.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.1 p 70.91 144.36 0.06 Allowed 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 129.596 3.158 . . . . 0.0 115.13 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -90.93 131.94 36.25 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 163.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -168.32 138.43 2.06 Favored Pre-proline 0 CA--C 1.541 0.597 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.46 -179.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -69.55 166.27 27.89 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 122.676 2.251 . . . . 0.0 111.626 174.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 5.7 t -104.44 -157.1 0.59 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 126.582 1.953 . . . . 0.0 111.151 -176.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 4.0 t 41.79 53.47 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 C-N-CA 126.136 1.774 . . . . 0.0 114.128 168.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . 76.13 -13.43 0.9 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 126.502 1.921 . . . . 0.0 115.511 177.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 74.8 mt-10 -69.12 162.64 26.55 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 122.829 1.3 . . . . 0.0 112.117 174.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 . . . . . 0 N--CA 1.464 0.272 0 C-N-CA 125.998 1.719 . . . . 0.0 110.214 176.577 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.468 0 N-CA-C 110.753 -0.091 . . . . 0.0 110.753 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.02 -26.92 67.02 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.629 1.172 . . . . 0.0 112.645 -172.375 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.75 -56.18 17.51 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.999 1.272 . . . . 0.0 111.752 171.051 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -59.03 -58.95 6.41 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.802 0.841 . . . . 0.0 111.828 175.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.72 -52.52 56.66 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 125.869 1.668 . . . . 0.0 109.945 -172.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.59 -39.25 96.62 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-O 118.358 -1.246 . . . . 0.0 112.247 -175.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -37.59 79.77 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.123 1.461 . . . . 0.0 110.923 174.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.86 -16.43 60.68 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 178.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 10.3 mp -90.62 -32.73 16.13 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 118.962 0.801 . . . . 0.0 110.031 168.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -74.85 56.0 0.71 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.392 1.877 . . . . 0.0 113.633 169.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -146.63 135.15 10.94 Favored Pre-proline 0 CA--C 1.544 0.714 0 C-N-CA 125.419 1.488 . . . . 0.0 107.167 178.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -46.89 -70.01 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.803 1 C-N-CA 125.628 4.218 . . . . 0.0 113.525 -166.219 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.482 ' HG1' ' CD2' ' B' ' 54' ' ' HIS . 12.1 p -70.18 -16.49 63.08 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 117.849 -1.072 . . . . 0.0 112.59 -178.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . 0.414 HH22 HG13 ' B' ' 26' ' ' ILE . 0.0 OUTLIER -72.16 -46.3 56.96 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 116.551 -1.69 . . . . 0.0 112.252 -176.486 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 38.0 t -45.99 -52.34 11.93 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.454 1.025 . . . . 0.0 110.404 169.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -61.01 -50.37 73.64 Favored 'General case' 0 C--O 1.225 -0.221 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 179.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . 0.414 HG13 HH22 ' B' ' 23' ' ' ARG . 5.2 mm -51.37 -56.99 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.841 1.2 . . . . 0.0 110.526 171.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 59.7 mt -62.17 -42.76 99.57 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 118.699 -0.667 . . . . 0.0 111.906 -169.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 6.3 p -73.23 -32.64 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 123.614 0.765 . . . . 0.0 112.69 177.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.33 -31.6 60.65 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.409 0.55 . . . . 0.0 111.891 176.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 7.8 tp -62.0 -40.83 96.99 Favored 'General case' 0 C--N 1.341 0.235 0 O-C-N 121.093 -1.004 . . . . 0.0 112.536 -178.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.76 -31.0 1.81 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 130.023 3.329 . . . . 0.0 114.383 172.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -100.99 -14.06 18.01 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 127.032 2.133 . . . . 0.0 112.626 -178.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -114.68 -71.91 0.53 Allowed Glycine 0 C--N 1.344 1.006 0 C-N-CA 124.87 1.224 . . . . 0.0 115.642 -169.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 35.0 m 32.6 34.48 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 N-CA-C 117.314 2.339 . . . . 0.0 117.314 -169.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 68.6 m -82.9 -84.08 0.13 Allowed 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 125.975 1.71 . . . . 0.0 112.326 176.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -130.72 163.31 49.53 Favored Pre-proline 0 CA--C 1.543 0.701 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -172.459 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -57.81 -42.2 61.65 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.336 2.024 . . . . 0.0 111.943 178.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -72.11 -1.83 50.69 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 117.955 -1.47 . . . . 0.0 114.645 174.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -64.17 -51.5 63.52 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.533 1.666 . . . . 0.0 111.322 -177.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 5.3 mt -66.48 -28.57 68.68 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 118.77 0.714 . . . . 0.0 109.248 -174.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -75.06 23.96 0.1 Allowed 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 172.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -143.43 -45.39 0.28 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.385 2.674 . . . . 0.0 108.111 168.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -53.13 -29.55 31.71 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 126.323 1.849 . . . . 0.0 113.819 170.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.7 mt -101.61 -18.59 15.82 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 126.045 1.738 . . . . 0.0 113.323 175.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.27 -2.47 52.0 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 124.285 0.945 . . . . 0.0 114.667 -170.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mp -92.84 144.84 24.88 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.052 1.426 . . . . 0.0 110.383 -178.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 21.2 p -58.86 156.35 11.52 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.065 0.946 . . . . 0.0 113.544 -169.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -37.39 79.14 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 121.465 -0.772 . . . . 0.0 111.314 178.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 26.6 m -63.3 -47.08 83.8 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.754 0.822 . . . . 0.0 111.933 170.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -62.78 -50.43 71.05 Favored 'General case' 0 CA--C 1.546 0.795 0 O-C-N 121.038 -1.039 . . . . 0.0 112.375 178.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 3.9 t -67.8 -19.57 25.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 O-C-N 121.007 -1.058 . . . . 0.0 111.739 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 61.2 m -72.2 -46.61 55.52 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.496 1.498 . . . . 0.0 113.674 171.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -49.74 -46.91 50.89 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 123.644 1.687 . . . . 0.0 111.208 173.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . 0.482 ' CD2' ' HG1' ' B' ' 22' ' ' THR . 27.5 m170 -59.46 -55.08 39.21 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 113.134 -1.848 . . . . 0.0 113.783 170.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 52.5 mt -67.59 -14.99 63.41 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 120.003 -1.686 . . . . 0.0 112.78 -178.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.2 t -50.69 -50.96 53.68 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 119.452 1.024 . . . . 0.0 111.065 168.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.95 -21.19 31.88 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.821 1.191 . . . . 0.0 112.875 -171.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 4.7 tp -73.02 -47.17 47.35 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 121.659 -0.651 . . . . 0.0 111.69 176.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 43.3 mtm180 -72.35 -26.4 61.9 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.786 0.834 . . . . 0.0 110.94 174.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.3 -46.32 12.83 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-O 119.292 -0.727 . . . . 0.0 113.745 176.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 54.1 m -75.8 -15.93 60.18 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 119.161 1.481 . . . . 0.0 113.772 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 107.65 9.36 28.91 Favored Glycine 0 C--N 1.344 0.992 0 C-N-CA 125.259 1.409 . . . . 0.0 115.622 169.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 3.1 mt -85.12 -17.26 37.82 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 120.006 1.903 . . . . 0.0 114.55 -169.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.73 143.09 42.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 126.455 1.902 . . . . 0.0 110.455 177.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 98.1 t -131.1 141.2 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.304 1.041 . . . . 0.0 110.024 -176.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.49 136.87 33.24 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.496 1.119 . . . . 0.0 112.144 173.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -142.15 166.22 25.31 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.113 0.965 . . . . 0.0 109.506 172.235 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -77.36 127.38 32.47 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 165.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.254 0.0 OUTLIER -75.15 -21.13 59.01 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 172.757 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 135.21 -19.44 3.86 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.781 1.658 . . . . 0.0 114.02 -177.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 5.1 tmt_? -142.63 -25.48 0.63 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 129.503 3.121 . . . . 0.0 111.608 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -138.66 179.39 6.51 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 127.557 2.343 . . . . 0.0 110.8 -177.252 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 14.8 p -91.1 145.16 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.943 0.897 . . . . 0.0 108.865 166.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 20.2 ptt180 -128.92 164.29 23.44 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 126.295 1.838 . . . . 0.0 110.093 176.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -108.0 149.21 28.68 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 106.005 -1.85 . . . . 0.0 106.005 162.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -146.56 158.3 43.88 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 125.227 1.411 . . . . 0.0 108.571 176.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 62.3 mt -59.28 152.91 19.83 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.385 0.993 . . . . 0.0 109.32 167.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.79 -34.99 76.88 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -168.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -159.62 167.56 28.18 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 123.121 1.439 . . . . 0.0 110.292 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 14.7 m -50.28 -30.62 12.25 Favored 'General case' 0 C--O 1.22 -0.473 0 C-N-CA 125.601 1.56 . . . . 0.0 110.337 167.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -46.73 -65.52 0.55 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.118 1.367 . . . . 0.0 113.789 171.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 11.9 mt -67.68 -41.09 84.25 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 121.075 1.761 . . . . 0.0 111.036 -177.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.02 -24.09 65.9 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 177.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -80.03 -64.52 1.17 Allowed 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 124.982 1.313 . . . . 0.0 110.707 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.54 -34.9 77.84 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.112 1.152 . . . . 0.0 114.112 -178.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tt -65.32 -41.57 93.84 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 121.4 -0.813 . . . . 0.0 109.459 169.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.86 -40.14 95.37 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 126.709 2.099 . . . . 0.0 115.835 -175.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.06 -15.23 62.53 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 120.88 2.34 . . . . 0.0 112.9 169.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 43.2 tp 67.78 111.41 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 127.603 2.361 . . . . 0.0 109.834 -169.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 20.1 m -61.41 28.21 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 128.207 2.603 . . . . 0.0 115.232 174.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 81.87 -15.17 0.73 Allowed 'General case' 0 CA--C 1.535 0.394 0 O-C-N 119.768 -1.832 . . . . 0.0 113.077 156.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.3 p -56.14 31.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.098 1 C-N-CA 132.854 4.461 . . . . 0.0 115.649 168.172 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 2.0 t 56.71 26.27 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 128.15 2.58 . . . . 0.0 113.415 167.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 tt 80.42 106.47 0.07 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 127.51 2.324 . . . . 0.0 105.109 -167.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.79 75.84 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.156 1.783 . . . . 0.0 115.695 -169.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.3 146.05 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 126.273 1.829 . . . . 0.0 112.855 -179.139 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.32 -20.19 60.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 127.46 2.304 . . . . 0.0 113.919 179.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 22.5 p -49.29 124.65 9.48 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.884 1.674 . . . . 0.0 113.743 -169.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -67.44 152.98 44.74 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 165.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -167.9 143.27 3.14 Favored Pre-proline 0 N--CA 1.448 -0.558 0 CA-C-O 116.806 -1.569 . . . . 0.0 107.778 172.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -60.79 158.87 31.11 Favored 'Trans proline' 0 CA--C 1.536 0.599 0 C-N-CA 122.809 2.34 . . . . 0.0 112.521 177.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 15.4 t -85.28 -145.41 0.1 Allowed 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 122.537 1.16 . . . . 0.0 112.87 -176.235 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 25.2 t 12.22 68.92 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 C-N-CA 130.825 3.65 . . . . 0.0 114.199 174.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . 77.02 -9.09 1.58 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.834 2.054 . . . . 0.0 115.613 171.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -73.29 164.14 27.09 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.633 1.173 . . . . 0.0 112.263 174.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.6 mtp180 . . . . . 0 N--CA 1.469 0.477 0 C-N-CA 127.964 2.506 . . . . 0.0 109.764 172.906 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.555 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -52.68 -53.42 47.63 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.801 1.182 . . . . 0.0 113.019 -170.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.58 -14.9 59.9 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 175.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.593 HH22 ' CA ' ' B' ' 102' ' ' CYS . 34.3 ttt180 -93.03 -43.57 8.84 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.376 1.07 . . . . 0.0 111.991 172.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -62.89 -37.63 87.71 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.635 1.574 . . . . 0.0 112.417 -177.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.18 -23.23 52.14 Favored Glycine 0 CA--C 1.536 1.389 0 CA-C-N 120.034 1.288 . . . . 0.0 112.741 170.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.9 ttp85 -100.24 -0.43 38.62 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.903 1.446 . . . . 0.0 114.903 171.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -86.64 -35.66 19.24 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.918 1.235 . . . . 0.0 109.248 167.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.6 mp -70.65 -38.01 73.78 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 167.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -92.54 35.45 1.02 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 171.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.73 149.17 74.0 Favored Pre-proline 0 CA--C 1.542 0.664 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 165.513 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -41.79 -89.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.351 0.659 1 C-N-CA 126.495 4.797 . . . . 0.0 113.793 -167.257 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.52 -31.14 72.04 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 124.997 1.319 . . . . 0.0 111.066 175.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 54.5 mtm-85 -58.69 -33.76 70.52 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 119.547 1.067 . . . . 0.0 113.746 -177.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 49.3 t -58.64 -54.29 48.73 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.295 0.952 . . . . 0.0 110.694 172.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -72.01 -34.26 68.72 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.356 -0.84 . . . . 0.0 112.295 -179.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.5 mm -52.14 -46.39 43.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 124.61 1.164 . . . . 0.0 109.222 167.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 41.7 mt -64.71 -46.06 83.92 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 117.298 -1.334 . . . . 0.0 111.969 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.4 m -64.29 -35.23 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 CA-C-N 121.391 1.905 . . . . 0.0 112.235 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.37 -1.74 46.63 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.978 1.311 . . . . 0.0 113.483 177.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.54 -52.72 7.28 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 124.87 1.268 . . . . 0.0 108.533 169.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -44.47 -60.31 2.02 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.823 2.849 . . . . 0.0 114.015 -171.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -101.16 18.09 20.77 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 126.324 1.849 . . . . 0.0 111.279 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -109.44 -80.01 1.15 Allowed Glycine 0 C--N 1.337 0.635 0 C-N-CA 127.718 2.58 . . . . 0.0 111.164 -179.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.4 m 36.93 28.72 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 116.405 2.002 . . . . 0.0 116.405 -177.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 31.5 m -83.57 -72.12 0.47 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 120.506 1.503 . . . . 0.0 113.588 -173.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -137.36 160.8 64.1 Favored Pre-proline 0 N--CA 1.471 0.621 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -178.234 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -60.94 113.22 1.63 Allowed 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.234 1.956 . . . . 0.0 108.76 171.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.35 -2.33 60.97 Favored Glycine 0 CA--C 1.538 1.508 0 CA-C-O 118.099 -1.389 . . . . 0.0 116.042 -173.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -58.13 -20.1 37.76 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 120.579 2.189 . . . . 0.0 114.597 176.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.401 ' H ' HD12 ' A' ' 40' ' ' LEU . 1.8 mp -71.87 -9.16 57.93 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-O 118.758 -0.639 . . . . 0.0 112.327 176.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.96 -44.09 94.63 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.668 0.667 . . . . 0.0 111.688 177.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.7 -50.91 63.16 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 123.458 0.703 . . . . 0.0 110.684 172.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 -59.1 -27.62 65.74 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -177.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.9 mt -113.39 -22.39 10.41 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -173.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.44 -3.19 33.99 Favored Glycine 0 CA--C 1.535 1.301 0 CA-C-N 119.545 1.066 . . . . 0.0 114.337 -169.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -84.31 139.21 32.46 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.44 1.12 . . . . 0.0 109.803 175.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -55.16 147.82 15.51 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.545 -0.722 . . . . 0.0 111.053 -179.373 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -48.78 -27.75 3.19 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.483 1.113 . . . . 0.0 113.057 169.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.2 m -69.03 -46.35 68.18 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.1 0.96 . . . . 0.0 111.62 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -74.41 -39.35 62.69 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.119 0.872 . . . . 0.0 111.978 177.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.2 t -55.87 -48.43 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 118.621 -0.704 . . . . 0.0 110.57 169.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 39.2 m -64.88 -40.01 94.44 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 120.087 1.312 . . . . 0.0 113.073 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -56.08 -51.79 66.62 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.476 1.11 . . . . 0.0 111.675 176.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 -70.74 -28.51 64.76 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 120.595 -1.316 . . . . 0.0 113.506 177.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.9 mt -70.26 -30.07 67.01 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 117.933 -1.032 . . . . 0.0 112.751 172.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.1 p -49.52 -44.26 46.19 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.346 1.43 . . . . 0.0 113.259 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.5 t -70.51 -42.09 71.74 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.615 1.966 . . . . 0.0 112.873 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.1 tp -63.4 -29.54 70.82 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.927 1.691 . . . . 0.0 112.03 -177.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 56.1 mtm180 -83.67 -12.38 55.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.474 1.509 . . . . 0.0 113.651 172.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -97.17 -48.38 2.06 Favored Glycine 0 N--CA 1.474 1.21 0 C-N-CA 124.446 1.022 . . . . 0.0 111.13 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 69.1 m -68.49 10.62 0.23 Allowed 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 127.836 2.454 . . . . 0.0 114.142 170.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 63.48 14.5 54.62 Favored Glycine 0 N--CA 1.474 1.171 0 C-N-CA 126.581 2.038 . . . . 0.0 116.583 174.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 86.1 mt -75.7 -28.72 58.73 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 120.619 -1.518 . . . . 0.0 113.427 -179.147 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -134.05 135.12 55.14 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 125.757 1.623 . . . . 0.0 112.834 176.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 87.0 t -124.89 138.88 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 125.817 1.647 . . . . 0.0 109.235 -175.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.19 152.22 36.68 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 122.624 1.202 . . . . 0.0 112.9 178.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.2 m -160.4 163.21 33.3 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.769 1.627 . . . . 0.0 108.103 -170.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -85.87 148.32 25.85 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 119.125 0.875 . . . . 0.0 111.248 167.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.93 -14.39 41.98 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 121.35 -0.844 . . . . 0.0 111.745 167.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 138.21 -14.92 3.49 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 126.976 2.227 . . . . 0.0 113.628 -176.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 65.3 ttt-85 -157.49 -43.91 0.07 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.038 2.135 . . . . 0.0 111.861 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -101.33 179.33 4.39 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.408 1.883 . . . . 0.0 110.459 169.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 25.9 m -105.6 160.11 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 123.793 0.837 . . . . 0.0 112.484 171.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.8 ptt85 -142.88 170.28 15.98 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 129.397 3.079 . . . . 0.0 109.788 -172.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -110.9 120.36 42.14 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.358 1.063 . . . . 0.0 108.703 167.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -108.71 146.15 33.95 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.491 1.516 . . . . 0.0 111.159 174.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 tp -56.83 135.28 55.65 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 118.238 -0.886 . . . . 0.0 108.837 170.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.47 -42.34 70.56 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -170.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -154.35 159.28 41.09 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.849 1.66 . . . . 0.0 112.796 176.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.56 -36.98 0.12 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 130.797 3.639 . . . . 0.0 113.468 165.522 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -56.37 -48.3 77.12 Favored 'General case' 0 C--N 1.342 0.252 0 C-N-CA 126.178 1.791 . . . . 0.0 113.336 174.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 11.0 mt -69.59 -41.63 75.52 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 175.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.57 -37.99 76.94 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.974 1.309 . . . . 0.0 111.027 -175.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 -68.04 -55.42 12.65 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-O 117.538 -1.22 . . . . 0.0 112.177 173.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.41 -40.2 95.75 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 121.895 2.134 . . . . 0.0 112.753 -177.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.0 tp -61.54 -43.99 97.86 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.65 1.98 . . . . 0.0 112.664 170.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -78.55 -32.56 41.57 Favored Glycine 0 N--CA 1.478 1.442 0 C-N-CA 126.882 2.182 . . . . 0.0 114.301 -176.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.431 ' C ' ' H ' ' A' ' 90' ' ' VAL . 12.1 mm-40 -66.99 -6.12 15.61 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.538 1.135 . . . . 0.0 110.084 166.225 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 32.1 tp 78.56 -34.65 0.17 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 130.661 3.584 . . . . 0.0 112.794 167.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.431 ' H ' ' C ' ' A' ' 88' ' ' GLU . 0.2 OUTLIER 153.37 -21.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.021 1 C-N-CA 134.012 4.925 . . . . 0.0 111.423 173.19 . . . . . . . . 4 4 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 46.2 mm-40 71.24 -23.99 0.18 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.866 2.066 . . . . 0.0 114.428 -178.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.8 p -71.51 42.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 126.59 1.956 . . . . 0.0 115.135 -172.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER 63.28 17.73 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 C-N-CA 126.996 2.119 . . . . 0.0 112.504 177.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 62.4 mt 84.6 107.51 0.05 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 129.976 3.31 . . . . 0.0 109.693 -171.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.75 76.1 0.85 Allowed 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.089 -1.007 . . . . 0.0 110.002 169.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.0 t -44.74 149.09 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 127.487 2.315 . . . . 0.0 114.652 -169.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.62 25.75 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 128.532 2.733 . . . . 0.0 114.937 171.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 44.0 p -104.53 170.61 7.79 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.655 -1.278 . . . . 0.0 112.723 175.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -99.94 2.95 44.1 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 128.83 2.852 . . . . 0.0 113.842 -176.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -53.43 141.7 42.36 Favored Pre-proline 0 CA--C 1.556 1.192 0 N-CA-C 116.151 1.908 . . . . 0.0 116.151 -167.113 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -72.97 -168.97 0.45 Allowed 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 125.236 3.957 . . . . 0.0 111.489 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . 0.413 ' HA ' HH12 ' B' ' 13' ' ' ARG . 49.6 t -56.21 148.83 17.39 Favored 'General case' 0 CA--C 1.548 0.874 0 O-C-N 120.429 -1.42 . . . . 0.0 111.881 175.331 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 93.5 t -73.5 -18.48 17.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.877 -169.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -81.41 24.04 0.58 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.682 1.593 . . . . 0.0 114.222 173.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -128.68 161.96 28.46 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.245 1.818 . . . . 0.0 110.719 -171.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.785 0 C-N-CA 126.004 1.722 . . . . 0.0 112.858 177.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.887 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -35.84 -73.0 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 127.61 2.364 . . . . 0.0 114.139 -176.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.68 -5.7 39.4 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.933 1.457 . . . . 0.0 114.933 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . 0.413 HH12 ' HA ' ' A' ' 102' ' ' CYS . 67.3 ttt180 -86.08 -46.64 10.28 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 118.658 -0.687 . . . . 0.0 110.464 168.024 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.96 -41.37 99.51 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.368 0.985 . . . . 0.0 112.104 -168.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.8 -6.3 11.63 Favored Glycine 0 CA--C 1.542 1.774 0 CA-C-O 119.004 -0.887 . . . . 0.0 114.432 173.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 49.6 ttp85 -115.4 -3.68 12.41 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 127.187 2.195 . . . . 0.0 113.851 172.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -92.65 -27.96 16.97 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.478 1.511 . . . . 0.0 110.906 167.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 3.8 mp -79.18 -44.58 21.61 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 168.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -87.69 32.57 0.72 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 125.299 1.44 . . . . 0.0 114.619 171.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -64.17 151.94 89.25 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 126.924 2.09 . . . . 0.0 111.977 172.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -44.67 -36.27 10.17 Favored 'Trans proline' 0 C--N 1.357 0.987 1 C-N-CA 125.579 4.186 . . . . 0.0 114.718 177.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.411 ' HB ' HH21 ' B' ' 23' ' ' ARG . 5.6 m -130.18 -34.89 1.62 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.824 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . 0.411 HH21 ' HB ' ' B' ' 22' ' ' THR . 0.0 OUTLIER -60.28 -26.94 66.89 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 117.211 -1.376 . . . . 0.0 112.091 -179.742 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 42.3 t -55.13 -65.43 0.59 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 120.14 1.336 . . . . 0.0 112.193 168.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 17.4 ttm180 -68.65 -33.2 73.6 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.152 -0.968 . . . . 0.0 111.713 -177.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.1 mm -48.92 -55.03 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 O-C-N 121.049 -1.032 . . . . 0.0 109.053 168.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 56.6 mt -62.82 -36.44 83.17 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 116.798 -1.572 . . . . 0.0 112.613 -174.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 3.6 m -64.27 -38.48 82.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 CA-C-N 120.849 1.659 . . . . 0.0 111.045 175.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.35 -7.1 59.14 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.307 1.043 . . . . 0.0 113.547 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.15 -55.3 6.25 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 170.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -44.05 -61.29 1.51 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 128.433 2.693 . . . . 0.0 112.558 177.586 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -86.97 5.19 38.47 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.051 1.34 . . . . 0.0 112.086 -176.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.53 -73.16 0.53 Allowed Glycine 0 C--N 1.341 0.833 0 C-N-CA 126.465 1.983 . . . . 0.0 113.657 -173.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 25.4 m 37.65 29.52 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 116.183 1.92 . . . . 0.0 116.183 -174.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 25.7 m -82.91 -73.37 0.41 Allowed 'General case' 0 C--N 1.342 0.251 0 CA-C-N 120.358 1.435 . . . . 0.0 114.218 -173.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -148.36 164.68 20.79 Favored Pre-proline 0 N--CA 1.47 0.526 0 N-CA-C 114.012 1.115 . . . . 0.0 114.012 -175.486 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -55.1 119.65 6.87 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.136 1.891 . . . . 0.0 108.768 169.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.43 -4.05 83.97 Favored Glycine 0 CA--C 1.535 1.339 0 CA-C-O 117.249 -1.861 . . . . 0.0 115.897 -174.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -57.22 -27.17 61.78 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 121.203 2.501 . . . . 0.0 112.948 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 3.4 mt -67.96 -22.7 65.02 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 124.509 1.124 . . . . 0.0 111.593 178.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.16 -43.49 98.79 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 118.549 0.613 . . . . 0.0 111.156 -173.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.94 -50.86 64.76 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.664 0.786 . . . . 0.0 111.571 173.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -54.75 -35.77 64.09 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 178.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 17.3 mt -103.21 -21.64 13.84 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -172.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.41 -1.69 33.96 Favored Glycine 0 CA--C 1.537 1.467 0 CA-C-N 119.177 0.899 . . . . 0.0 113.418 -168.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -90.08 121.85 32.52 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 125.386 1.474 . . . . 0.0 108.531 176.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.8 t -47.7 139.08 7.63 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.29 1.036 . . . . 0.0 112.548 -175.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.12 -28.35 4.19 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.816 1.647 . . . . 0.0 113.577 174.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 50.3 m -62.32 -58.28 8.26 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.002 0.921 . . . . 0.0 111.358 170.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -76.12 -34.91 59.47 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.427 1.012 . . . . 0.0 113.483 -178.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 1.5 t -50.2 -47.83 24.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.906 1.23 . . . . 0.0 109.648 169.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 5.2 m -83.22 -27.9 29.64 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -177.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -45.88 -34.8 4.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.27 1.428 . . . . 0.0 112.429 173.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -113.26 2.12 15.44 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 127.373 2.269 . . . . 0.0 114.311 -178.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 46.7 mt -72.58 -24.64 61.12 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 119.615 -1.928 . . . . 0.0 109.116 166.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 18.3 p -43.11 -42.74 4.15 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.092 1.357 . . . . 0.0 111.75 167.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 12.5 t -75.36 -43.03 52.6 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tp -62.85 -34.57 77.62 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.488 1.515 . . . . 0.0 110.967 -176.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 60.5 mtm180 -82.46 -7.56 59.64 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.164 1.385 . . . . 0.0 113.867 173.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -97.89 -49.37 1.78 Allowed Glycine 0 N--CA 1.474 1.174 0 CA-C-N 119.391 0.996 . . . . 0.0 111.778 175.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 99.5 m -72.02 13.46 0.3 Allowed 'General case' 0 CA--C 1.565 1.551 0 C-N-CA 126.741 2.016 . . . . 0.0 113.223 175.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.89 0.04 12.53 Favored Glycine 0 N--CA 1.471 1.025 0 C-N-CA 127.597 2.522 . . . . 0.0 116.59 176.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 41.6 mt -65.62 -30.29 70.98 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.654 1.727 . . . . 0.0 113.702 -171.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -123.7 141.08 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 126.433 1.893 . . . . 0.0 111.771 170.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 74.3 t -123.7 138.15 54.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 125.538 1.535 . . . . 0.0 109.118 174.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.62 148.5 30.24 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.458 1.103 . . . . 0.0 113.013 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 8.7 m -160.48 162.87 33.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.144 1.378 . . . . 0.0 108.194 -168.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -81.75 147.28 29.52 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.842 1.201 . . . . 0.0 111.55 167.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.21 -14.62 43.38 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.169 0.895 . . . . 0.0 111.781 167.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 139.51 -18.01 3.06 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 126.851 2.167 . . . . 0.0 113.02 -177.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 58.5 ttt-85 -153.37 -46.09 0.09 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 127.326 2.251 . . . . 0.0 111.446 -176.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -97.61 -177.88 3.94 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.599 1.96 . . . . 0.0 109.975 170.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 33.8 m -109.09 158.74 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 123.869 0.868 . . . . 0.0 112.822 171.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 10.0 ptt85 -140.08 173.57 11.39 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 128.71 2.804 . . . . 0.0 110.12 -171.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -117.9 120.14 36.96 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.304 1.042 . . . . 0.0 108.476 167.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -103.96 151.43 23.19 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.901 1.28 . . . . 0.0 110.196 172.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 tp -60.43 143.81 52.48 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 168.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -42.66 -60.42 1.56 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.107 0.963 . . . . 0.0 112.612 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . 0.521 ' CG ' ' H ' ' B' ' 80' ' ' SER . 11.8 t70 -166.8 -174.83 2.87 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.42 1.488 . . . . 0.0 113.658 171.539 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 80' ' ' SER . . . . . 0.521 ' H ' ' CG ' ' B' ' 79' ' ' ASP . 4.2 m -35.65 -39.26 0.14 Allowed 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 130.196 3.398 . . . . 0.0 113.757 172.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -55.45 -52.41 63.71 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.344 1.057 . . . . 0.0 113.035 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 19.2 mt -75.1 -34.39 61.73 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.036 1.289 . . . . 0.0 110.08 175.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.31 -38.19 88.47 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.32 0.648 . . . . 0.0 110.729 -174.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -67.95 -55.04 14.21 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-O 117.425 -1.274 . . . . 0.0 111.816 169.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.99 -32.45 72.92 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 122.407 2.367 . . . . 0.0 113.977 -174.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.41 -43.37 50.28 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.245 1.418 . . . . 0.0 112.285 171.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -79.72 -26.35 56.56 Favored Glycine 0 CA--C 1.54 1.645 0 C-N-CA 124.809 1.195 . . . . 0.0 114.918 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.422 ' C ' ' H ' ' B' ' 90' ' ' VAL . 63.2 mm-40 -69.57 -10.6 58.83 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.704 1.202 . . . . 0.0 109.397 165.278 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 60.2 tp 80.87 -42.6 0.19 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 130.798 3.639 . . . . 0.0 110.574 171.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . 0.422 ' H ' ' C ' ' B' ' 88' ' ' GLU . 0.0 OUTLIER 160.54 -27.25 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.548 1 C-N-CA 133.057 4.543 . . . . 0.0 110.573 170.438 . . . . . . . . 4 4 . 1 . 020 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 79.93 -12.2 1.08 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.323 2.249 . . . . 0.0 113.129 -178.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 27.2 m -80.34 70.02 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 CA-C-O 125.641 2.639 . . . . 0.0 114.749 -168.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.344 0.7 OUTLIER 34.38 27.47 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.432 -1.347 2 C-N-CA 133.825 4.85 . . . . 0.0 114.595 -167.312 . . . . . . . . 4 3 . 1 . 020 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 34.3 mt 74.61 71.32 0.1 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.497 2.319 . . . . 0.0 110.985 -168.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.4 99.3 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.063 -1.023 . . . . 0.0 111.731 169.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 2.8 t -65.68 159.67 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 126.037 1.735 . . . . 0.0 110.978 177.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.59 9.13 0.69 Allowed 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 128.247 2.619 . . . . 0.0 115.488 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 61.7 p -78.25 154.32 31.09 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 116.426 2.01 . . . . 0.0 116.426 -167.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -65.17 1.93 0.91 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 130.124 3.37 . . . . 0.0 116.356 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -68.68 141.79 93.19 Favored Pre-proline 0 CA--C 1.555 1.136 0 N-CA-C 115.091 1.515 . . . . 0.0 115.091 -167.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . 0.493 ' C ' HH12 ' A' ' 13' ' ' ARG . 66.2 Cg_endo -75.29 -171.23 0.95 Allowed 'Trans proline' 0 C--N 1.361 1.196 1 C-N-CA 125.634 4.223 . . . . 0.0 111.704 175.761 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . 0.593 ' CA ' HH22 ' A' ' 13' ' ' ARG . 0.1 OUTLIER -59.04 149.08 28.6 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 120.696 -1.252 . . . . 0.0 112.369 -176.613 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 61.0 t -63.04 -23.66 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -168.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -90.19 44.28 1.19 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.022 1.329 . . . . 0.0 113.31 177.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -143.29 158.43 43.63 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.765 2.026 . . . . 0.0 110.65 -172.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.89 0 C-N-CA 127.076 2.15 . . . . 0.0 112.969 -179.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.555 1.172 0 N-CA-C 119.851 3.278 . . . . 0.0 119.851 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp 2.43 -92.14 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 128.459 2.703 . . . . 0.0 116.876 -179.472 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.93 -36.88 64.71 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.302 0.955 . . . . 0.0 111.475 -169.352 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.7 ttm105 -58.55 -48.05 82.18 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 117.648 -1.168 . . . . 0.0 110.622 169.748 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.66 -51.5 69.68 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.11 1.364 . . . . 0.0 111.095 -179.051 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.22 -38.86 91.35 Favored Glycine 0 CA--C 1.533 1.213 0 CA-C-N 119.044 0.838 . . . . 0.0 112.372 177.262 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -87.11 10.14 17.64 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.249 1.42 . . . . 0.0 114.174 175.972 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -117.93 -2.48 11.3 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.761 2.424 . . . . 0.0 111.469 169.364 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.0 mp -105.13 -36.26 7.33 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.232 0.923 . . . . 0.0 109.734 165.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.44 86.14 2.57 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 168.12 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -130.69 156.3 80.03 Favored Pre-proline 0 CA--C 1.54 0.576 0 C-N-CA 127.489 2.315 . . . . 0.0 110.71 -173.335 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -77.64 -122.81 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.361 3.374 . . . . 0.0 109.575 -174.603 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 54.1 m -57.65 -17.38 14.37 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 119.924 -1.735 . . . . 0.0 113.003 170.707 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.46 -18.27 60.66 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 120.8 -1.188 . . . . 0.0 112.606 171.475 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.5 t -85.38 -29.43 24.43 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 120.351 -1.468 . . . . 0.0 110.911 166.077 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.2 -43.28 74.27 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.678 -0.639 . . . . 0.0 109.798 167.859 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.3 mm -52.14 -51.3 31.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 CA-C-N 118.94 0.791 . . . . 0.0 112.177 169.211 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 52.9 mt -62.88 -38.39 90.67 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.126 0.788 . . . . 0.0 113.126 -177.167 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.9 p -79.18 -28.83 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 CA-C-N 119.395 0.998 . . . . 0.0 113.195 175.701 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.41 3.15 13.96 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.654 1.182 . . . . 0.0 112.953 169.351 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.45 HD22 ' CE2' ' A' ' 75' ' ' TYR . 0.3 OUTLIER -83.62 -52.38 6.5 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.02 1.328 . . . . 0.0 108.603 168.163 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.46 -52.73 27.17 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 128.728 2.811 . . . . 0.0 111.94 178.144 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -90.85 36.97 0.91 Allowed 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.861 2.064 . . . . 0.0 111.358 174.163 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -147.28 -93.26 0.12 Allowed Glycine 0 C--N 1.338 0.667 0 C-N-CA 125.588 1.566 . . . . 0.0 113.331 -172.77 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 28.4 m 38.84 29.44 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 C-N-CA 127.356 2.262 . . . . 0.0 116.053 -170.805 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 69.4 m -68.44 -89.43 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 127.872 2.469 . . . . 0.0 113.489 176.166 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 17.7 m-85 -142.93 144.63 30.02 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 126.622 1.969 . . . . 0.0 110.72 -172.935 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -63.24 135.31 49.8 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 123.081 2.521 . . . . 0.0 111.162 -174.107 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.64 -3.13 56.44 Favored Glycine 0 CA--C 1.534 1.224 0 CA-C-O 118.628 -1.095 . . . . 0.0 114.589 -175.211 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.7 pp0? -70.17 -17.85 63.18 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.773 1.787 . . . . 0.0 112.841 176.198 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.8 mt -50.68 -22.02 1.87 Allowed 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.5 0.591 . . . . 0.0 111.525 171.227 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.39 -32.32 73.89 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.685 0.994 . . . . 0.0 113.685 178.468 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.8 -44.43 27.48 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.105 0.562 . . . . 0.0 110.448 169.118 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -63.65 -30.78 71.84 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.743 1.217 . . . . 0.0 114.081 -176.139 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 27.6 mt -101.41 -14.09 17.7 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.008 1.723 . . . . 0.0 113.71 176.223 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.57 0.39 31.32 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.43 1.014 . . . . 0.0 114.241 -170.612 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 88.8 mt -89.62 136.68 32.89 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.062 1.345 . . . . 0.0 109.732 -179.488 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.1 p -59.07 159.14 7.64 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -168.405 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 71.6 mtp85 -54.37 -30.4 51.65 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.836 176.634 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.4 m -69.09 -57.62 5.17 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.467 1.031 . . . . 0.0 111.225 169.56 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -54.9 -41.37 70.84 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.388 -0.82 . . . . 0.0 112.995 -178.797 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.4 t -71.95 -32.65 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 O-C-N 121.486 -0.759 . . . . 0.0 111.962 176.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 68.8 m -69.55 -33.75 73.22 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.364 0.984 . . . . 0.0 112.19 178.477 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -54.9 -48.81 72.56 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.729 0.695 . . . . 0.0 111.788 169.649 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 32.0 m80 -62.6 -40.28 96.43 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 177.538 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 84.1 mt -75.9 -17.86 59.62 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.54 1.536 . . . . 0.0 114.218 179.769 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 t -66.31 -41.84 89.16 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.858 1.208 . . . . 0.0 111.895 179.479 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 46.4 t -67.57 -48.28 67.36 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-O 122.8 1.286 . . . . 0.0 110.884 168.839 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.407 ' HB3' ' CG2' ' A' ' 64' ' ' VAL . 1.1 tp -62.45 -37.75 87.12 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.591 1.557 . . . . 0.0 114.362 -169.241 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.2 mtt85 -89.76 8.65 30.72 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 114.679 1.362 . . . . 0.0 114.679 173.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.414 ' C ' ' H ' ' A' ' 62' ' ' GLY . . . -108.38 -55.77 0.58 Allowed Glycine 0 N--CA 1.474 1.224 0 C-N-CA 124.959 1.266 . . . . 0.0 111.138 171.879 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 56.0 m -74.76 15.31 0.39 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 128.262 2.625 . . . . 0.0 112.863 179.409 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 60' ' ' GLY . . . 73.97 -5.68 24.09 Favored Glycine 0 C--N 1.34 0.799 0 C-N-CA 128.415 2.912 . . . . 0.0 116.296 169.497 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.4 mt -60.93 -30.42 70.19 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.57 1.685 . . . . 0.0 114.106 -173.059 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.407 ' CG2' ' HB3' ' A' ' 58' ' ' LEU . 1.5 m -138.87 151.21 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 125.854 1.662 . . . . 0.0 111.115 169.395 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.2 t -149.86 144.7 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 123.234 0.614 . . . . 0.0 112.559 176.059 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -78.89 140.43 38.11 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.108 1.363 . . . . 0.0 113.092 178.527 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.5 m -143.07 134.07 25.6 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 126.062 1.745 . . . . 0.0 106.956 -168.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -61.78 127.04 29.54 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 121.18 1.809 . . . . 0.0 111.191 172.851 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.409 ' CD ' ' H ' ' A' ' 70' ' ' GLY 0.313 2.8 pp20? -85.34 -134.15 0.06 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 118.147 -0.93 . . . . 0.0 110.314 174.344 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.409 ' H ' ' CD ' ' A' ' 69' ' ' GLU . . . -72.77 -37.77 57.12 Favored Glycine 0 CA--C 1.531 1.068 0 CA-C-N 120.892 1.678 . . . . 0.0 113.408 176.27 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.0 ttp85 -154.9 -9.38 0.13 Allowed 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -179.524 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -111.8 -173.08 2.17 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.618 2.367 . . . . 0.0 107.707 171.37 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 4.3 m -104.8 146.42 12.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 124.017 0.927 . . . . 0.0 108.916 166.768 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -111.27 -162.66 0.81 Allowed 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 127.279 2.231 . . . . 0.0 109.713 172.752 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.45 ' CE2' HD22 ' A' ' 30' ' ' LEU . 1.1 p90 -159.24 96.87 1.33 Allowed 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 127.107 2.163 . . . . 0.0 106.557 -172.092 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -94.23 156.16 16.68 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.701 1.6 . . . . 0.0 111.233 -177.466 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.1 mt -62.7 160.13 14.84 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 165.471 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -42.44 -47.04 4.94 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.545 1.138 . . . . 0.0 114.056 -177.932 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -169.02 172.37 7.59 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 126.309 1.843 . . . . 0.0 108.63 176.728 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -34.33 -36.67 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 128.762 2.825 . . . . 0.0 111.226 162.836 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -38.96 -67.83 0.19 Allowed 'General case' 0 C--N 1.344 0.35 0 C-N-CA 128.552 2.741 . . . . 0.0 113.542 168.662 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 17.4 mt -79.07 -36.01 41.56 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 118.673 -0.679 . . . . 0.0 109.757 -173.16 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.77 -34.19 62.29 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.924 0.784 . . . . 0.0 112.597 170.096 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 -83.14 -59.73 2.38 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.738 178.738 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.35 -32.36 73.76 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -176.232 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.77 -35.98 59.96 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 121.417 -0.802 . . . . 0.0 110.656 169.846 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.58 -42.87 62.29 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 125.403 1.478 . . . . 0.0 114.44 -173.76 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -77.83 -23.61 48.95 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.734 1.267 . . . . 0.0 111.96 169.352 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 22.1 tp 80.74 146.38 0.09 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 129.583 3.153 . . . . 0.0 113.859 166.19 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.9 m -48.9 -7.39 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 129.142 2.977 . . . . 0.0 117.14 -178.387 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 74.89 -44.01 0.53 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 128.147 2.579 . . . . 0.0 113.008 172.893 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.8 p -50.94 44.68 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.34 1 C-N-CA 133.793 4.837 . . . . 0.0 118.435 -169.804 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 59.25 10.35 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 128.896 2.878 . . . . 0.0 112.756 -172.622 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.2 tt 75.28 113.9 0.06 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.821 2.448 . . . . 0.0 106.056 -165.503 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.51 77.94 0.11 Allowed 'General case' 0 CA--C 1.551 1.013 0 O-C-N 121.137 -0.977 . . . . 0.0 112.477 -177.274 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.0 m -57.98 140.81 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 125.743 1.617 . . . . 0.0 114.468 -174.948 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.79 104.0 0.07 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.94 2.496 . . . . 0.0 110.216 171.544 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 11.9 p -153.18 -72.3 0.14 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.458 1.103 . . . . 0.0 111.041 -169.157 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . 0.251 30.9 m-20 64.21 43.49 4.88 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 127.377 2.271 . . . . 0.0 112.996 171.591 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -66.39 158.12 79.29 Favored Pre-proline 0 CA--C 1.544 0.735 0 CA-C-N 113.769 -1.56 . . . . 0.0 110.413 168.028 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -59.8 161.8 17.47 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.463 2.776 . . . . 0.0 111.357 169.412 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -60.33 145.87 46.18 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.29 0.566 . . . . 0.0 111.004 -178.408 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 22.0 t -52.63 -29.26 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 124.809 1.244 . . . . 0.0 113.228 -173.108 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -94.15 -17.45 22.75 Favored 'General case' 0 CA--C 1.553 1.071 0 N-CA-C 115.556 1.687 . . . . 0.0 115.556 -179.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -105.91 -142.7 0.37 Allowed 'General case' 0 N--CA 1.478 0.954 0 CA-C-O 116.251 -1.833 . . . . 0.0 110.643 -179.503 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.3 ptp180 . . . . . 0 N--CA 1.493 1.679 0 C-N-CA 127.753 2.421 . . . . 0.0 115.364 -173.093 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 0.992 0 N-CA-C 118.21 2.67 . . . . 0.0 118.21 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 27.2 tp -2.19 -96.94 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 128.319 2.647 . . . . 0.0 116.708 -174.356 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.09 -33.67 63.71 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 119.217 0.917 . . . . 0.0 111.041 -169.339 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 7.0 ttm105 -55.23 -46.81 76.0 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 118.521 -0.752 . . . . 0.0 110.719 169.267 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.34 -50.0 74.34 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.906 1.282 . . . . 0.0 111.063 -179.666 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -59.07 -31.3 68.52 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-N 119.323 0.965 . . . . 0.0 112.831 177.624 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.6 3.08 55.09 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 174.436 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.09 -17.49 14.31 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 127.587 2.355 . . . . 0.0 111.706 172.701 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 4.3 mp -93.8 -44.91 7.89 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.416 0.687 . . . . 0.0 110.853 168.151 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.71 70.55 7.49 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.734 0.778 . . . . 0.0 110.807 172.675 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -127.12 132.97 24.57 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 128.066 2.546 . . . . 0.0 106.105 176.404 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -52.89 -94.01 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.862 1 C-N-CA 126.603 4.868 . . . . 0.0 115.806 -165.936 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 5.3 m -58.19 -25.37 61.49 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.623 1.569 . . . . 0.0 111.214 178.517 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 13.4 ttp180 -73.91 -34.69 64.47 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 179.635 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 52.8 t -63.03 -36.97 85.35 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.573 1.533 . . . . 0.0 109.572 167.605 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.1 mtm180 -61.78 -41.41 97.68 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.949 0.9 . . . . 0.0 112.354 169.823 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mm -61.41 -47.47 93.3 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 CA-C-N 120.235 1.38 . . . . 0.0 111.48 170.284 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 52.8 mt -62.47 -40.9 98.13 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.814 0.845 . . . . 0.0 112.101 -179.301 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 3.7 p -77.59 -28.2 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 177.462 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.17 -12.23 59.67 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 121.138 -0.976 . . . . 0.0 113.183 170.208 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.08 -54.07 16.97 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.292 1.037 . . . . 0.0 108.806 169.263 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 2.6 mt -41.3 -66.7 0.31 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 128.164 2.586 . . . . 0.0 111.201 173.273 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -79.75 32.05 0.25 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.667 1.987 . . . . 0.0 112.403 177.836 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -143.74 -80.91 0.05 OUTLIER Glycine 0 C--N 1.338 0.693 0 C-N-CA 125.002 1.287 . . . . 0.0 113.832 -173.867 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 23.6 m 37.43 22.83 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 N-CA-C 118.447 2.758 . . . . 0.0 118.447 -175.289 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 91.3 m -76.11 -69.66 0.49 Allowed 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.979 1.718 . . . . 0.0 113.274 179.87 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -144.14 159.12 53.75 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 123.684 0.794 . . . . 0.0 112.785 -168.629 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -60.79 138.18 77.67 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 123.748 2.965 . . . . 0.0 111.757 173.892 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 66.39 0.0 7.27 Favored Glycine 0 CA--C 1.533 1.204 0 CA-C-O 119.099 -0.834 . . . . 0.0 114.578 177.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -67.51 -29.16 68.5 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 119.077 1.439 . . . . 0.0 111.217 -178.154 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.7 mp -56.07 -15.16 3.24 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 124.23 1.012 . . . . 0.0 112.892 177.591 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.0 -46.04 78.85 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.635 0.774 . . . . 0.0 111.739 170.75 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.25 -42.24 75.88 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.096 0.862 . . . . 0.0 111.417 174.494 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -63.57 -31.05 72.1 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.103 1.361 . . . . 0.0 113.751 -177.48 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 29.9 mt -99.18 -10.38 22.54 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.55 1.54 . . . . 0.0 113.485 175.391 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.63 8.11 55.72 Favored Glycine 0 CA--C 1.537 1.428 0 CA-C-N 118.984 0.811 . . . . 0.0 113.737 -169.303 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 91.3 mt -88.83 162.82 15.96 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 118.615 1.208 . . . . 0.0 111.742 -177.232 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.5 p -70.67 154.81 41.5 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.634 -1.291 . . . . 0.0 110.287 175.26 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 68.0 mtp85 -54.03 -40.47 67.09 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.096 172.019 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 5.6 m -59.2 -49.39 78.04 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.172 0.989 . . . . 0.0 112.877 173.163 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -61.6 -46.62 89.05 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.595 -0.691 . . . . 0.0 110.934 178.657 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 19.3 t -67.18 -37.1 78.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.047 -179.204 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 56.6 m -58.86 -42.91 90.52 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 119.825 1.193 . . . . 0.0 112.855 170.984 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 34.9 m-20 -56.52 -46.57 80.5 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.05 0.841 . . . . 0.0 111.269 176.374 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -66.26 -40.65 90.3 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 121.719 -0.613 . . . . 0.0 112.32 176.759 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 88.2 mt -68.5 -18.49 64.4 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.908 0.883 . . . . 0.0 113.054 175.24 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.03 -53.74 54.28 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.229 1.377 . . . . 0.0 112.225 -179.16 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 17.5 t -65.99 -44.51 84.64 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.244 0.545 . . . . 0.0 110.326 173.86 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 2.5 tp -55.54 -40.53 71.99 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.092 1.757 . . . . 0.0 113.796 -172.816 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 64.5 mtm180 -83.53 -11.86 56.9 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.057 1.343 . . . . 0.0 113.367 176.447 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -85.62 -54.34 2.82 Favored Glycine 0 N--CA 1.47 0.949 0 C-N-CA 124.466 1.031 . . . . 0.0 110.673 170.828 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 31.2 m -58.45 -6.06 0.63 Allowed 'General case' 0 CA--C 1.56 1.356 0 C-N-CA 126.583 1.953 . . . . 0.0 114.519 174.708 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.87 -2.18 42.88 Favored Glycine 0 CA--C 1.531 1.08 0 C-N-CA 124.65 1.119 . . . . 0.0 114.065 -175.396 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 79.6 mt -57.24 -26.4 60.69 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.387 1.875 . . . . 0.0 113.386 -177.281 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -132.43 143.75 38.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 127.276 2.23 . . . . 0.0 110.177 168.508 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 22.1 t -143.3 139.09 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 125.726 1.61 . . . . 0.0 109.624 -172.54 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.7 153.59 40.01 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 178.108 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 93.7 m -162.01 139.67 8.69 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.36 1.464 . . . . 0.0 108.639 -178.828 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -71.12 123.39 22.04 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 119.946 1.248 . . . . 0.0 109.489 169.037 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.296 0.0 OUTLIER -69.97 -76.35 0.1 Allowed 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.711 1.141 . . . . 0.0 110.351 179.251 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -142.29 -29.98 0.14 Allowed Glycine 0 CA--C 1.534 1.277 0 C-N-CA 127.408 2.432 . . . . 0.0 113.282 169.714 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 6.4 ttp85 -145.93 -10.21 0.52 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.703 1.601 . . . . 0.0 113.914 179.067 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -117.56 172.07 7.59 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 127.0 2.12 . . . . 0.0 109.413 170.012 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 27.8 m -97.88 145.88 8.79 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 164.439 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -126.51 175.49 7.87 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 126.864 2.066 . . . . 0.0 109.718 -176.008 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -120.65 117.03 26.47 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 164.349 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -93.03 166.05 12.55 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.488 1.515 . . . . 0.0 109.123 169.525 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -66.93 166.67 13.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.857 0.863 . . . . 0.0 109.428 167.363 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -47.68 -47.52 29.56 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.538 1.135 . . . . 0.0 113.649 174.77 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -176.72 170.36 2.39 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 126.638 1.975 . . . . 0.0 109.427 -179.442 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -34.65 -36.96 0.05 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 129.373 3.069 . . . . 0.0 111.491 162.723 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -43.25 -69.39 0.14 Allowed 'General case' 0 C--N 1.341 0.205 0 C-N-CA 128.698 2.799 . . . . 0.0 113.295 169.626 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 19.0 mt -70.55 -28.76 65.16 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.22 0.918 . . . . 0.0 111.237 177.528 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -66.49 -34.54 78.14 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.001 0.818 . . . . 0.0 111.388 -176.81 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -79.57 -55.51 4.98 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 117.273 -1.346 . . . . 0.0 110.134 171.611 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.92 -32.17 67.51 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -176.019 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.63 -43.89 15.15 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.386 -0.822 . . . . 0.0 110.939 169.796 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.47 -29.51 71.58 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 125.106 1.336 . . . . 0.0 114.776 -170.134 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -82.88 -25.0 32.94 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.827 1.251 . . . . 0.0 112.451 168.556 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . 0.486 ' C ' ' H ' ' B' ' 91' ' ' GLN . 21.4 tp 71.22 142.71 0.06 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 129.962 3.305 . . . . 0.0 112.238 -177.754 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 12.1 m -42.62 -4.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 C-N-CA 129.487 3.115 . . . . 0.0 117.187 168.606 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.486 ' H ' ' C ' ' B' ' 89' ' ' LEU . 2.5 mm-40 71.68 -29.55 0.2 Allowed 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 128.969 2.908 . . . . 0.0 114.565 173.29 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 4.5 p -58.8 39.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 131.619 3.968 . . . . 0.0 116.488 -175.736 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 60.83 11.63 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 128.779 2.832 . . . . 0.0 113.259 -177.13 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.0 tt 78.85 113.68 0.07 Allowed 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 128.74 2.816 . . . . 0.0 106.35 -166.905 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.28 80.86 0.05 Allowed 'General case' 0 CA--C 1.548 0.887 0 O-C-N 121.045 -1.035 . . . . 0.0 111.868 175.721 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 6.6 m -56.74 146.81 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 127.046 2.138 . . . . 0.0 114.777 -176.322 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -51.11 108.72 0.27 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 127.307 2.243 . . . . 0.0 110.244 169.976 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 3.0 p -158.63 -73.59 0.08 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.138 0.975 . . . . 0.0 109.332 -171.486 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 69.24 36.05 2.48 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.658 1.983 . . . . 0.0 113.133 168.223 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -62.2 164.88 9.75 Favored Pre-proline 0 CA--C 1.545 0.783 0 CA-C-N 114.486 -1.234 . . . . 0.0 111.259 168.543 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -59.56 162.37 15.28 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.238 2.626 . . . . 0.0 111.92 169.448 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -68.2 151.39 47.03 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.577 0.751 . . . . 0.0 109.351 177.065 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 27.4 t -65.22 -38.8 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 O-C-N 120.924 -1.11 . . . . 0.0 111.574 -168.729 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.36 -13.54 62.43 Favored 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 175.583 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -128.0 -154.76 0.65 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 126.103 1.761 . . . . 0.0 112.328 -176.253 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 1.2 ptp85 . . . . . 0 N--CA 1.486 1.349 0 C-N-CA 125.943 1.697 . . . . 0.0 115.33 -168.318 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.471 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -70.76 -19.6 62.7 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.304 -0.872 . . . . 0.0 110.624 168.226 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.11 -42.29 96.92 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 120.661 -1.274 . . . . 0.0 113.363 168.962 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.5 mmt180 -59.93 -43.93 94.64 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 121.461 -0.774 . . . . 0.0 110.367 173.129 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -58.93 -42.26 89.3 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.421 1.888 . . . . 0.0 112.551 176.25 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.7 -30.11 76.59 Favored Glycine 0 N--CA 1.47 0.904 0 O-C-N 120.689 -1.257 . . . . 0.0 112.999 177.199 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.7 ttt-85 -73.44 -41.3 63.39 Favored 'General case' 0 C--O 1.221 -0.395 0 O-C-N 121.725 -0.867 . . . . 0.0 110.817 169.991 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.83 -32.65 65.97 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 176.554 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.5 mt -75.15 -44.93 44.15 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.344 1.058 . . . . 0.0 112.772 172.122 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -84.28 -14.24 50.35 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 116.56 2.059 . . . . 0.0 116.56 -175.507 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -50.94 148.7 7.21 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 126.74 2.016 . . . . 0.0 115.082 -170.843 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.44 ' HG2' ' H ' ' A' ' 22' ' ' THR . 47.8 Cg_endo -49.41 -64.97 0.18 Allowed 'Trans proline' 0 C--N 1.351 0.666 1 C-N-CA 125.889 4.393 . . . . 0.0 112.652 -173.538 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.44 ' H ' ' HG2' ' A' ' 21' ' ' PRO . 52.8 m -82.39 -31.58 29.61 Favored 'General case' 0 C--O 1.226 -0.145 0 CA-C-O 118.452 -0.785 . . . . 0.0 111.756 175.054 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.89 -32.06 65.12 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 120.313 1.415 . . . . 0.0 114.406 -171.304 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.8 t -61.46 -50.38 73.02 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.0 0.818 . . . . 0.0 110.39 170.438 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -57.63 -45.48 85.36 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.812 1.245 . . . . 0.0 113.044 174.363 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 mm -51.6 -53.39 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.388 1.075 . . . . 0.0 110.607 169.515 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.6 mt -56.28 -51.91 66.43 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 117.617 -1.183 . . . . 0.0 111.74 178.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -61.21 -38.18 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 CA-C-N 119.532 1.06 . . . . 0.0 112.404 -178.645 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.83 -15.41 61.17 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 176.327 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.0 tp -74.12 -40.16 62.85 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 120.778 1.626 . . . . 0.0 112.806 175.487 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.4 mt -51.56 -46.61 63.47 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.596 1.559 . . . . 0.0 110.978 175.116 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -86.12 11.98 10.64 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 126.533 1.933 . . . . 0.0 113.277 176.305 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.41 -92.79 0.92 Allowed Glycine 0 N--CA 1.468 0.794 0 C-N-CA 126.848 2.166 . . . . 0.0 114.447 -174.345 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 30.4 m 36.04 41.12 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 127.182 2.193 . . . . 0.0 114.75 -167.326 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 98.9 m -87.38 -102.99 0.07 Allowed 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 124.14 0.976 . . . . 0.0 110.679 175.761 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -112.52 168.87 7.03 Favored Pre-proline 0 CA--C 1.55 0.976 0 O-C-N 120.034 -1.666 . . . . 0.0 114.356 -170.17 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.25 111.4 2.26 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.14 1.893 . . . . 0.0 109.899 -176.002 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.54 7.21 76.05 Favored Glycine 0 CA--C 1.532 1.096 0 CA-C-O 119.166 -0.797 . . . . 0.0 114.354 -175.974 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.01 -21.79 23.4 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 119.45 1.625 . . . . 0.0 115.076 177.97 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.7 mp -63.72 -17.04 62.6 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 123.384 0.674 . . . . 0.0 111.845 175.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.33 -25.2 67.76 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.915 0.78 . . . . 0.0 112.992 173.607 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.55 -50.17 14.58 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.656 0.662 . . . . 0.0 110.146 168.706 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -56.29 -38.78 71.68 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 179.752 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.4 mt -99.36 -19.83 16.81 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.42 1.088 . . . . 0.0 113.438 -172.515 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.64 -11.03 3.51 Favored Glycine 0 CA--C 1.539 1.544 0 C-N-CA 124.525 1.059 . . . . 0.0 113.254 -168.303 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.38 128.15 34.81 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 125.147 1.379 . . . . 0.0 108.051 175.461 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.2 t -56.33 154.99 7.42 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 122.29 1.043 . . . . 0.0 112.019 -176.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.6 ptt-85 -54.93 -16.53 2.78 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.129 0.971 . . . . 0.0 113.316 175.02 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.6 t -65.32 -67.79 0.41 Allowed 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.404 1.002 . . . . 0.0 109.48 167.766 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -54.5 -42.81 71.22 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.604 1.093 . . . . 0.0 112.836 176.947 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.3 t -63.4 -45.48 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-O 118.389 -0.815 . . . . 0.0 111.41 177.005 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 26.0 m -71.57 -35.4 70.56 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.793 1.633 . . . . 0.0 112.837 178.311 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -56.15 -56.79 16.56 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.595 1.558 . . . . 0.0 110.094 173.746 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -73.0 -28.65 62.5 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -179.87 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 44.0 mt -64.3 -33.9 76.89 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.895 1.225 . . . . 0.0 111.72 169.671 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 66.7 m -62.04 -45.31 94.13 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.368 1.44 . . . . 0.0 113.683 -170.795 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 17.6 t -72.14 -21.07 61.52 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 119.432 1.015 . . . . 0.0 112.293 170.816 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.2 tp -67.31 -38.12 84.45 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 120.525 1.511 . . . . 0.0 110.439 171.528 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 90.9 mtm-85 -73.78 -15.24 61.2 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.078 1.351 . . . . 0.0 112.305 172.889 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.446 ' C ' ' H ' ' A' ' 62' ' ' GLY . . . -90.18 -58.51 1.56 Allowed Glycine 0 C--N 1.338 0.69 0 N-CA-C 109.323 -1.511 . . . . 0.0 109.323 179.499 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 69.7 m -60.89 10.82 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 128.113 2.565 . . . . 0.0 114.375 173.191 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.446 ' H ' ' C ' ' A' ' 60' ' ' GLY . . . 62.87 16.12 56.3 Favored Glycine 0 N--CA 1.469 0.864 0 C-N-CA 127.229 2.347 . . . . 0.0 115.631 173.668 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 82.6 mt -78.45 -26.91 46.3 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.532 1.166 . . . . 0.0 112.941 -179.566 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.8 m -132.54 142.81 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.771 1.228 . . . . 0.0 113.686 178.249 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 20.5 t -129.78 139.88 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.979 2.112 . . . . 0.0 109.893 -177.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.03 138.16 43.88 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.272 0.629 . . . . 0.0 112.272 170.726 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.98 161.51 35.47 Favored 'General case' 0 CA--C 1.509 -0.604 0 CA-C-O 121.706 0.765 . . . . 0.0 110.191 170.503 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -73.69 122.66 22.7 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 105.893 -1.892 . . . . 0.0 105.893 165.152 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -75.39 -22.99 57.02 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.773 1.169 . . . . 0.0 112.542 169.804 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 118.69 105.32 2.21 Favored Glycine 0 C--N 1.337 0.584 0 N-CA-C 106.798 -2.521 . . . . 0.0 106.798 -168.344 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 13.8 ttt85 76.01 -57.33 0.57 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.615 1.966 . . . . 0.0 111.621 -169.209 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -98.14 -166.95 1.44 Allowed 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 119.13 0.877 . . . . 0.0 111.249 -179.426 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 10.4 p -128.67 149.63 33.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 126.255 1.822 . . . . 0.0 108.649 -176.797 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.5 ptt180 -136.0 169.73 17.14 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 126.268 1.827 . . . . 0.0 110.998 -177.732 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -112.34 139.5 47.85 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 164.012 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -139.81 150.86 45.21 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.533 1.133 . . . . 0.0 110.394 -178.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.05 129.41 20.72 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.28 1.032 . . . . 0.0 108.302 170.031 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.9 -24.34 66.83 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -170.533 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -161.09 156.61 24.76 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 123.217 1.484 . . . . 0.0 112.9 -179.817 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 91.2 p -43.04 -36.48 1.61 Allowed 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 128.809 2.844 . . . . 0.0 114.87 168.519 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 -58.5 -42.88 88.62 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.08 -1.012 . . . . 0.0 112.559 175.904 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.3 mt -73.06 -38.3 66.51 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 118.685 0.675 . . . . 0.0 109.389 179.062 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.55 89.05 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.469 0.708 . . . . 0.0 109.23 -179.53 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -70.98 -51.97 22.47 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.951 1.7 . . . . 0.0 113.495 175.581 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.2 -45.19 95.62 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.734 1.152 . . . . 0.0 112.736 -179.654 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.0 tt -56.49 -55.59 31.88 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.836 0.855 . . . . 0.0 108.99 169.468 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.78 -17.54 78.32 Favored Glycine 0 CA--C 1.543 1.835 0 C-N-CA 125.601 1.572 . . . . 0.0 115.603 -167.93 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -73.58 -23.25 59.92 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 119.36 1.58 . . . . 0.0 110.361 166.998 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 52.7 tp 72.81 117.83 0.05 OUTLIER 'General case' 0 C--N 1.343 0.314 0 C-N-CA 129.261 3.024 . . . . 0.0 107.68 -171.872 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 21.7 t -69.1 18.78 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 125.902 1.681 . . . . 0.0 113.591 -169.078 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.402 ' C ' ' H ' ' A' ' 93' ' ' VAL . 1.7 tp-100 91.19 -21.64 0.1 Allowed 'General case' 0 C--O 1.221 -0.446 0 O-C-N 119.494 -2.004 . . . . 0.0 110.349 126.319 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.461 ' C ' ' H ' ' A' ' 94' ' ' LEU . 7.7 p -72.44 41.61 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 127.628 2.371 . . . . 0.0 111.43 165.376 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.402 ' H ' ' C ' ' A' ' 91' ' ' GLN . 0.7 OUTLIER 68.6 -27.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 C-N-CA 129.608 3.163 . . . . 0.0 113.57 -173.162 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.461 ' H ' ' C ' ' A' ' 92' ' ' VAL . 45.8 tp 138.28 112.67 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.35 1 C-N-CA 133.116 4.566 . . . . 0.0 106.032 -169.644 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.41 106.84 0.27 Allowed 'General case' 0 CA--C 1.546 0.813 0 O-C-N 121.603 -0.686 . . . . 0.0 111.356 169.432 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.2 t -58.87 158.8 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 127.494 2.317 . . . . 0.0 110.916 169.89 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -85.85 18.83 2.76 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.261 1.824 . . . . 0.0 115.015 -179.568 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.4 p -75.36 96.99 3.5 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.198 0.999 . . . . 0.0 111.906 -178.347 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.79 49.34 1.77 Allowed 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 126.662 1.985 . . . . 0.0 110.534 170.503 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 66.6 mm-40 -103.1 -174.41 0.34 Allowed Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 127.674 2.389 . . . . 0.0 112.43 -169.738 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.28 149.7 88.2 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.988 2.459 . . . . 0.0 110.495 164.207 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.9 t -61.13 172.81 0.94 Allowed 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 124.303 2.002 . . . . 0.0 114.994 -170.339 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 2.4 t -72.69 -17.36 18.35 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 CA-C-N 113.387 -1.733 . . . . 0.0 110.91 172.511 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.96 -24.5 40.92 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.739 1.216 . . . . 0.0 112.099 168.121 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -91.71 -122.48 0.08 Allowed 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 128.756 2.823 . . . . 0.0 105.345 173.119 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.335 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.507 0 C-N-CA 131.174 3.789 . . . . 0.0 114.8 165.149 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.541 0 N-CA-C 117.224 2.305 . . . . 0.0 117.224 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -88.45 -17.74 29.76 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.339 1.056 . . . . 0.0 112.487 168.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.62 -29.08 69.82 Favored 'General case' 0 CA--C 1.546 0.793 0 O-C-N 119.605 -1.934 . . . . 0.0 112.45 170.44 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 11.8 mmt-85 -66.04 -39.52 90.24 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.94 0.896 . . . . 0.0 111.691 170.39 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -57.32 -41.29 79.67 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.146 1.378 . . . . 0.0 111.879 -178.55 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -61.77 -37.24 93.97 Favored Glycine 0 N--CA 1.476 1.305 0 CA-C-N 120.339 1.427 . . . . 0.0 113.535 -178.391 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 9.2 ttt-85 -80.58 -24.11 39.41 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 118.054 0.927 . . . . 0.0 111.937 170.611 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.39 -33.94 74.51 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.138 -1.601 . . . . 0.0 112.498 170.289 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 17.5 mt -83.62 -42.14 17.04 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.163 0.985 . . . . 0.0 111.242 174.409 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -100.08 65.23 1.26 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.833 1.253 . . . . 0.0 112.746 173.307 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -120.81 149.56 50.96 Favored Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 126.082 1.753 . . . . 0.0 108.974 176.881 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -59.74 -63.73 0.12 Allowed 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 124.601 3.534 . . . . 0.0 112.725 -171.839 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.3 m -77.99 -37.75 46.49 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-O 118.709 -0.662 . . . . 0.0 110.066 174.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -67.0 -37.2 83.77 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -169.6 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 22.2 t -62.7 -49.53 74.74 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.644 1.111 . . . . 0.0 111.139 171.811 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 64.5 mtt180 -53.81 -46.67 71.18 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.243 1.017 . . . . 0.0 112.982 172.841 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 11.3 mm -51.9 -53.27 18.36 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 C-N-CA 124.63 1.172 . . . . 0.0 110.787 170.47 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 78.2 mt -57.85 -47.38 82.86 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 117.837 -1.077 . . . . 0.0 111.667 179.131 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.5 m -64.29 -39.52 85.81 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 119.914 1.233 . . . . 0.0 112.813 -179.995 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.32 -8.64 59.78 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -179.274 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 13.2 mt -69.42 -45.17 69.8 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 118.279 -0.867 . . . . 0.0 112.907 169.207 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -44.48 -63.29 0.92 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.27 2.628 . . . . 0.0 112.569 -176.525 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -95.63 8.31 43.76 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 126.53 1.932 . . . . 0.0 112.788 -177.365 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.14 -85.88 1.83 Allowed Glycine 0 C--N 1.338 0.66 0 C-N-CA 127.818 2.628 . . . . 0.0 110.435 173.185 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 34.11 44.53 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.754 1.621 . . . . 0.0 113.552 -167.728 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 88.6 m -105.18 -145.54 0.38 Allowed 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 123.571 1.653 . . . . 0.0 109.655 170.038 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.79 166.03 13.42 Favored Pre-proline 0 C--N 1.317 -0.847 0 N-CA-C 117.609 2.448 . . . . 0.0 117.609 -160.47 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -72.32 110.9 3.07 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 122.25 1.966 . . . . 0.0 107.797 -175.996 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.81 13.27 75.61 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-O 118.227 -1.319 . . . . 0.0 114.908 -171.676 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.59 -36.82 64.83 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.603 1.701 . . . . 0.0 111.297 171.013 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.5 mp -56.14 -15.8 4.26 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 124.634 1.174 . . . . 0.0 113.926 -179.756 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.16 -43.74 92.09 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 119.233 0.924 . . . . 0.0 111.507 172.933 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.43 -25.04 54.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.764 0.826 . . . . 0.0 113.125 175.347 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -70.26 -32.71 70.67 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.422 -0.799 . . . . 0.0 112.813 172.288 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 12.8 mt -111.0 -20.18 12.51 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -169.426 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.88 4.83 78.12 Favored Glycine 0 CA--C 1.535 1.285 0 CA-C-N 119.926 1.239 . . . . 0.0 113.75 -169.731 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -100.24 135.67 41.32 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 125.065 1.346 . . . . 0.0 110.82 178.503 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 6.2 t -55.9 154.47 7.24 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.385 -0.822 . . . . 0.0 112.544 177.796 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 32.9 ptt-85 -51.57 -23.76 4.57 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.251 1.42 . . . . 0.0 113.539 174.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 25.7 t -63.66 -67.08 0.46 Allowed 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 118.526 0.603 . . . . 0.0 110.751 169.484 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -58.07 -35.73 71.79 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.209 1.003 . . . . 0.0 113.455 -179.892 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 15.4 t -59.43 -47.96 88.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 118.767 0.712 . . . . 0.0 111.793 169.899 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 35.7 m -78.31 -32.54 49.36 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -175.638 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -60.15 -49.85 76.01 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.053 0.941 . . . . 0.0 110.176 176.477 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -72.95 -34.36 66.47 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 117.981 -1.009 . . . . 0.0 113.68 175.363 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 28.3 mt -56.38 -30.72 63.06 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 120.643 1.565 . . . . 0.0 112.526 169.571 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 67.7 m -69.54 -49.8 51.0 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 120.144 1.338 . . . . 0.0 114.571 -170.79 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 16.6 t -63.19 -27.55 69.44 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 119.708 1.14 . . . . 0.0 111.678 171.599 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 11.8 tp -66.36 -39.98 89.47 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.108 2.163 . . . . 0.0 112.35 177.271 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 82.2 mtm-85 -67.65 -33.52 75.11 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 119.145 0.884 . . . . 0.0 110.327 173.228 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -71.46 -53.64 9.87 Favored Glycine 0 N--CA 1.466 0.634 0 N-CA-C 110.251 -1.14 . . . . 0.0 110.251 179.226 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 57.1 m -55.98 -4.6 0.13 Allowed 'General case' 0 CA--C 1.56 1.332 0 C-N-CA 128.112 2.565 . . . . 0.0 113.961 173.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.78 16.66 67.47 Favored Glycine 0 C--N 1.343 0.953 0 C-N-CA 127.347 2.403 . . . . 0.0 113.645 170.083 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 90.7 mt -94.52 -21.11 19.08 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 -169.648 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 4.5 m -140.44 156.17 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -173.77 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 96.2 t -147.21 149.48 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 125.702 1.601 . . . . 0.0 111.019 -173.144 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.4 125.2 41.89 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.012 0.925 . . . . 0.0 111.906 169.168 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.15 165.85 16.84 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.254 1.021 . . . . 0.0 110.313 -176.154 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -76.04 122.57 24.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.817 168.675 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -85.78 -24.97 26.63 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 118.316 0.507 . . . . 0.0 111.357 167.067 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 125.96 105.33 1.47 Allowed Glycine 0 C--N 1.34 0.778 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -174.191 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 71.15 -52.1 0.69 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.999 2.12 . . . . 0.0 111.403 -169.639 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -91.45 -178.04 4.99 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.643 1.177 . . . . 0.0 110.444 177.568 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 11.2 p -125.61 138.24 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 125.976 1.71 . . . . 0.0 108.884 179.896 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 38.1 ptt180 -115.17 166.28 12.0 Favored 'General case' 0 CA--C 1.509 -0.628 0 C-N-CA 124.708 1.203 . . . . 0.0 109.415 -176.78 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -115.75 135.94 53.54 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 168.979 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -141.77 160.91 39.22 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.88 1.672 . . . . 0.0 112.055 -169.098 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 49.7 mt -68.19 152.67 45.13 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.803 0.841 . . . . 0.0 109.271 167.421 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.22 -22.35 38.86 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 -169.5 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -167.07 158.14 12.0 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.383 1.473 . . . . 0.0 112.76 179.068 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 89.5 p -40.01 -39.84 0.94 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 128.811 2.845 . . . . 0.0 114.949 168.221 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -55.97 -43.81 77.92 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.701 0.8 . . . . 0.0 111.571 175.9 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 1.9 mt -78.0 -42.14 33.61 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.408 1.004 . . . . 0.0 110.194 -176.471 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.12 -38.9 63.06 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.852 0.861 . . . . 0.0 111.043 171.777 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . 0.45 HH22 ' CD ' ' B' ' 88' ' ' GLU . 18.5 tpt180 -70.95 -52.72 18.15 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.574 1.55 . . . . 0.0 113.659 177.041 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.94 -40.38 88.73 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 118.89 0.768 . . . . 0.0 112.43 177.622 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.88 -49.32 77.13 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.971 1.308 . . . . 0.0 109.883 169.564 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.05 -29.95 63.94 Favored Glycine 0 CA--C 1.536 1.384 0 C-N-CA 125.636 1.588 . . . . 0.0 114.768 -169.552 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . 0.45 ' CD ' HH22 ' B' ' 84' ' ' ARG . 4.4 tp10 -73.75 -14.63 61.15 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 118.971 1.385 . . . . 0.0 111.128 167.197 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . 0.409 ' C ' ' H ' ' B' ' 91' ' ' GLN . 28.2 tp 70.78 157.08 0.16 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 129.001 2.921 . . . . 0.0 107.922 -166.861 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . 0.467 HG23 ' H ' ' B' ' 95' ' ' ALA . 27.8 m -53.91 -11.84 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 O-C-N 121.055 -1.028 . . . . 0.0 112.654 167.397 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.421 ' C ' ' H ' ' B' ' 93' ' ' VAL . 3.6 tp-100 76.5 -20.04 0.39 Allowed 'General case' 0 C--N 1.345 0.376 0 C-N-CA 127.742 2.417 . . . . 0.0 112.287 161.487 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 3.9 p -68.05 38.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 128.593 2.757 . . . . 0.0 113.903 169.515 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . 0.421 ' H ' ' C ' ' B' ' 91' ' ' GLN . 2.3 t 74.72 -34.42 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 C-N-CA 130.039 3.336 . . . . 0.0 112.301 -178.718 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 38.3 tp 155.3 111.12 0.0 OUTLIER 'General case' 0 C--N 1.341 0.236 0 C-N-CA 131.664 3.986 . . . . 0.0 108.123 178.073 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . 0.467 ' H ' HG23 ' B' ' 90' ' ' VAL . . . -64.07 87.11 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.82 0 O-C-N 121.638 -0.664 . . . . 0.0 109.557 165.943 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 4.2 t -53.7 162.04 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 128.091 2.556 . . . . 0.0 111.237 173.293 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -73.61 8.09 2.06 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 127.625 2.37 . . . . 0.0 116.544 -179.533 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 45.1 p -73.59 114.73 12.18 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.247 0.931 . . . . 0.0 113.351 -171.22 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -102.0 113.84 27.42 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 105.68 -1.97 . . . . 0.0 105.68 166.062 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 1.3 tp-100 -161.78 -169.04 0.21 Allowed Pre-proline 0 CA--C 1.551 0.982 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 -163.933 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -75.43 -174.39 1.97 Allowed 'Trans proline' 0 N--CA 1.45 -1.056 0 C-N-CA 121.371 1.38 . . . . 0.0 111.43 175.124 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 5.2 t -68.16 171.54 6.89 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-O 123.339 1.542 . . . . 0.0 110.655 168.936 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 17.3 t -77.47 -22.11 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 C-N-CA 127.105 2.162 . . . . 0.0 111.7 175.389 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -76.69 -37.27 56.41 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.419 1.087 . . . . 0.0 111.681 169.373 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -68.27 175.86 3.07 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.985 1.714 . . . . 0.0 110.248 169.304 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.819 0 O-C-N 120.498 -1.376 . . . . 0.0 113.819 -179.851 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.842 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . 0.258 4.0 pp -67.19 -33.45 75.4 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -172.373 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.53 -46.75 89.01 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.465 1.03 . . . . 0.0 111.004 168.613 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -59.11 -38.31 79.26 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 120.452 1.478 . . . . 0.0 112.679 174.705 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -63.36 -57.47 10.23 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.036 0.834 . . . . 0.0 110.853 177.366 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -61.15 -32.34 80.12 Favored Glycine 0 CA--C 1.533 1.178 0 O-C-N 121.335 -0.853 . . . . 0.0 113.007 178.267 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -68.15 -4.04 12.47 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.295 1.548 . . . . 0.0 114.144 -178.807 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -128.31 -15.87 4.54 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 167.898 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.6 mp -101.39 -15.76 17.1 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 178.641 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.23 75.09 4.62 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.571 1.548 . . . . 0.0 107.329 167.281 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -164.46 147.92 7.69 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 123.757 0.823 . . . . 0.0 113.125 -168.441 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -63.63 -96.87 0.0 OUTLIER 'Trans proline' 0 CA--C 1.547 1.145 1 C-N-CA 125.45 4.1 . . . . 0.0 111.512 174.065 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.422 ' HG1' ' CD2' ' A' ' 54' ' ' HIS . 41.3 p -47.98 -35.6 11.17 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 128.12 2.568 . . . . 0.0 112.912 169.677 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -75.96 -46.71 28.33 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 121.532 1.969 . . . . 0.0 113.94 -169.17 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 37.3 t -59.17 -42.42 90.76 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.93 0.786 . . . . 0.0 109.514 169.943 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -54.66 -43.37 72.34 Favored 'General case' 0 CA--C 1.555 1.163 0 CA-C-O 117.93 -1.033 . . . . 0.0 112.641 171.251 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.1 mt -56.28 -51.7 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 CA-C-N 121.858 2.117 . . . . 0.0 110.338 172.338 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.17 -40.05 88.56 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 118.486 -0.769 . . . . 0.0 112.796 -177.165 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.6 p -81.67 -24.62 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 CA-C-N 119.637 1.108 . . . . 0.0 113.067 178.324 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.75 -31.03 63.14 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.638 1.175 . . . . 0.0 111.972 172.844 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 tp -64.64 -39.68 94.12 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 120.787 -1.196 . . . . 0.0 113.513 170.441 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -44.6 -44.41 8.87 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.626 2.37 . . . . 0.0 114.283 -174.753 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -103.56 -19.31 14.41 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.36 1.064 . . . . 0.0 112.978 169.089 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.71 -2.28 57.41 Favored Glycine 0 C--O 1.218 -0.871 0 CA-C-O 114.992 -3.115 . . . . 0.0 117.257 -165.076 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 19.7 m -32.99 54.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 N-CA-C 119.668 3.21 . . . . 0.0 119.668 169.418 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.9 m -109.42 -67.47 0.98 Allowed 'General case' 0 C--O 1.224 -0.287 0 O-C-N 119.828 -1.795 . . . . 0.0 110.728 -174.167 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -148.78 157.14 41.13 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-O 117.901 -1.047 . . . . 0.0 110.976 -174.456 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -55.98 -31.93 83.94 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.166 2.578 . . . . 0.0 113.827 179.121 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -81.33 -8.26 87.36 Favored Glycine 0 CA--C 1.532 1.135 0 CA-C-O 118.352 -1.249 . . . . 0.0 114.851 176.338 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.85 -37.58 84.73 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 119.554 1.677 . . . . 0.0 111.531 -170.881 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.5 mt -58.5 -24.58 60.84 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 123.699 0.8 . . . . 0.0 111.33 178.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.59 -36.67 67.14 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 119.265 0.938 . . . . 0.0 111.427 -175.366 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.39 -51.94 10.88 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.933 0.893 . . . . 0.0 112.529 172.756 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -53.57 -32.92 52.89 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 178.239 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 55.6 mt -97.33 -11.31 24.19 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 126.442 1.897 . . . . 0.0 112.617 -179.104 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 61.69 18.42 56.41 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-O 118.598 -1.112 . . . . 0.0 113.867 -170.812 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.8 mt -122.19 148.17 45.28 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 119.277 1.539 . . . . 0.0 113.733 -169.661 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.3 t -58.79 138.12 57.35 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.074 178.572 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.4 -24.82 65.44 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -171.325 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.7 m -63.8 -47.89 79.06 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.4 1.08 . . . . 0.0 112.687 170.196 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -75.2 -32.83 61.31 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 118.76 0.709 . . . . 0.0 111.712 178.341 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.9 t -58.89 -41.52 83.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 120.982 -1.074 . . . . 0.0 110.343 167.848 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 57.8 m -63.1 -40.29 97.19 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 177.844 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -51.07 -50.52 58.53 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.488 1.115 . . . . 0.0 111.572 173.405 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.422 ' CD2' ' HG1' ' A' ' 22' ' ' THR . 9.3 m-70 -69.87 -37.23 76.01 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 115.4 -2.238 . . . . 0.0 113.598 176.205 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 37.7 mt -61.25 -34.09 74.58 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 121.437 1.926 . . . . 0.0 113.279 175.464 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.4 m -53.12 -39.26 63.34 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.184 -0.947 . . . . 0.0 113.441 -177.797 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 3.2 t -66.99 -51.08 59.45 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 118.878 0.763 . . . . 0.0 111.085 176.603 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.431 ' CD1' ' H ' ' A' ' 58' ' ' LEU . 2.6 mp -59.64 -36.2 75.9 Favored 'General case' 0 N--CA 1.484 1.259 0 O-C-N 120.792 -1.192 . . . . 0.0 111.885 -175.394 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 90.4 mtm180 -76.17 -21.7 56.22 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.336 1.055 . . . . 0.0 112.71 -176.721 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.3 -36.11 4.5 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.893 1.235 . . . . 0.0 114.49 176.991 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 59.9 m -70.63 -17.03 62.88 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 125.003 1.321 . . . . 0.0 112.441 173.396 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 95.17 20.14 28.7 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 128.137 2.78 . . . . 0.0 115.782 172.295 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.1 mt -83.4 -20.38 34.27 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 119.333 1.567 . . . . 0.0 114.499 177.091 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.9 t -134.33 140.74 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 124.637 1.175 . . . . 0.0 110.612 -179.057 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.6 t -135.31 135.93 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 126.273 1.829 . . . . 0.0 108.672 -170.977 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.09 157.57 37.52 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 122.628 1.204 . . . . 0.0 112.214 172.399 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 30.3 m -153.54 154.34 34.11 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.842 1.657 . . . . 0.0 106.587 175.301 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -74.23 162.44 28.93 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.936 0.789 . . . . 0.0 112.379 169.758 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -139.91 171.32 14.38 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 126.309 1.844 . . . . 0.0 111.911 178.246 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -68.14 75.42 0.26 Allowed Glycine 0 CA--C 1.527 0.834 0 C-N-CA 125.837 1.684 . . . . 0.0 112.525 179.366 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 95.9 18.96 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 129.945 3.298 . . . . 0.0 111.987 179.7 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -158.06 -178.63 7.44 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 120.972 -1.08 . . . . 0.0 110.551 -175.17 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 32.5 m -121.76 156.48 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 124.148 0.979 . . . . 0.0 109.198 167.257 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -132.51 178.3 6.95 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 124.767 1.227 . . . . 0.0 110.452 -170.23 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -129.54 134.92 48.01 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.525 168.862 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -130.09 151.64 50.4 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 126.414 1.886 . . . . 0.0 108.834 179.596 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.12 157.76 15.22 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.257 0.48 . . . . 0.0 110.708 175.536 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -43.04 -54.61 4.23 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.748 1.619 . . . . 0.0 113.544 -178.201 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -165.7 165.66 18.47 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.834 1.653 . . . . 0.0 110.137 -173.843 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.16 -35.72 0.08 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 129.687 3.195 . . . . 0.0 111.642 165.803 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -46.53 -69.2 0.14 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.307 1.843 . . . . 0.0 113.145 169.172 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.4 mt -71.57 -34.01 69.57 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.083 0.856 . . . . 0.0 110.771 -174.487 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.65 -45.91 90.61 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 118.673 -0.68 . . . . 0.0 111.923 175.612 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.03 -43.28 71.63 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 117.318 -1.325 . . . . 0.0 111.651 176.416 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.37 -47.86 80.53 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.785 1.175 . . . . 0.0 113.238 177.063 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.25 -39.62 74.92 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.763 -0.585 . . . . 0.0 111.136 178.472 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.69 -36.79 61.83 Favored Glycine 0 CA--C 1.531 1.059 0 C-N-CA 125.311 1.434 . . . . 0.0 114.565 -176.7 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -72.68 -5.96 41.15 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.651 1.226 . . . . 0.0 112.521 172.655 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 52.0 tp 75.01 107.62 0.07 Allowed 'General case' 0 C--N 1.345 0.392 0 C-N-CA 129.764 3.226 . . . . 0.0 112.459 166.349 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.81 32.67 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 125.81 1.644 . . . . 0.0 112.328 -169.756 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 79.93 -10.8 1.25 Allowed 'General case' 0 C--O 1.221 -0.433 0 O-C-N 120.387 -1.445 . . . . 0.0 113.824 122.123 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 12.3 p -71.94 54.08 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 C-N-CA 130.218 3.407 . . . . 0.0 109.963 166.647 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 71.92 -10.87 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 126.632 1.973 . . . . 0.0 114.355 178.268 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.3 tt 117.47 103.67 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 131.291 3.836 . . . . 0.0 106.755 -169.355 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.81 76.72 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.173 0 C-N-CA 125.115 1.366 . . . . 0.0 114.383 174.269 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.1 t -82.08 145.4 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 125.686 1.594 . . . . 0.0 107.728 167.269 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -69.82 13.99 0.12 Allowed 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 178.137 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.82 34.48 0.12 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.966 1.306 . . . . 0.0 109.771 166.74 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -57.83 130.54 46.92 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 125.254 1.422 . . . . 0.0 109.245 -166.742 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -132.31 132.78 23.1 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.958 -160.693 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -53.39 150.71 25.56 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 125.142 3.894 . . . . 0.0 117.968 -163.499 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 41.5 t -90.98 -134.47 0.13 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 127.066 2.146 . . . . 0.0 112.727 177.171 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 10.0 t 58.54 -116.17 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 127.917 2.487 . . . . 0.0 106.163 -168.472 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -175.67 149.42 0.97 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 129.603 3.161 . . . . 0.0 108.38 171.303 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -153.01 141.13 20.41 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.45 1.1 . . . . 0.0 108.674 -169.601 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 7.5 ttm180 . . . . . 0 CA--C 1.548 0.884 0 C-N-CA 123.666 0.786 . . . . 0.0 112.025 175.903 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.466 ' H ' ' HD2' ' B' ' 13' ' ' ARG . . . . . . . . 0 CA--C 1.544 0.736 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 pp -60.96 -33.86 73.86 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 116.827 2.158 . . . . 0.0 116.827 -167.314 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.01 -30.21 62.33 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 121.048 1.749 . . . . 0.0 112.404 174.0 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . 0.466 ' HD2' ' H ' ' B' ' 10' ' ' ALA . 93.1 mtt180 -57.57 -51.23 70.34 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.369 0.986 . . . . 0.0 109.69 171.305 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -58.9 -63.36 1.32 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.827 0.851 . . . . 0.0 109.563 175.797 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -59.98 -40.84 97.49 Favored Glycine 0 C--O 1.219 -0.825 0 CA-C-O 117.64 -1.644 . . . . 0.0 112.831 -169.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -87.07 -12.31 47.59 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.212 2.006 . . . . 0.0 114.085 -179.428 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -86.95 -31.56 20.59 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.773 1.17 . . . . 0.0 111.467 168.103 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.6 mp -83.77 -19.12 35.64 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.616 0.766 . . . . 0.0 111.207 171.899 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.16 63.73 1.89 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.29 1.836 . . . . 0.0 110.597 167.713 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -144.22 137.39 13.96 Favored Pre-proline 0 CA--C 1.547 0.841 0 N-CA-C 104.19 -2.522 . . . . 0.0 104.19 167.831 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . 0.523 ' HG2' ' H ' ' B' ' 22' ' ' THR . 57.1 Cg_endo -52.13 -77.42 0.02 OUTLIER 'Trans proline' 0 CA--C 1.548 1.183 1 C-N-CA 125.816 4.344 . . . . 0.0 112.703 -175.853 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.759 ' HG1' ' CD2' ' B' ' 54' ' ' HIS . 2.0 p -41.19 -49.89 3.56 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 129.605 3.162 . . . . 0.0 112.586 168.251 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 37.6 ttt180 -72.95 -34.83 66.77 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.12 0.968 . . . . 0.0 111.979 -168.076 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 46.8 t -63.09 -51.48 66.46 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.19 0.905 . . . . 0.0 109.802 167.595 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -57.99 -35.01 70.61 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.034 1.334 . . . . 0.0 112.364 178.729 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 5.3 mm -56.1 -61.87 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 125.629 1.571 . . . . 0.0 108.644 169.085 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 82.1 mt -64.36 -40.2 95.37 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.585 0.754 . . . . 0.0 111.997 -169.366 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 8.6 p -70.96 -23.97 24.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 177.311 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.38 -21.0 20.47 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 175.32 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.6 mt -58.2 -46.37 85.95 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.112 -0.993 . . . . 0.0 110.021 168.664 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.7 mt -44.66 -36.62 3.19 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 129.355 3.062 . . . . 0.0 114.484 175.193 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -100.01 -18.79 16.86 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.276 1.831 . . . . 0.0 112.751 -177.963 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -108.32 -66.97 0.6 Allowed Glycine 0 C--N 1.341 0.861 0 C-N-CA 125.203 1.382 . . . . 0.0 115.033 -170.509 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 15.7 m 34.3 36.1 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 C-N-CA 127.069 2.147 . . . . 0.0 115.815 -169.182 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 72.7 m -85.02 -72.63 0.47 Allowed 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.066 0.947 . . . . 0.0 112.68 -176.587 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -148.29 153.08 40.41 Favored Pre-proline 0 N--CA 1.474 0.769 0 CA-C-O 117.767 -1.111 . . . . 0.0 112.306 -169.932 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -54.39 -31.31 67.44 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 123.127 2.551 . . . . 0.0 113.783 -178.063 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -84.46 -7.04 85.25 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-O 117.868 -1.518 . . . . 0.0 115.301 175.53 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -30.4 70.9 Favored 'General case' 0 C--N 1.347 0.498 0 CA-C-N 120.534 2.167 . . . . 0.0 112.224 -170.704 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.4 mt -67.09 -13.33 61.83 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 119.082 -0.485 . . . . 0.0 111.567 -175.444 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.63 -31.71 66.53 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.286 0.948 . . . . 0.0 112.358 171.473 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.84 -48.91 13.83 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.312 0.645 . . . . 0.0 111.422 171.533 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -55.05 -32.38 61.84 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 179.94 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 67.0 mt -104.16 -23.43 13.27 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.751 1.62 . . . . 0.0 112.095 -176.077 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.65 8.63 72.6 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 124.271 0.938 . . . . 0.0 113.402 -169.073 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 92.0 mt -111.1 148.95 31.56 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 125.48 1.512 . . . . 0.0 110.674 -170.554 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.3 t -59.57 150.79 26.18 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -177.862 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -21.77 64.72 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -174.993 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 9.4 m -73.7 -41.26 62.85 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 120.952 -1.093 . . . . 0.0 112.526 169.164 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -68.82 -39.72 79.89 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.599 0.76 . . . . 0.0 110.955 174.781 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 43.7 t -54.3 -50.46 56.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.896 0.878 . . . . 0.0 109.725 167.09 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 68.6 m -60.56 -40.38 91.44 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -178.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -53.99 -50.56 66.29 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.265 1.026 . . . . 0.0 112.217 -178.788 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . 0.759 ' CD2' ' HG1' ' B' ' 22' ' ' THR . 73.1 m-70 -79.04 -10.91 59.96 Favored 'General case' 0 CA--C 1.552 1.025 0 O-C-N 120.847 -1.158 . . . . 0.0 114.044 175.865 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 81.2 mt -80.26 -28.84 38.35 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.592 1.542 . . . . 0.0 111.651 167.422 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 68.9 m -53.74 -46.1 70.76 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 117.754 -1.117 . . . . 0.0 113.064 -176.65 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 4.0 t -72.16 -44.5 62.98 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.803 1.183 . . . . 0.0 109.579 176.91 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 3.6 tp -50.82 -38.23 47.52 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.873 2.469 . . . . 0.0 114.572 -173.26 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 47.3 mtp180 -80.74 -9.93 59.77 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.318 1.847 . . . . 0.0 112.604 -179.785 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -105.68 -32.93 3.71 Favored Glycine 0 CA--C 1.539 1.592 0 C-N-CA 127.166 2.317 . . . . 0.0 113.825 169.212 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 86.9 m -55.72 -27.68 51.76 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 126.389 1.876 . . . . 0.0 112.052 169.387 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.95 25.17 58.47 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 126.089 1.804 . . . . 0.0 112.488 -173.398 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 91.4 mt -86.83 -25.32 24.61 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.19 1.495 . . . . 0.0 113.279 175.562 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.1 m -127.61 131.85 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 124.772 1.229 . . . . 0.0 112.544 179.074 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 49.6 t -121.0 136.48 57.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.493 1.517 . . . . 0.0 109.83 -179.863 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.06 155.73 28.67 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.13 1.372 . . . . 0.0 113.35 170.571 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 87.3 m -155.15 151.55 28.38 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.853 1.661 . . . . 0.0 107.435 178.728 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -76.84 150.58 36.08 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.792 0.723 . . . . 0.0 112.25 173.886 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -125.12 170.76 10.89 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 127.001 2.12 . . . . 0.0 112.377 178.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -67.46 78.86 0.17 Allowed Glycine 0 CA--C 1.528 0.846 0 C-N-CA 125.221 1.391 . . . . 0.0 112.209 177.16 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 93.62 17.43 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 129.418 3.087 . . . . 0.0 112.359 178.802 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -157.07 -179.67 8.43 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.806 1.242 . . . . 0.0 109.974 -176.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 27.2 m -117.68 158.61 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.122 0.969 . . . . 0.0 109.328 166.608 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -131.83 176.93 7.93 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 124.851 1.26 . . . . 0.0 110.653 -175.082 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -136.34 153.88 51.01 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 125.193 1.397 . . . . 0.0 109.236 170.607 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -157.3 154.91 29.81 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 124.278 1.031 . . . . 0.0 110.871 -172.742 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -50.71 129.47 22.87 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.02 1.328 . . . . 0.0 107.581 168.362 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.18 -38.89 74.28 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 -169.563 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -151.13 163.68 38.25 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 123.1 1.428 . . . . 0.0 111.775 174.892 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.53 -36.79 0.11 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 129.761 3.225 . . . . 0.0 111.603 165.867 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -47.75 -63.94 0.92 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.198 1.799 . . . . 0.0 112.468 169.835 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 9.4 mt -71.59 -38.74 70.85 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.201 0.91 . . . . 0.0 110.369 -177.828 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.73 -47.13 77.45 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.307 0.643 . . . . 0.0 112.198 177.538 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 4.8 ppt_? -71.58 -47.54 54.14 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 117.868 -1.063 . . . . 0.0 111.589 178.706 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.62 -44.23 72.95 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.484 1.038 . . . . 0.0 113.387 176.776 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.82 -40.05 66.13 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.451 -0.781 . . . . 0.0 111.804 177.003 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.34 -36.38 50.22 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 124.935 1.255 . . . . 0.0 114.348 -174.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -74.01 -5.38 41.04 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 118.632 1.216 . . . . 0.0 112.548 169.855 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . 0.441 ' C ' ' H ' ' B' ' 91' ' ' GLN . 50.3 tp 72.27 112.56 0.06 Allowed 'General case' 0 C--N 1.343 0.303 0 C-N-CA 129.582 3.153 . . . . 0.0 112.751 166.891 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.6 t -70.93 23.8 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 127.272 2.229 . . . . 0.0 113.186 -175.38 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.441 ' H ' ' C ' ' B' ' 89' ' ' LEU . 1.4 tp-100 84.78 -14.89 0.58 Allowed 'General case' 0 N--CA 1.472 0.656 0 O-C-N 119.726 -1.859 . . . . 0.0 114.314 121.697 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 8.1 p -64.34 49.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 130.492 3.517 . . . . 0.0 112.058 167.741 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 63.38 13.41 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 126.682 1.993 . . . . 0.0 114.306 -176.388 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt 100.73 108.35 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 130.004 3.322 . . . . 0.0 107.686 -169.519 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.97 67.93 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 125.226 1.41 . . . . 0.0 113.022 171.181 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 12.4 t -69.73 144.73 13.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 124.974 1.309 . . . . 0.0 109.418 172.441 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -76.07 18.36 0.28 Allowed 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 115.024 1.491 . . . . 0.0 115.024 177.684 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.31 45.81 0.58 Allowed 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 164.884 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -57.96 131.52 50.68 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 125.025 1.33 . . . . 0.0 110.728 -163.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -139.22 139.02 21.73 Favored Pre-proline 0 CA--C 1.556 1.191 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.905 -161.751 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.3 151.62 72.63 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 125.132 3.888 . . . . 0.0 119.656 -163.369 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 1.5 t -88.33 164.98 15.3 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 129.224 3.009 . . . . 0.0 112.182 169.378 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 26.3 t 88.44 138.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 129.15 2.98 . . . . 0.0 108.757 179.297 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.67 69.28 1.75 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.154 1.782 . . . . 0.0 113.765 -174.456 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -62.03 132.82 54.17 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.652 168.893 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? . . . . . 0 CA--C 1.551 0.998 0 C-N-CA 124.485 1.114 . . . . 0.0 112.905 175.702 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.252 0 N-CA-C 111.833 0.308 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.8 mt -46.43 -63.22 1.06 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.576 1.15 . . . . 0.0 112.422 -179.205 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.23 9.94 4.11 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -178.472 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.42 -35.26 6.82 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.378 0.671 . . . . 0.0 111.781 167.339 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -61.05 -51.92 67.16 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.213 1.405 . . . . 0.0 110.254 176.921 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.67 -23.83 69.2 Favored Glycine 0 CA--C 1.534 1.255 0 O-C-N 121.136 -0.977 . . . . 0.0 113.058 173.489 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.18 -33.62 65.52 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 118.872 1.336 . . . . 0.0 110.761 172.714 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -79.99 -34.46 38.54 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.637 1.175 . . . . 0.0 113.542 177.846 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 mt -63.82 -41.88 97.76 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.705 0.802 . . . . 0.0 112.486 174.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -94.28 -10.01 34.2 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -173.474 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -51.76 147.22 12.14 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.006 1.722 . . . . 0.0 111.344 -178.845 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.412 ' HG2' ' H ' ' A' ' 22' ' ' THR . 55.8 Cg_endo -35.57 -79.13 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.709 1 C-N-CA 127.864 5.71 . . . . 0.0 113.112 -166.804 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.412 ' H ' ' HG2' ' A' ' 21' ' ' PRO . 2.9 p -81.24 -22.26 38.89 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 116.42 -1.752 . . . . 0.0 113.23 178.385 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.4 mtm-85 -63.33 -45.6 90.55 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 121.531 1.968 . . . . 0.0 111.67 175.98 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 25.1 t -50.8 -48.63 59.51 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.611 1.096 . . . . 0.0 110.749 169.545 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.1 mtm-85 -62.41 -47.75 82.72 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.467 1.107 . . . . 0.0 113.521 176.997 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.1 mm -53.13 -47.11 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.613 1.565 . . . . 0.0 110.863 170.319 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 48.8 mt -70.15 -43.02 71.74 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 117.746 -1.121 . . . . 0.0 112.769 -177.711 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.4 p -73.0 -25.99 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 119.95 1.25 . . . . 0.0 111.195 179.21 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.49 -12.95 59.48 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.743 1.217 . . . . 0.0 113.014 169.473 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.1 tp -82.42 -36.49 26.61 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 116.948 -1.501 . . . . 0.0 112.139 169.223 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -43.48 -58.17 2.73 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.005 2.122 . . . . 0.0 112.881 -175.463 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -98.22 9.28 43.33 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.662 1.585 . . . . 0.0 112.403 172.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -108.54 -33.89 2.79 Favored Glycine 0 C--N 1.342 0.865 0 CA-C-O 114.585 -3.342 . . . . 0.0 117.92 -168.344 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 33.9 m -15.59 43.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.069 2 C-N-CA 132.251 4.22 . . . . 0.0 122.122 175.801 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.8 m -95.78 -60.39 1.66 Allowed 'General case' 0 C--N 1.327 -0.386 0 O-C-N 118.763 -2.461 . . . . 0.0 111.514 178.205 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -146.41 151.55 43.9 Favored Pre-proline 0 N--CA 1.476 0.845 0 N-CA-C 116.633 2.086 . . . . 0.0 116.633 -169.214 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -63.83 133.1 37.45 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 123.479 2.786 . . . . 0.0 110.744 178.321 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.5 -2.62 52.52 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-O 118.753 -1.026 . . . . 0.0 114.444 -176.882 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -58.52 -28.91 65.88 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.344 1.572 . . . . 0.0 112.882 179.272 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mp -69.25 -2.52 10.81 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 122.481 0.312 . . . . 0.0 111.499 -172.067 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.99 -38.16 90.05 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.13 0.572 . . . . 0.0 110.541 169.091 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.94 -36.06 64.63 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.441 0.697 . . . . 0.0 111.999 170.708 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -66.73 -36.52 82.67 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 177.301 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.1 mt -105.03 -20.72 13.44 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -172.563 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.79 11.22 83.49 Favored Glycine 0 CA--C 1.537 1.416 0 CA-C-N 119.46 1.027 . . . . 0.0 113.091 -168.451 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.5 mt -100.75 148.18 25.19 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.697 1.199 . . . . 0.0 111.46 -176.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.2 t -61.15 144.04 54.38 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 122.16 0.981 . . . . 0.0 111.891 -172.84 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.78 -20.15 54.91 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.222 1.009 . . . . 0.0 113.589 179.468 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.5 p -70.78 -60.12 2.42 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.442 1.019 . . . . 0.0 109.414 167.083 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -54.32 -42.08 69.76 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.71 1.604 . . . . 0.0 114.684 178.481 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 5.0 t -64.32 -41.21 91.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 O-C-N 119.876 -1.765 . . . . 0.0 111.813 171.898 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 55.0 m -62.45 -43.36 99.01 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 119.159 0.89 . . . . 0.0 112.071 173.612 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -55.74 -45.36 78.02 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 127.004 2.121 . . . . 0.0 112.261 175.678 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 23.6 m170 -64.33 -40.51 96.04 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.149 -0.969 . . . . 0.0 112.863 171.693 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.6 mt -67.36 -25.32 65.92 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 118.691 0.678 . . . . 0.0 112.349 178.068 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.3 m -62.08 -44.76 95.97 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.213 1.37 . . . . 0.0 114.364 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 42.8 t -60.37 -54.0 50.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.975 1.31 . . . . 0.0 110.482 169.508 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -51.22 -42.59 61.06 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 128.535 2.734 . . . . 0.0 113.677 -177.668 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 9.1 mtm-85 -83.26 -4.4 58.39 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.538 1.535 . . . . 0.0 113.143 178.802 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -110.05 -26.31 5.0 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 126.236 1.874 . . . . 0.0 114.107 174.092 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 2.6 m -74.51 -1.46 21.44 Favored 'General case' 0 CA--C 1.564 1.504 0 C-N-CA 129.928 3.291 . . . . 0.0 111.724 168.86 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.82 14.45 37.37 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 126.184 1.849 . . . . 0.0 113.571 -175.122 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.9 mt -69.07 -30.23 68.51 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.458 -1.025 . . . . 0.0 111.676 172.777 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.8 t -134.43 132.44 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.902 0.881 . . . . 0.0 112.814 -167.472 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 89.0 t -126.61 141.13 46.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 126.058 1.743 . . . . 0.0 111.098 -168.074 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -93.68 148.7 21.86 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.202 1.401 . . . . 0.0 113.045 173.99 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.8 m -169.61 152.77 4.78 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.649 1.98 . . . . 0.0 107.119 -175.713 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -79.91 141.42 36.1 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 119.853 1.206 . . . . 0.0 112.895 174.788 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.263 0.0 OUTLIER -89.47 -17.94 27.7 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 122.603 0.361 . . . . 0.0 111.444 166.588 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 123.0 -30.26 5.1 Favored Glycine 0 N--CA 1.474 1.208 0 C-N-CA 126.592 2.044 . . . . 0.0 114.24 169.444 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.38 -15.96 14.88 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 128.226 2.611 . . . . 0.0 112.08 172.919 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -158.6 167.0 30.75 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 129.397 3.079 . . . . 0.0 109.469 -176.256 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 6.0 p -91.96 150.62 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.221 1.009 . . . . 0.0 109.908 168.543 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 12.3 ptt85 -126.49 163.93 22.28 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.95 0.881 . . . . 0.0 111.405 -176.422 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -111.28 156.41 21.55 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 114.294 -1.321 . . . . 0.0 107.584 164.519 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -163.19 151.22 13.57 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.143 0.977 . . . . 0.0 109.902 -176.413 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 14.5 mt -57.44 152.14 15.11 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 119.009 0.822 . . . . 0.0 109.02 167.314 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.14 -33.11 73.87 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -170.065 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -169.85 163.21 9.66 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.396 1.478 . . . . 0.0 112.684 -174.243 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 98.3 p -42.69 -33.81 0.79 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 128.491 2.717 . . . . 0.0 114.34 166.931 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -52.98 -52.09 59.42 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.864 1.666 . . . . 0.0 112.25 170.494 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 35.2 mt -73.0 -39.66 65.85 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 118.934 -0.555 . . . . 0.0 109.794 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.46 -44.52 72.61 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.441 1.096 . . . . 0.0 113.295 178.905 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -65.71 -49.8 67.18 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 120.007 1.276 . . . . 0.0 112.615 178.865 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.81 -44.99 83.98 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.46 1.027 . . . . 0.0 112.471 -179.46 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -64.84 -37.88 89.09 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.879 0.872 . . . . 0.0 110.714 176.605 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.9 -22.06 64.11 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 126.118 1.818 . . . . 0.0 114.102 176.996 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -115.75 23.5 12.25 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.129 1.372 . . . . 0.0 112.659 170.098 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 30.6 tp 76.53 -38.85 0.33 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 128.969 2.908 . . . . 0.0 112.92 171.205 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.6 m 160.96 -19.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.262 1 C-N-CA 132.312 4.245 . . . . 0.0 111.207 -170.389 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 93.59 -8.18 0.14 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 129.486 3.115 . . . . 0.0 113.533 175.96 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.1 p -66.85 41.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 C-N-CA 128.105 2.562 . . . . 0.0 116.646 -172.339 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER 71.09 13.5 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 C-N-CA 126.56 1.944 . . . . 0.0 112.371 174.138 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 88.91 95.13 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 130.111 3.364 . . . . 0.0 108.883 179.521 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.4 139.8 49.88 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.155 179.156 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.4 m -85.34 152.87 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 122.378 1.085 . . . . 0.0 111.492 179.239 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -79.84 12.35 2.72 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.472 1.509 . . . . 0.0 114.925 -168.749 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.9 m -104.29 47.35 0.88 Allowed 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.587 1.555 . . . . 0.0 109.863 -176.243 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -49.93 88.57 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 129.123 2.969 . . . . 0.0 113.14 -167.734 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -106.96 152.88 41.11 Favored Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 113.998 1.111 . . . . 0.0 113.998 -164.985 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -88.58 117.94 0.98 Allowed 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 122.087 1.858 . . . . 0.0 113.746 -175.24 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . 0.558 3.3 t 43.17 -179.18 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 111.344 -2.662 . . . . 0.0 113.854 -161.302 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 3.6 p -169.38 -16.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 CA-C-N 110.531 -3.031 . . . . 0.0 112.701 -155.855 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.48 110.26 7.64 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 166.037 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 81.85 -43.51 0.16 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.849 2.06 . . . . 0.0 112.338 177.082 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.545 0.76 0 C-N-CA 125.457 1.503 . . . . 0.0 113.945 -173.274 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.724 0 N-CA-C 116.154 1.909 . . . . 0.0 116.154 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 87.8 mt -119.73 -82.6 0.65 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.797 1.639 . . . . 0.0 109.18 171.712 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.28 -4.24 13.59 Favored 'General case' 0 CA--C 1.549 0.904 0 O-C-N 120.71 -1.244 . . . . 0.0 114.104 172.525 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.74 -43.74 13.11 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 120.597 -1.314 . . . . 0.0 109.038 163.078 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.12 -49.1 73.51 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.148 1.779 . . . . 0.0 111.21 -174.539 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.56 -7.27 46.34 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 123.866 0.746 . . . . 0.0 114.443 172.618 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.38 -45.22 9.63 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.158 1.383 . . . . 0.0 108.75 168.143 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.16 -42.35 76.03 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.187 1.795 . . . . 0.0 114.446 -176.867 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -39.54 94.49 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.147 0.979 . . . . 0.0 111.29 178.59 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -98.37 -2.99 37.97 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.929 1.291 . . . . 0.0 114.449 -173.415 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.435 ' CG ' ' HD2' ' B' ' 21' ' ' PRO . 0.3 OUTLIER -55.12 147.72 33.45 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 125.623 1.569 . . . . 0.0 112.525 177.882 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . 0.468 ' HG2' ' H ' ' B' ' 22' ' ' THR . 41.0 Cg_endo -37.66 -69.89 0.07 OUTLIER 'Trans proline' 0 C--N 1.354 0.824 1 C-N-CA 127.416 5.411 . . . . 0.0 113.407 -167.629 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.468 ' H ' ' HG2' ' B' ' 21' ' ' PRO . 2.2 p -90.65 -20.7 22.22 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 125.863 1.665 . . . . 0.0 112.95 179.731 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 9.3 mtm-85 -66.34 -42.85 87.56 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 121.493 1.951 . . . . 0.0 111.848 177.266 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 40.5 t -54.61 -49.67 69.91 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.36 0.982 . . . . 0.0 110.97 169.88 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -58.05 -54.23 49.34 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.157 0.983 . . . . 0.0 112.65 177.178 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 4.4 mm -45.76 -54.02 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 126.221 1.808 . . . . 0.0 111.175 169.87 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 42.5 mt -68.3 -37.44 80.61 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 117.806 -1.093 . . . . 0.0 113.434 -173.72 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.1 p -76.2 -27.4 17.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 CA-C-N 119.731 1.151 . . . . 0.0 111.434 176.961 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.97 -23.06 52.34 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.107 0.963 . . . . 0.0 112.858 173.075 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 5.5 tp -73.5 -33.51 64.83 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 119.807 1.185 . . . . 0.0 113.76 171.187 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -45.52 -54.51 7.4 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.03 2.132 . . . . 0.0 113.299 -168.781 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -97.2 -11.42 24.26 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.415 1.486 . . . . 0.0 112.138 169.507 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -97.61 2.51 60.61 Favored Glycine 0 C--N 1.342 0.889 0 CA-C-O 116.64 -2.2 . . . . 0.0 118.235 -167.907 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 29.7 m -38.49 40.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.059 1 C-N-CA 131.81 4.044 . . . . 0.0 119.014 167.537 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 51.2 m -83.78 -74.5 0.37 Allowed 'General case' 0 C--O 1.223 -0.318 0 O-C-N 119.713 -1.867 . . . . 0.0 111.309 179.173 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.51 163.39 50.21 Favored Pre-proline 0 CA--C 1.547 0.829 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -169.889 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -63.1 130.18 28.12 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.158 1.906 . . . . 0.0 110.104 178.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.35 5.62 67.59 Favored Glycine 0 CA--C 1.538 1.49 0 CA-C-O 118.133 -1.371 . . . . 0.0 115.708 -178.304 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -25.2 64.43 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 120.124 1.962 . . . . 0.0 113.24 -177.457 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.8 mt -52.96 -20.1 3.13 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 125.946 1.698 . . . . 0.0 112.01 176.712 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.36 -30.44 70.53 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.312 0.645 . . . . 0.0 112.532 177.738 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.99 -50.82 11.38 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.39 0.676 . . . . 0.0 110.791 169.43 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -55.37 -38.38 68.76 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 -177.798 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.2 mt -96.83 -19.65 18.73 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.707 1.603 . . . . 0.0 112.756 -177.125 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.07 11.66 67.32 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-N 119.205 0.911 . . . . 0.0 113.2 -168.997 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 97.0 mt -102.13 141.11 35.5 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.115 1.366 . . . . 0.0 110.973 -174.276 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.0 t -57.69 143.09 42.94 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.158 0.98 . . . . 0.0 112.186 -171.23 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.94 -19.13 39.96 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.755 1.222 . . . . 0.0 113.634 -179.463 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 7.5 p -72.29 -62.8 1.31 Allowed 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.656 1.116 . . . . 0.0 109.255 166.904 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -46.99 -46.84 21.95 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.433 1.493 . . . . 0.0 113.658 176.091 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.87 -40.52 89.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 O-C-N 120.474 -1.391 . . . . 0.0 112.661 175.507 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.0 m -66.74 -37.81 85.38 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 118.588 0.631 . . . . 0.0 111.645 176.156 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 9.5 m-20 -58.96 -45.03 91.51 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.0 1.72 . . . . 0.0 112.19 173.322 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -64.63 -40.93 96.33 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 120.403 -1.435 . . . . 0.0 112.967 172.129 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 49.6 mt -67.3 -31.32 71.53 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 179.291 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 37.6 m -61.22 -28.11 68.92 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -178.569 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 47.8 t -71.36 -51.31 24.89 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.075 0.95 . . . . 0.0 110.747 169.379 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 4.5 mp -63.43 -40.3 96.81 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.389 2.275 . . . . 0.0 112.746 -171.957 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 60.7 mtm-85 -75.06 -5.7 45.53 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.593 1.157 . . . . 0.0 112.965 174.321 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -104.53 -38.07 2.68 Favored Glycine 0 N--CA 1.472 1.07 0 C-N-CA 124.718 1.151 . . . . 0.0 112.146 171.809 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 7.3 m -61.51 -6.94 2.69 Favored 'General case' 0 CA--C 1.56 1.353 0 C-N-CA 128.349 2.66 . . . . 0.0 113.409 169.471 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.02 13.66 62.21 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 125.217 1.389 . . . . 0.0 113.716 -175.561 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 83.6 mt -70.94 -26.12 63.04 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.593 1.196 . . . . 0.0 112.632 178.003 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.6 m -141.41 142.8 28.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.353 1.461 . . . . 0.0 111.558 -174.595 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 68.9 t -122.83 140.19 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 127.433 2.293 . . . . 0.0 109.253 -174.335 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -92.97 146.5 23.57 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.343 1.057 . . . . 0.0 112.425 170.126 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 2.4 m -167.47 168.42 12.97 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.079 2.151 . . . . 0.0 107.534 -172.888 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -81.19 155.35 26.2 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 174.746 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.04 -26.58 14.19 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.629 0.772 . . . . 0.0 109.144 162.28 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 141.19 -31.74 2.14 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 127.575 2.512 . . . . 0.0 113.738 171.412 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.58 -18.9 11.82 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 129.518 3.127 . . . . 0.0 112.503 178.604 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -150.72 167.71 26.55 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 129.696 3.198 . . . . 0.0 109.026 -179.576 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 14.3 m -85.1 165.31 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 O-C-N 121.666 -0.646 . . . . 0.0 111.087 167.544 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 21.6 ptt85 -138.11 167.91 20.82 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 127.07 2.148 . . . . 0.0 109.872 -179.438 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -119.02 133.03 56.07 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.738 1.215 . . . . 0.0 108.326 168.167 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -136.25 151.25 49.47 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.479 1.112 . . . . 0.0 109.82 179.097 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 13.0 mt -55.5 149.0 14.32 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 168.735 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.43 -36.59 82.89 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -169.903 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -162.34 163.37 27.95 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.624 1.57 . . . . 0.0 112.23 178.366 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 95.6 p -44.22 -32.47 1.27 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.109 2.564 . . . . 0.0 113.546 167.643 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -52.89 -49.71 65.34 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 125.245 1.418 . . . . 0.0 112.507 170.512 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 21.4 mt -72.47 -46.94 52.48 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.964 0.802 . . . . 0.0 109.636 179.11 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.17 -40.2 64.18 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 117.776 -1.107 . . . . 0.0 113.738 -177.041 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -69.48 -47.35 64.18 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 120.408 1.458 . . . . 0.0 113.385 178.248 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.1 -43.26 95.89 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 118.928 0.785 . . . . 0.0 111.192 -179.267 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.54 -52.3 64.18 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.776 1.63 . . . . 0.0 110.374 170.919 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.94 -14.03 58.1 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.812 1.196 . . . . 0.0 114.567 -176.048 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . 0.257 20.7 pt-20 -114.91 18.48 16.42 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 169.876 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 21.4 tp 63.66 2.12 1.2 Allowed 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 128.522 2.729 . . . . 0.0 115.361 167.269 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 1.7 t 74.31 33.47 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 126.586 1.954 . . . . 0.0 110.37 -171.511 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.419 ' C ' ' H ' ' B' ' 93' ' ' VAL . 0.8 OUTLIER 81.68 -14.07 0.83 Allowed 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 115.241 1.571 . . . . 0.0 115.241 118.417 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 13.1 p -67.46 39.09 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 129.558 3.143 . . . . 0.0 113.415 174.103 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . 0.419 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.2 OUTLIER 72.44 26.67 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 128.063 2.545 . . . . 0.0 113.182 177.001 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 84.36 90.15 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.77 2.028 . . . . 0.0 109.368 -177.724 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.47 149.52 45.89 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 114.521 -1.218 . . . . 0.0 113.421 178.517 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 30.2 m -56.91 156.05 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 125.625 1.57 . . . . 0.0 113.88 176.301 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . 0.423 ' C ' ' HG1' ' B' ' 98' ' ' THR . 24.0 t0 -83.16 64.22 7.58 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.54 1.136 . . . . 0.0 109.927 169.87 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 98' ' ' THR . . . . . 0.423 ' HG1' ' C ' ' B' ' 97' ' ' ASP . 41.8 m -160.09 148.09 16.77 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.579 1.551 . . . . 0.0 111.084 -174.062 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -116.8 137.82 51.93 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.831 1.652 . . . . 0.0 107.44 166.222 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . 0.402 HE21 ' CG2' ' B' ' 98' ' ' THR . 1.7 tp-100 -160.95 170.49 8.36 Favored Pre-proline 0 CA--C 1.557 1.233 0 CA-C-O 117.386 -1.292 . . . . 0.0 111.38 -167.566 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -95.36 120.22 0.26 Allowed 'Trans proline' 0 C--N 1.358 1.064 0 CA-C-N 122.315 1.863 . . . . 0.0 116.549 -167.27 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 28.7 t 45.68 -113.03 0.38 Allowed 'General case' 0 C--N 1.347 0.489 0 N-CA-C 105.279 -2.119 . . . . 0.0 105.279 -163.703 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 5.4 p 165.71 -33.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.843 0 C-N-CA 130.313 3.445 . . . . 0.0 111.758 168.758 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.42 123.73 15.71 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.29 0.95 . . . . 0.0 111.077 178.376 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 69.2 -49.21 0.6 Allowed 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 128.681 2.792 . . . . 0.0 113.019 -174.156 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.656 0 CA-C-O 123.157 1.456 . . . . 0.0 113.711 -170.001 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.351 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.71 -38.2 66.77 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.596 0.759 . . . . 0.0 111.317 168.801 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.79 -18.22 60.5 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.281 1.832 . . . . 0.0 113.946 179.504 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.31 -57.23 3.46 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.464 1.105 . . . . 0.0 109.195 167.402 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -55.25 -63.53 1.13 Allowed 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 126.645 1.978 . . . . 0.0 110.331 -174.225 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -60.81 -36.21 91.5 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.641 -0.583 . . . . 0.0 111.641 -172.281 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 16.3 ttt85 -67.33 -50.97 57.88 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.839 0.856 . . . . 0.0 111.226 179.761 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.85 -27.02 67.79 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 176.641 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.4 mp -90.98 -12.47 35.81 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.447 1.099 . . . . 0.0 113.567 174.282 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.56 -20.15 40.52 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.7 1.2 . . . . 0.0 114.058 169.888 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -72.63 140.41 81.57 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 126.835 2.054 . . . . 0.0 109.424 174.261 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.4 ' HG2' ' H ' ' A' ' 22' ' ' THR . 71.7 Cg_endo -53.03 -84.89 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.647 1 C-N-CA 126.696 4.931 . . . . 0.0 113.738 -166.621 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.4 ' H ' ' HG2' ' A' ' 21' ' ' PRO . 52.1 m -70.3 -15.43 62.89 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 124.551 1.141 . . . . 0.0 111.134 -179.701 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -68.63 -40.2 80.42 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 120.378 -1.452 . . . . 0.0 113.312 -177.854 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 13.2 t -59.28 -40.21 85.38 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 121.806 0.812 . . . . 0.0 110.806 169.432 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.4 mmp_? -66.64 -41.27 88.54 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 172.879 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 5.1 mm -50.63 -44.38 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 120.077 -1.639 . . . . 0.0 111.412 171.328 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.26 -24.95 67.46 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 175.28 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -78.66 -29.51 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 124.77 1.228 . . . . 0.0 112.729 171.25 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.89 -32.46 63.6 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.494 0.717 . . . . 0.0 112.717 178.855 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -85.92 -10.42 55.26 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 173.226 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.07 -23.52 63.83 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-O 119.505 -0.283 . . . . 0.0 111.401 165.622 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -124.19 -59.52 1.48 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 127.768 2.427 . . . . 0.0 114.564 -171.92 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.05 -74.77 0.63 Allowed Glycine 0 N--CA 1.468 0.818 0 C-N-CA 125.354 1.455 . . . . 0.0 113.226 -165.86 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.9 m 45.88 33.66 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 C-N-CA 125.851 1.66 . . . . 0.0 113.815 -179.001 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.2 m -82.61 -51.63 7.57 Favored 'General case' 0 C--O 1.226 -0.157 0 O-C-N 120.932 -1.105 . . . . 0.0 112.046 -175.56 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 50.3 p90 -165.69 157.2 12.42 Favored Pre-proline 0 N--CA 1.477 0.894 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -169.78 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -61.73 104.43 0.32 Allowed 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 123.868 3.045 . . . . 0.0 110.128 173.937 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 113.86 -11.5 22.87 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-O 118.021 -1.433 . . . . 0.0 114.651 -175.01 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.72 -34.08 69.11 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.651 2.226 . . . . 0.0 111.349 175.079 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.579 HD13 ' H ' ' A' ' 40' ' ' LEU . 0.5 OUTLIER -62.8 -21.06 65.61 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 126.22 1.808 . . . . 0.0 111.985 -178.317 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.19 -30.02 69.02 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.431 0.692 . . . . 0.0 111.786 -179.581 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.37 -44.85 61.97 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.527 0.331 . . . . 0.0 110.344 169.87 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -62.59 -35.53 79.82 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -179.174 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.0 mt -103.27 -16.38 15.69 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -174.363 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.56 -2.08 54.99 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-O 118.072 -1.404 . . . . 0.0 114.341 -175.409 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 mp -105.6 148.43 27.32 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.561 1.68 . . . . 0.0 110.947 177.23 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.458 HG22 ' H ' ' A' ' 50' ' ' ASN . 13.5 t -54.83 151.24 8.77 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.356 1.063 . . . . 0.0 113.005 -173.252 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -50.13 -23.25 2.04 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.054 1.741 . . . . 0.0 113.839 169.498 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 14.7 m -69.22 -56.99 5.96 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.461 1.028 . . . . 0.0 111.85 170.395 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.458 ' H ' HG22 ' A' ' 47' ' ' THR . 16.0 t-20 -61.9 -42.85 99.56 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.461 1.028 . . . . 0.0 112.074 176.113 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.5 t -53.26 -48.16 55.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 123.834 0.854 . . . . 0.0 111.166 172.01 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 51.1 m -66.26 -35.96 81.75 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 177.559 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -60.4 -52.46 65.13 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.006 0.922 . . . . 0.0 110.097 176.579 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -68.36 -27.38 66.2 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 120.332 -1.48 . . . . 0.0 113.777 176.648 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 36.4 mt -70.42 -20.86 62.89 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 120.378 1.444 . . . . 0.0 113.311 167.862 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.2 t -63.19 -51.81 64.86 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 120.189 1.359 . . . . 0.0 112.973 -169.175 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 42.0 t -54.74 -51.25 66.25 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 123.956 1.836 . . . . 0.0 110.018 174.822 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -48.36 -41.48 28.8 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 130.797 3.639 . . . . 0.0 113.628 -177.081 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 80.1 mtm-85 -78.86 -24.14 44.52 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 179.423 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.12 -54.69 2.1 Favored Glycine 0 N--CA 1.471 0.974 0 CA-C-N 119.181 0.9 . . . . 0.0 111.271 177.78 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 73.0 m -67.29 -3.69 8.69 Favored 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 127.119 2.168 . . . . 0.0 112.135 -178.853 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 86.01 10.57 74.99 Favored Glycine 0 C--N 1.34 0.792 0 C-N-CA 127.293 2.378 . . . . 0.0 116.304 164.791 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.8 mt -70.56 -22.75 62.56 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 119.6 1.7 . . . . 0.0 113.127 178.024 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.8 m -133.53 156.13 41.2 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 126.952 2.101 . . . . 0.0 113.088 171.454 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.3 t -133.47 153.44 37.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 127.744 2.418 . . . . 0.0 109.748 -179.57 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.52 145.65 26.02 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.822 1.649 . . . . 0.0 112.512 175.224 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.413 ' HB ' ' HG2' ' A' ' 74' ' ' ARG . 9.6 m -140.86 144.66 35.43 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.677 1.191 . . . . 0.0 109.285 -177.836 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -80.75 115.86 20.46 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.985 0.421 . . . . 0.0 110.803 167.89 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -88.54 166.08 14.41 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.25 1.42 . . . . 0.0 110.531 168.854 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -66.69 15.28 0.32 Allowed Glycine 0 N--CA 1.481 1.677 0 N-CA-C 117.035 1.574 . . . . 0.0 117.035 -169.59 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.61 -1.13 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.831 2.053 . . . . 0.0 114.185 178.229 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -168.55 164.8 12.49 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 126.172 1.789 . . . . 0.0 108.783 -168.959 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 34.5 m -94.68 156.42 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 CA-C-N 119.856 1.207 . . . . 0.0 110.626 168.834 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.413 ' HG2' ' HB ' ' A' ' 67' ' ' THR . 9.8 ptt180 -127.26 178.34 6.11 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.379 1.071 . . . . 0.0 112.65 -179.424 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -124.7 128.82 49.4 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.367 1.467 . . . . 0.0 108.384 165.236 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.02 157.43 41.73 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.291 1.037 . . . . 0.0 109.946 173.83 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.61 153.6 42.65 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.339 0.518 . . . . 0.0 109.813 170.968 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.02 -36.18 79.52 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -168.584 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -158.71 158.81 34.42 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 123.378 1.561 . . . . 0.0 113.244 176.641 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -35.21 -39.23 0.11 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 130.25 3.42 . . . . 0.0 112.701 165.724 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -44.29 -66.12 0.43 Allowed 'General case' 0 C--N 1.342 0.275 0 C-N-CA 127.862 2.465 . . . . 0.0 112.647 169.519 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.2 pp -79.39 -25.39 42.15 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 118.576 -0.726 . . . . 0.0 112.626 -172.502 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.48 -45.77 89.23 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 122.71 0.404 . . . . 0.0 110.428 167.855 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 24.7 ttp85 -62.87 -54.0 45.54 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.618 1.167 . . . . 0.0 111.968 178.063 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.48 -35.97 79.14 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -175.707 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.25 -42.02 66.12 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.567 -0.708 . . . . 0.0 111.009 172.894 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.05 -43.88 98.16 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.824 1.678 . . . . 0.0 114.585 -178.409 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -76.06 -2.02 28.75 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.556 1.142 . . . . 0.0 113.482 174.263 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.422 ' C ' ' H ' ' A' ' 91' ' ' GLN . 34.2 tp 76.08 124.8 0.04 OUTLIER 'General case' 0 C--N 1.345 0.378 0 C-N-CA 130.136 3.374 . . . . 0.0 110.914 168.473 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 46.4 t -75.62 21.69 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 CA-C-O 123.465 1.602 . . . . 0.0 112.233 -169.521 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.422 ' H ' ' C ' ' A' ' 89' ' ' LEU . 1.2 tp-100 84.99 -12.63 0.71 Allowed 'General case' 0 C--O 1.219 -0.534 0 O-C-N 120.038 -1.664 . . . . 0.0 111.467 130.662 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 12.7 p -68.35 46.81 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 C-N-CA 129.75 3.22 . . . . 0.0 111.14 164.672 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 69.71 -42.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 C-N-CA 130.486 3.514 . . . . 0.0 112.806 -169.893 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.1 tt 168.14 104.69 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 130.674 3.59 . . . . 0.0 106.03 -169.486 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.98 82.57 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.122 0 O-C-N 121.285 -0.885 . . . . 0.0 112.147 169.163 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 18.0 m -45.21 163.41 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 130.302 3.441 . . . . 0.0 116.788 -178.482 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -90.62 73.12 6.79 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.311 1.444 . . . . 0.0 109.263 166.444 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . 0.261 0.3 OUTLIER 172.8 138.83 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 128.477 2.711 . . . . 0.0 112.836 168.454 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -88.34 26.56 1.4 Allowed 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 130.526 3.53 . . . . 0.0 113.34 -171.244 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -33.43 134.82 0.32 Allowed Pre-proline 0 N--CA 1.483 1.176 0 C-N-CA 126.529 1.932 . . . . 0.0 112.821 -174.801 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -60.24 149.14 87.08 Favored 'Trans proline' 0 C--N 1.355 0.9 1 C-N-CA 126.12 4.546 . . . . 0.0 118.997 -164.94 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.12 121.6 15.97 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.286 1.434 . . . . 0.0 109.551 170.135 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 9.5 p -105.59 -38.91 4.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 -165.825 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -87.5 -7.91 57.04 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.738 1.154 . . . . 0.0 113.936 177.912 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.424 ' CD ' HH22 ' B' ' 23' ' ' ARG . 17.0 mt-10 -127.24 124.41 38.83 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 125.288 1.435 . . . . 0.0 108.289 170.315 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? . . . . . 0 CA--C 1.535 0.387 0 C-N-CA 124.928 1.291 . . . . 0.0 111.241 -168.669 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.456 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -54.29 -42.93 70.61 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.844 0.858 . . . . 0.0 112.065 169.992 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.26 -17.06 63.1 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.451 1.501 . . . . 0.0 112.967 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.43 -55.33 4.21 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.928 0.891 . . . . 0.0 110.216 167.439 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -54.93 -61.72 2.13 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.47 1.508 . . . . 0.0 110.716 -176.136 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.61 -38.63 95.93 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 111.781 -0.528 . . . . 0.0 111.781 -170.68 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 14.2 ttm105 -60.49 -48.51 81.46 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.704 1.602 . . . . 0.0 111.108 176.547 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.16 -29.94 69.78 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 177.51 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.0 mp -88.84 -8.0 55.11 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 113.858 1.058 . . . . 0.0 113.858 175.614 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -88.22 -15.64 35.39 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.637 1.575 . . . . 0.0 114.362 172.803 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -78.0 146.0 70.81 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 126.301 1.84 . . . . 0.0 110.825 174.33 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -59.13 -82.03 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.67 1 C-N-CA 126.474 4.783 . . . . 0.0 112.55 -168.974 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 5.7 m -59.42 -29.58 67.86 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.155 0.982 . . . . 0.0 111.114 176.48 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . 0.424 HH22 ' CD ' ' A' ' 105' ' ' GLU . 11.0 ttm180 -66.74 -41.03 88.5 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -171.444 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 5.3 t -57.78 -47.24 83.12 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-O 122.238 1.018 . . . . 0.0 110.152 169.565 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . 0.445 HH11 ' CG ' ' B' ' 97' ' ' ASP . 11.2 mmp_? -63.05 -36.43 83.55 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.561 1.689 . . . . 0.0 115.561 175.911 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 4.8 mm -49.64 -41.4 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 120.319 -1.488 . . . . 0.0 111.91 173.283 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 83.0 mt -72.67 -29.62 63.57 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 112.808 0.669 . . . . 0.0 112.808 176.434 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -78.19 -25.59 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 O-C-N 120.585 -1.322 . . . . 0.0 112.096 176.46 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.77 -57.61 4.9 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.495 1.518 . . . . 0.0 108.822 168.337 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 10.4 mt -61.24 -23.38 65.6 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 117.163 2.282 . . . . 0.0 117.163 -176.126 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -42.5 -32.74 0.58 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 125.951 1.701 . . . . 0.0 112.109 168.427 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -120.05 -30.24 4.73 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 128.278 2.631 . . . . 0.0 112.324 168.563 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.8 21.55 1.58 Allowed Glycine 0 N--CA 1.465 0.633 0 C-N-CA 128.819 3.104 . . . . 0.0 115.39 -164.66 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 13.3 m -64.87 29.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 C-N-CA 127.371 2.268 . . . . 0.0 114.613 173.818 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -85.17 -64.16 1.2 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.382 1.073 . . . . 0.0 111.457 -176.753 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 55.4 p90 -165.84 154.71 10.47 Favored Pre-proline 0 CA--C 1.545 0.751 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 -170.007 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -58.45 118.74 5.68 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 123.207 2.605 . . . . 0.0 109.894 175.971 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 94.22 -8.94 72.55 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-O 117.619 -1.656 . . . . 0.0 114.899 -174.64 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . 0.407 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -56.67 -36.73 69.92 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 120.918 2.359 . . . . 0.0 110.545 172.855 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.577 HD13 ' H ' ' B' ' 40' ' ' LEU . 0.4 OUTLIER -61.6 -19.09 61.84 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 126.14 1.776 . . . . 0.0 112.361 -175.688 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.87 -31.27 71.76 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.145 0.578 . . . . 0.0 111.826 176.447 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.37 -43.81 59.9 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.661 0.384 . . . . 0.0 110.824 170.585 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . 0.407 ' CD2' HE22 ' B' ' 39' ' ' GLN . 2.7 m-70 -63.44 -33.41 75.51 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 179.909 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 36.1 mt -104.35 -18.37 14.46 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.558 1.143 . . . . 0.0 113.725 -174.761 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.94 -0.72 61.48 Favored Glycine 0 CA--C 1.526 0.747 0 CA-C-O 118.156 -1.358 . . . . 0.0 113.756 -174.216 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 8.3 mp -107.2 143.32 35.59 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.031 1.415 . . . . 0.0 110.834 177.213 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 47' ' ' THR . . . . . 0.468 HG22 ' H ' ' B' ' 50' ' ' ASN . 9.8 t -51.35 149.97 3.78 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 126.189 1.796 . . . . 0.0 113.461 -173.295 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -49.12 -22.33 0.93 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.397 1.879 . . . . 0.0 113.458 169.372 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.4 m -67.22 -63.64 1.02 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.59 1.156 . . . . 0.0 112.374 169.516 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . 0.468 ' H ' HG22 ' B' ' 47' ' ' THR . 28.4 t-20 -65.04 -36.65 85.03 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.75 -1.219 . . . . 0.0 112.404 178.211 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.3 t -54.58 -48.79 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 122.963 0.505 . . . . 0.0 110.422 168.71 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.9 m -66.61 -38.81 87.76 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 117.809 -1.091 . . . . 0.0 113.926 177.508 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -54.36 -54.52 39.37 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.107 0.867 . . . . 0.0 109.692 174.57 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -70.9 -25.18 62.66 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.792 -1.193 . . . . 0.0 113.439 -178.872 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 32.0 mt -68.61 -25.52 64.89 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.436 1.471 . . . . 0.0 112.954 167.424 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.0 t -58.99 -55.79 30.65 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 119.983 1.265 . . . . 0.0 112.976 -169.44 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 40.5 t -53.46 -52.64 58.84 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 122.387 1.089 . . . . 0.0 109.476 172.655 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.4 tp -47.63 -38.16 14.14 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 128.293 2.637 . . . . 0.0 113.886 -174.291 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 25.2 mtm-85 -83.99 -32.62 24.88 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 119.684 1.129 . . . . 0.0 113.73 -179.211 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -83.3 -45.88 6.37 Favored Glycine 0 N--CA 1.467 0.755 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 -179.82 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 80.3 m -74.5 5.91 4.26 Favored 'General case' 0 CA--C 1.563 1.46 0 C-N-CA 127.484 2.313 . . . . 0.0 111.628 177.746 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.56 -6.46 83.38 Favored Glycine 0 C--N 1.344 1.01 0 C-N-CA 128.301 2.858 . . . . 0.0 119.078 165.594 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 59.9 mt -66.99 -26.93 67.05 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 119.366 1.583 . . . . 0.0 113.785 -172.713 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 11.1 m -132.01 161.09 41.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 126.767 2.027 . . . . 0.0 113.238 177.26 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 76.4 t -139.93 146.73 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 128.232 2.613 . . . . 0.0 109.877 -169.202 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -96.37 138.08 34.49 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.994 1.318 . . . . 0.0 111.605 170.493 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 9.5 m -146.88 147.19 30.56 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.097 1.359 . . . . 0.0 108.522 -174.465 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -77.11 138.03 39.28 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 175.778 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -112.17 164.71 12.88 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.385 1.874 . . . . 0.0 111.436 169.181 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.9 14.16 0.3 Allowed Glycine 0 N--CA 1.48 1.627 0 N-CA-C 117.271 1.669 . . . . 0.0 117.271 -168.952 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.92 -0.77 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.95 2.1 . . . . 0.0 113.849 178.907 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -168.79 167.08 11.3 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 126.561 1.945 . . . . 0.0 108.949 -168.225 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 35.2 m -93.74 159.34 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 119.818 1.19 . . . . 0.0 110.605 168.246 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 5.2 ptt180 -121.9 171.4 8.95 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 122.363 1.078 . . . . 0.0 112.508 178.154 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -119.94 112.62 19.41 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.469 -2.049 . . . . 0.0 105.469 165.227 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -110.14 167.58 10.07 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.599 1.16 . . . . 0.0 110.147 174.458 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -85.82 150.9 24.23 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 169.678 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.21 -50.47 69.31 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -168.411 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -153.34 160.35 42.66 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 123.275 1.512 . . . . 0.0 112.921 -178.822 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -35.34 -40.5 0.15 Allowed 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 129.657 3.183 . . . . 0.0 111.671 165.521 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -42.75 -68.22 0.21 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.469 2.308 . . . . 0.0 112.397 169.184 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 2.3 pp -79.04 -22.98 44.61 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -172.418 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.22 -44.51 91.69 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 122.892 0.477 . . . . 0.0 110.606 166.937 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 28.6 ttp85 -64.44 -51.61 62.23 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.132 1.773 . . . . 0.0 112.6 178.835 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.31 -41.61 80.23 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.983 0.81 . . . . 0.0 112.691 -179.857 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.6 -41.53 72.17 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 118.79 -0.624 . . . . 0.0 111.038 176.263 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.87 -44.65 95.8 Favored Glycine 0 CA--C 1.533 1.189 0 C-N-CA 125.42 1.486 . . . . 0.0 114.389 179.571 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -76.93 -2.3 33.0 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.82 1.248 . . . . 0.0 113.129 172.982 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . 0.472 ' C ' ' H ' ' B' ' 91' ' ' GLN . 44.7 tp 70.65 112.09 0.05 Allowed 'General case' 0 C--N 1.341 0.224 0 C-N-CA 129.679 3.192 . . . . 0.0 111.992 168.409 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.4 t -69.97 26.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 C-N-CA 127.198 2.199 . . . . 0.0 113.232 -176.167 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.472 ' H ' ' C ' ' B' ' 89' ' ' LEU . 1.8 tp-100 89.02 -14.24 0.35 Allowed 'General case' 0 N--CA 1.468 0.47 0 O-C-N 119.623 -1.923 . . . . 0.0 113.226 119.046 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 11.5 p -63.95 39.69 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 130.306 3.443 . . . . 0.0 113.633 169.321 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 63.41 24.53 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 127.244 2.218 . . . . 0.0 112.823 -175.742 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 98.49 112.48 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 129.928 3.291 . . . . 0.0 107.947 -173.443 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.49 78.53 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.866 0.866 . . . . 0.0 111.057 168.139 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 10.3 m -42.8 155.62 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 130.336 3.455 . . . . 0.0 116.764 -177.64 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . 0.445 ' CG ' HH11 ' B' ' 25' ' ' ARG . 19.4 m-20 -85.9 68.44 10.34 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.07 1.348 . . . . 0.0 110.647 167.873 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 174.68 126.29 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 128.706 2.803 . . . . 0.0 111.396 168.936 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -72.72 40.36 0.09 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 130.156 3.382 . . . . 0.0 113.72 178.218 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -36.37 132.85 0.62 Allowed Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 127.165 2.186 . . . . 0.0 111.545 -178.933 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -67.04 155.94 68.56 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 124.074 3.183 . . . . 0.0 115.675 -166.327 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.86 145.85 53.35 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 126.059 1.744 . . . . 0.0 111.797 177.675 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 48.2 t -95.46 -68.79 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.651 1.18 . . . . 0.0 112.55 -175.636 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -85.57 -7.86 58.62 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.813 2.153 . . . . 0.0 116.813 -168.137 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -131.89 139.78 48.87 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.454 1.102 . . . . 0.0 109.53 -178.135 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? . . . . . 0 N--CA 1.468 0.445 0 C-N-CA 123.523 0.729 . . . . 0.0 112.176 -169.697 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 pp -51.66 -39.2 57.76 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.786 1.634 . . . . 0.0 115.201 -170.427 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.84 -58.14 6.98 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 118.755 0.707 . . . . 0.0 111.724 175.639 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -62.28 -30.37 71.09 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 121.415 -0.803 . . . . 0.0 111.993 179.222 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -61.71 -43.41 98.91 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.798 1.639 . . . . 0.0 111.381 170.019 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -59.75 -29.25 66.93 Favored Glycine 0 N--CA 1.474 1.21 0 CA-C-N 119.548 1.067 . . . . 0.0 113.184 175.264 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.19 -27.37 64.45 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.085 0.954 . . . . 0.0 112.116 173.333 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.01 -26.13 62.1 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 120.104 1.32 . . . . 0.0 111.643 172.753 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.4 mp -83.21 -28.61 29.14 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.005 0.522 . . . . 0.0 111.389 172.71 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.7 -10.61 57.34 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 117.021 2.23 . . . . 0.0 117.021 -179.278 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.67 156.83 21.76 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 128.048 2.539 . . . . 0.0 114.098 -173.602 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.526 ' HG2' ' H ' ' A' ' 22' ' ' THR . 58.3 Cg_endo -53.65 -76.65 0.02 OUTLIER 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 124.532 3.488 . . . . 0.0 111.345 169.554 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.526 ' H ' ' HG2' ' A' ' 21' ' ' PRO . 57.9 m -87.37 -28.01 22.45 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 116.145 -1.883 . . . . 0.0 112.36 -172.528 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.432 ' HG3' ' HD1' ' A' ' 54' ' ' HIS . 44.3 mtt85 -64.15 -39.55 94.25 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 122.666 2.484 . . . . 0.0 111.589 172.668 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 15.2 t -57.66 -40.57 79.63 Favored 'General case' 0 CA--C 1.552 1.019 0 CA-C-N 121.466 1.939 . . . . 0.0 111.944 170.618 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -60.91 -55.82 28.49 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 121.129 -0.982 . . . . 0.0 112.081 173.688 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.4 mm -52.84 -42.82 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.96 1.704 . . . . 0.0 110.767 176.265 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 49.5 mt -68.21 -43.15 78.65 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.822 0.849 . . . . 0.0 112.869 178.714 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.2 p -68.37 -26.43 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 119.977 1.262 . . . . 0.0 111.806 177.471 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.66 1.67 9.73 Favored 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 127.242 2.217 . . . . 0.0 115.023 170.444 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 95.2 mt -99.23 -25.36 14.53 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.413 -1.429 . . . . 0.0 114.768 173.439 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.4 mt -59.4 -24.02 63.09 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.629 -1.169 . . . . 0.0 111.873 171.638 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 45.7 p-10 -132.25 -28.16 1.73 Allowed 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 116.036 1.865 . . . . 0.0 116.036 -175.179 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.86 -69.35 1.41 Allowed Glycine 0 C--N 1.343 0.945 0 CA-C-N 119.436 1.017 . . . . 0.0 113.221 -168.874 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 33.4 m 33.42 23.57 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 129.746 3.218 . . . . 0.0 119.14 174.88 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 69.2 m -86.08 -76.47 0.34 Allowed 'General case' 0 C--N 1.331 -0.204 0 O-C-N 121.01 -1.056 . . . . 0.0 109.764 177.608 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -137.04 157.1 75.24 Favored Pre-proline 0 N--CA 1.479 0.977 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -168.606 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -56.47 127.29 25.33 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.17 2.58 . . . . 0.0 110.535 173.327 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.05 -2.74 59.86 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-O 118.218 -1.324 . . . . 0.0 115.443 -178.292 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.79 -25.76 68.39 Favored 'General case' 0 N--CA 1.484 1.225 0 CA-C-N 120.46 2.13 . . . . 0.0 112.689 178.325 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.1 -12.27 3.31 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.507 1.123 . . . . 0.0 111.519 178.117 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.36 -38.56 91.62 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.988 1.315 . . . . 0.0 113.381 173.335 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.79 -37.98 70.33 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.586 0.63 . . . . 0.0 111.091 173.391 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -67.86 -47.73 68.09 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.209 1.004 . . . . 0.0 113.213 -178.987 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.2 mt -86.09 -11.92 51.46 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.539 1.136 . . . . 0.0 113.102 -178.659 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.31 -2.62 13.9 Favored Glycine 0 CA--C 1.537 1.444 0 C-N-CA 124.129 0.871 . . . . 0.0 113.728 -169.58 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.0 mt -81.9 153.52 26.29 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.618 1.167 . . . . 0.0 110.942 -176.712 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.3 t -61.23 142.38 56.84 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.362 -0.836 . . . . 0.0 110.62 171.499 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.9 ptp180 -56.78 -23.79 45.82 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 118.685 -0.674 . . . . 0.0 112.667 178.366 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.0 m -66.04 -48.03 72.41 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.27 1.028 . . . . 0.0 113.258 170.862 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -65.71 -41.21 92.58 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.041 1.336 . . . . 0.0 110.672 176.868 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 19.4 t -55.28 -49.9 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 123.654 0.781 . . . . 0.0 111.025 168.977 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 27.2 p -66.43 -36.15 82.1 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 120.31 1.414 . . . . 0.0 114.51 175.496 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -64.4 -45.28 88.3 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.31 1.444 . . . . 0.0 110.643 179.227 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . 0.432 ' HD1' ' HG3' ' A' ' 23' ' ' ARG . 26.2 m-70 -72.72 -35.35 67.55 Favored 'General case' 0 CA--C 1.558 1.281 0 CA-C-O 117.264 -1.35 . . . . 0.0 113.111 171.282 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.3 mt -63.11 -33.0 74.51 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 121.777 2.08 . . . . 0.0 113.719 173.259 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.3 m -55.42 -52.28 64.11 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.194 0.906 . . . . 0.0 113.405 -169.838 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 50.9 t -63.38 -40.29 96.86 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 122.933 0.493 . . . . 0.0 111.201 172.545 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.8 tp -58.86 -28.26 65.93 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.765 2.026 . . . . 0.0 112.908 -172.348 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 26.9 mtm180 -71.48 -38.9 71.18 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.9 0.88 . . . . 0.0 112.359 171.29 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -78.74 -36.12 29.98 Favored Glycine 0 N--CA 1.468 0.781 0 C-N-CA 125.883 1.706 . . . . 0.0 111.635 -176.721 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 36.3 m -61.86 -12.79 19.37 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 128.149 2.58 . . . . 0.0 112.865 167.28 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 81.87 -10.02 53.97 Favored Glycine 0 C--N 1.342 0.904 0 C-N-CA 126.957 2.218 . . . . 0.0 113.404 -179.033 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.0 mt -63.73 -33.03 74.73 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 127.496 2.318 . . . . 0.0 113.936 -169.902 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.22 133.3 59.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.599 1.56 . . . . 0.0 109.101 166.833 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.8 t -121.79 133.06 69.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 124.971 1.308 . . . . 0.0 109.574 172.324 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.03 142.56 50.91 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 114.746 -1.115 . . . . 0.0 111.979 170.121 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.1 m -162.92 158.96 23.09 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.098 1.759 . . . . 0.0 106.944 -174.303 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -91.46 145.61 24.48 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.73 1.15 . . . . 0.0 113.206 178.302 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -111.39 -166.79 1.11 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.284 1.834 . . . . 0.0 109.85 168.79 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -72.02 -8.1 68.32 Favored Glycine 0 CA--C 1.537 1.417 0 O-C-N 120.498 -1.376 . . . . 0.0 116.457 -169.39 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.03 -31.28 0.77 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.326 1.85 . . . . 0.0 113.091 177.667 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.25 -175.79 4.97 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.942 1.246 . . . . 0.0 112.929 -172.642 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 8.1 p -79.81 146.96 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 123.842 0.857 . . . . 0.0 110.792 168.858 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -128.79 162.7 26.83 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 127.657 2.383 . . . . 0.0 111.091 -179.202 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -110.59 120.42 42.35 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.409 1.084 . . . . 0.0 108.919 168.262 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -121.46 168.62 11.49 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.881 1.272 . . . . 0.0 110.461 174.985 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 17.6 mt -58.64 155.44 12.54 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 172.642 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -48.04 -40.7 23.69 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.155 1.782 . . . . 0.0 114.342 -178.457 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -174.52 169.42 3.69 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.578 1.951 . . . . 0.0 110.982 -174.387 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 88.0 p -46.57 -34.75 5.18 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 127.372 2.269 . . . . 0.0 113.605 169.271 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 62.1 m-70 -54.23 -53.47 53.16 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 125.525 1.53 . . . . 0.0 112.221 176.203 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 28.2 mt -73.15 -37.1 66.73 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 118.219 -0.895 . . . . 0.0 110.61 -179.968 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.2 -50.76 64.03 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 118.913 0.779 . . . . 0.0 111.495 179.089 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -75.64 -32.23 60.15 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.49 1.041 . . . . 0.0 113.611 -179.274 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.18 -44.72 83.2 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.764 1.166 . . . . 0.0 112.576 176.298 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.01 -38.43 75.93 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.931 0.892 . . . . 0.0 110.694 174.63 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.16 -35.43 91.96 Favored Glycine 0 CA--C 1.529 0.907 0 O-C-N 121.418 -0.801 . . . . 0.0 112.225 176.884 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -83.15 9.57 10.21 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.865 1.266 . . . . 0.0 114.093 170.148 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.7 tp 66.52 -18.48 0.11 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 130.785 3.634 . . . . 0.0 117.525 164.041 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.27 34.3 m 118.71 20.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.138 1 C-N-CA 134.938 5.295 . . . . 0.0 112.152 178.219 . . . . . . . . 3 2 . 1 . 026 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.4 ' HB3' ' CG ' ' B' ' 81' ' ' HIS . 25.4 mm-40 79.63 -33.43 0.14 Allowed 'General case' 0 CA--C 1.539 0.524 0 O-C-N 120.176 -1.578 . . . . 0.0 114.127 162.945 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.8 p -57.34 16.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 C-N-CA 129.835 3.254 . . . . 0.0 117.572 -175.206 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.4 t 69.54 27.37 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 C-N-CA 125.218 1.407 . . . . 0.0 111.446 169.036 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.6 tp 80.13 96.94 0.06 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 129.53 3.132 . . . . 0.0 111.855 -173.805 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -87.69 114.76 24.61 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 120.887 -1.133 . . . . 0.0 109.045 170.021 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.3 m -141.82 142.99 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 127.528 2.331 . . . . 0.0 108.891 170.397 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.79 127.45 32.27 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.729 1.612 . . . . 0.0 109.688 170.818 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 2.7 m -179.88 -57.96 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 126.867 2.067 . . . . 0.0 109.138 -168.824 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.1 t0 176.19 56.44 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 131.235 3.814 . . . . 0.0 108.065 175.322 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -111.12 -163.2 0.05 OUTLIER Pre-proline 0 CA--C 1.555 1.139 0 C-N-CA 127.912 2.485 . . . . 0.0 110.543 -168.282 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -73.56 -159.57 0.08 OUTLIER 'Trans proline' 0 CA--C 1.55 1.282 0 CA-C-N 122.664 1.987 . . . . 0.0 112.928 177.021 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . 0.449 0.5 OUTLIER 48.9 36.57 8.48 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 130.84 3.656 . . . . 0.0 117.402 -169.451 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 1.4 p -57.2 -40.13 71.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 126.997 2.119 . . . . 0.0 112.87 166.148 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.74 166.11 21.61 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.026 0.93 . . . . 0.0 112.103 -173.546 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -72.47 142.34 48.59 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 115.22 1.563 . . . . 0.0 115.22 -169.189 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.589 0 C-N-CA 127.406 2.282 . . . . 0.0 114.355 -172.016 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.603 0 CA-C-O 121.345 0.593 . . . . 0.0 111.429 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 pp -48.19 -36.46 13.69 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 126.589 1.956 . . . . 0.0 114.708 -177.612 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.23 -43.27 95.47 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.61 0.641 . . . . 0.0 111.506 177.299 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 25.6 ttp85 -64.95 -20.26 66.38 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.471 -1.393 . . . . 0.0 112.532 174.885 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.2 -38.22 85.79 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.802 1.637 . . . . 0.0 111.078 169.016 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -60.82 -25.52 63.92 Favored Glycine 0 CA--C 1.533 1.178 0 O-C-N 121.005 -1.059 . . . . 0.0 112.989 174.534 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 29.0 ttt-85 -69.35 -44.66 71.14 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 118.871 1.336 . . . . 0.0 110.364 170.817 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.54 -22.05 66.16 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 118.268 -0.873 . . . . 0.0 112.549 -177.014 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mp -91.34 -19.46 22.91 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.231 0.923 . . . . 0.0 113.308 168.384 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.0 -24.29 38.07 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 174.274 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -55.53 136.63 70.35 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 125.686 1.594 . . . . 0.0 109.597 178.849 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -49.26 -81.34 0.02 OUTLIER 'Trans proline' 0 CA--C 1.535 0.532 1 C-N-CA 126.611 4.874 . . . . 0.0 112.712 -167.695 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 13.4 m -62.86 -27.75 69.55 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 125.226 1.41 . . . . 0.0 111.415 -179.855 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -67.84 -43.5 79.38 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 120.495 1.498 . . . . 0.0 111.244 178.903 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 2.7 t -58.6 -14.1 7.38 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.51 1.05 . . . . 0.0 113.069 168.531 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -93.28 -55.33 3.35 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 120.265 -1.522 . . . . 0.0 112.053 171.641 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mt -38.87 -56.56 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 125.223 1.409 . . . . 0.0 110.464 170.899 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 96.9 mt -62.92 -30.56 71.65 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -170.545 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.6 p -88.12 -10.71 10.77 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 124.546 1.139 . . . . 0.0 112.337 178.012 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.71 -6.42 25.07 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 128.28 2.632 . . . . 0.0 112.907 176.503 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 52.7 mt -77.72 -54.27 6.56 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 119.639 -1.913 . . . . 0.0 110.177 168.84 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -35.31 -48.32 0.46 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 131.614 3.966 . . . . 0.0 114.303 179.551 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -102.8 -21.5 14.03 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.959 2.104 . . . . 0.0 113.224 -179.317 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -83.99 -70.1 1.36 Allowed Glycine 0 C--N 1.336 0.542 0 C-N-CA 125.826 1.679 . . . . 0.0 110.562 -170.726 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 11.0 m 32.46 26.81 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 N-CA-C 117.551 2.426 . . . . 0.0 117.551 -170.9 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 54.1 m -81.36 -89.56 0.07 Allowed 'General case' 0 C--O 1.221 -0.427 0 O-C-N 120.846 -1.159 . . . . 0.0 111.634 -178.661 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -135.16 156.52 78.12 Favored Pre-proline 0 N--CA 1.472 0.653 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -169.166 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -57.24 125.4 18.76 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.266 1.978 . . . . 0.0 109.359 171.554 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.14 -6.83 80.45 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 117.313 -1.826 . . . . 0.0 114.935 -174.091 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -59.36 -38.16 79.73 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 120.764 2.282 . . . . 0.0 111.235 172.273 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 15.0 mt -53.71 -23.05 10.42 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.224 1.41 . . . . 0.0 112.454 179.384 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.88 -28.15 69.3 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 176.966 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.03 -55.26 5.77 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.774 0.83 . . . . 0.0 110.6 171.312 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -49.67 -40.42 39.82 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 177.426 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.4 mt -95.6 -15.3 22.87 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.03 0.932 . . . . 0.0 113.245 -175.999 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.95 -5.13 4.93 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 124.542 1.068 . . . . 0.0 114.188 -170.123 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 87.8 mt -89.58 136.08 33.24 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 125.279 1.431 . . . . 0.0 109.678 -177.903 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.0 t -61.23 150.54 34.28 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.294 -0.879 . . . . 0.0 112.316 -173.631 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -57.5 -32.01 66.59 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -169.863 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.7 m -64.29 -52.34 59.02 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.017 0.927 . . . . 0.0 112.551 173.822 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -64.24 -40.92 97.01 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.8 1.24 . . . . 0.0 111.827 179.127 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 78.6 t -61.34 -44.7 98.94 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 121.505 -0.747 . . . . 0.0 111.143 169.504 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 81.1 p -64.04 -31.51 72.73 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.0 1.273 . . . . 0.0 113.913 176.88 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -57.27 -40.64 78.12 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 122.345 1.069 . . . . 0.0 110.854 174.316 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -73.85 -34.67 64.6 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 116.925 -1.512 . . . . 0.0 114.121 170.135 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 90.7 mt -61.24 -32.83 72.63 Favored 'General case' 0 N--CA 1.483 1.175 0 CA-C-N 121.793 2.088 . . . . 0.0 113.443 173.274 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 70.4 m -52.53 -44.82 66.01 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -174.159 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.1 t -75.73 -36.67 59.87 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.548 0.613 . . . . 0.0 110.788 175.733 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 10.1 tp -62.51 -28.33 69.76 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 127.16 2.184 . . . . 0.0 113.737 -168.148 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 28.2 mtm105 -71.92 -40.72 68.58 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.007 0.523 . . . . 0.0 110.602 171.815 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.82 -39.95 85.32 Favored Glycine 0 C--O 1.222 -0.654 0 CA-C-O 118.439 -1.2 . . . . 0.0 111.147 178.5 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 96.6 m -58.31 -12.91 4.18 Favored 'General case' 0 CA--C 1.565 1.556 0 C-N-CA 127.255 2.222 . . . . 0.0 112.323 168.541 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 82.29 -9.82 56.55 Favored Glycine 0 C--N 1.344 1.02 0 C-N-CA 127.033 2.254 . . . . 0.0 113.412 -179.834 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 19.8 mt -71.08 -31.52 67.92 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.196 1.398 . . . . 0.0 114.643 -167.862 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -109.62 139.65 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.688 1.595 . . . . 0.0 111.125 169.874 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 71.6 t -132.66 133.7 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 C-N-CA 125.764 1.626 . . . . 0.0 109.241 -176.272 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.72 135.34 35.5 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.482 0.713 . . . . 0.0 110.126 168.965 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 2.1 m -162.49 163.5 27.47 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.764 1.625 . . . . 0.0 107.046 -171.31 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -91.73 151.77 20.48 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 120.89 -1.131 . . . . 0.0 113.673 178.518 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -119.22 -171.56 2.14 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.513 1.925 . . . . 0.0 108.834 166.396 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -69.99 -10.28 64.72 Favored Glycine 0 CA--C 1.536 1.378 0 N-CA-C 116.932 1.533 . . . . 0.0 116.932 -168.69 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 24.6 mtm180 -138.27 -21.94 1.04 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.153 1.781 . . . . 0.0 113.571 -177.4 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -154.83 -175.39 5.4 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.665 1.575 . . . . 0.0 112.755 -179.478 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 9.2 p -83.34 146.61 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.312 1.045 . . . . 0.0 110.453 169.073 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -134.72 162.48 32.22 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 126.436 1.894 . . . . 0.0 111.566 -170.962 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -106.59 127.0 52.98 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 165.723 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -128.62 172.11 11.51 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.385 1.874 . . . . 0.0 109.924 176.218 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 29.4 mt -76.03 158.96 31.3 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.116 0.566 . . . . 0.0 112.399 177.912 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -46.2 -34.92 4.68 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.712 2.005 . . . . 0.0 116.071 177.955 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 11.6 t70 171.59 158.63 0.09 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 128.922 2.889 . . . . 0.0 110.453 -169.988 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 91.9 p -40.98 -36.14 0.62 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 128.749 2.82 . . . . 0.0 113.501 168.57 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . 0.4 ' CG ' ' HB3' ' A' ' 91' ' ' GLN . 5.2 m-70 -49.47 -53.05 25.18 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 125.674 1.59 . . . . 0.0 113.039 173.854 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 14.2 mt -74.22 -40.11 62.66 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.075 0.852 . . . . 0.0 110.43 -179.395 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.01 -45.76 75.14 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.088 0.555 . . . . 0.0 110.99 179.376 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -77.01 -35.6 56.94 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 117.049 -1.453 . . . . 0.0 114.193 176.088 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -69.31 -33.45 73.18 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 121.143 1.792 . . . . 0.0 112.822 178.778 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.44 -44.5 51.46 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.587 0.755 . . . . 0.0 110.683 169.868 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.96 -32.67 73.58 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 123.972 0.796 . . . . 0.0 113.178 -176.022 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -71.68 -8.79 56.34 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.289 1.436 . . . . 0.0 112.548 169.421 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . 0.404 ' C ' ' H ' ' B' ' 91' ' ' GLN . 4.8 tp 66.95 11.01 8.1 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 128.453 2.701 . . . . 0.0 115.338 167.994 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER 75.28 -9.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 C-N-CA 129.973 3.309 . . . . 0.0 111.907 168.093 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.459 ' C ' ' H ' ' B' ' 93' ' ' VAL 0.482 5.2 pt20 73.93 12.46 4.31 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 115.306 1.595 . . . . 0.0 115.306 141.726 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 4.9 p -68.38 42.68 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 130.112 3.365 . . . . 0.0 109.368 163.141 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . 0.459 ' H ' ' C ' ' B' ' 91' ' ' GLN . 1.5 t 59.22 45.57 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 C-N-CA 127.741 2.416 . . . . 0.0 111.633 178.296 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 32.6 tp 60.26 60.37 2.07 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 122.096 0.951 . . . . 0.0 110.242 -179.92 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.91 114.68 1.82 Allowed 'General case' 0 CA--C 1.548 0.877 0 O-C-N 121.156 -0.965 . . . . 0.0 110.658 179.682 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 27.4 m -144.32 144.35 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 126.464 1.906 . . . . 0.0 111.43 177.066 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -74.34 108.66 7.27 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.686 1.195 . . . . 0.0 110.348 179.418 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 22.0 m -166.1 -78.34 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.495 1.918 . . . . 0.0 107.132 -169.61 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -156.76 105.87 2.23 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 129.41 3.084 . . . . 0.0 103.832 166.783 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -158.99 -164.4 0.09 OUTLIER Pre-proline 0 CA--C 1.559 1.323 0 C-N-CA 125.626 1.571 . . . . 0.0 108.999 -165.34 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -63.16 -156.53 0.02 OUTLIER 'Trans proline' 0 CA--C 1.555 1.562 0 C-N-CA 124.087 3.191 . . . . 0.0 115.658 173.061 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . 0.4 0.5 OUTLIER 35.19 57.2 0.81 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 128.983 2.913 . . . . 0.0 115.369 -170.094 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -73.16 -39.52 56.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 C-N-CA 128.854 2.861 . . . . 0.0 114.464 168.443 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.74 -146.02 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -165.856 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . 0.5 ' CD ' ' H ' ' B' ' 106' ' ' ARG . 0.4 OUTLIER -66.24 154.73 39.09 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.82 -0.55 . . . . 0.0 109.831 169.415 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . 0.5 ' H ' ' CD ' ' B' ' 105' ' ' GLU . 0.7 OUTLIER . . . . . 0 CA--C 1.55 0.961 0 C-N-CA 130.593 3.557 . . . . 0.0 113.869 -169.137 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.959 0 CA-C-O 119.755 -0.164 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -61.59 -32.18 72.28 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 173.408 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.47 -54.23 35.77 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.879 0.871 . . . . 0.0 110.532 178.591 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -34.57 76.78 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.335 0.97 . . . . 0.0 112.586 176.631 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -68.77 -56.5 7.84 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.306 0.957 . . . . 0.0 111.066 -179.179 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.86 -29.84 75.91 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-O 119.128 -0.818 . . . . 0.0 111.141 -179.783 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -65.36 -48.4 73.08 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 118.344 1.072 . . . . 0.0 110.649 169.878 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.1 -24.97 67.44 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 119.869 1.213 . . . . 0.0 112.977 -179.647 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 mp -94.14 -4.34 49.39 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 171.477 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -99.68 -15.37 18.55 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 126.489 1.916 . . . . 0.0 114.192 168.511 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.416 ' CG ' HH21 ' A' ' 23' ' ' ARG . 0.7 OUTLIER -62.66 152.18 82.17 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 127.257 2.223 . . . . 0.0 112.671 174.221 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.35 -101.1 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 0.978 1 C-N-CA 127.533 5.489 . . . . 0.0 112.317 -169.681 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -44.92 -35.43 2.84 Favored 'General case' 0 C--O 1.22 -0.494 0 C-N-CA 126.516 1.926 . . . . 0.0 111.346 168.807 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.416 HH21 ' CG ' ' A' ' 20' ' ' ASP . 11.9 ttm-85 -64.41 -50.54 67.22 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 120.277 1.399 . . . . 0.0 113.952 -179.462 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.23 -42.51 99.37 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 120.069 1.304 . . . . 0.0 110.063 174.384 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 18.6 mmt-85 -54.48 -44.05 72.3 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 174.679 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.5 mm -50.22 -54.15 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.236 0.614 . . . . 0.0 109.792 170.772 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 86.7 mt -59.91 -48.11 83.05 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.472 -0.775 . . . . 0.0 112.173 -177.239 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.7 m -65.55 -36.05 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 CA-C-N 118.776 0.716 . . . . 0.0 111.092 -176.716 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.02 -26.7 33.58 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.513 0.561 . . . . 0.0 112.513 -178.773 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.9 tp -68.79 -37.27 79.17 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 117.182 -1.389 . . . . 0.0 112.051 174.323 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.39 -50.83 12.0 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.182 2.193 . . . . 0.0 112.893 -173.135 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -104.05 8.72 36.6 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 126.454 1.902 . . . . 0.0 112.118 178.695 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -92.98 -73.85 1.25 Allowed Glycine 0 C--N 1.341 0.86 0 C-N-CA 127.365 2.412 . . . . 0.0 111.504 172.256 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 23.7 m 24.54 49.54 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 C-N-CA 128.399 2.68 . . . . 0.0 115.918 -172.792 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 80.3 m -96.61 -66.94 0.87 Allowed 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 125.523 1.529 . . . . 0.0 112.661 177.304 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -146.0 159.02 47.7 Favored Pre-proline 0 N--CA 1.486 1.364 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -168.382 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -55.45 126.27 21.92 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.214 2.609 . . . . 0.0 111.061 173.528 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.56 8.35 62.91 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 117.918 -1.49 . . . . 0.0 115.046 179.966 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.07 -24.74 26.71 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.353 2.076 . . . . 0.0 112.883 177.085 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.3 mt -63.2 -15.87 58.32 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 125.894 1.677 . . . . 0.0 111.643 -176.662 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.27 -29.75 70.04 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 170.308 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.0 -49.04 16.31 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.489 0.586 . . . . 0.0 110.711 169.959 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -59.05 -36.49 75.13 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -179.023 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 17.5 mt -101.45 -14.12 17.66 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.279 1.432 . . . . 0.0 112.468 -175.839 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.4 -1.83 12.19 Favored Glycine 0 CA--C 1.536 1.359 0 CA-C-N 119.416 1.007 . . . . 0.0 114.497 -171.981 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -85.54 150.97 24.29 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.879 1.272 . . . . 0.0 110.738 178.21 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.4 p -64.58 159.38 21.93 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.637 -1.289 . . . . 0.0 111.87 -177.506 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 23.7 ttm180 -53.24 -34.43 57.11 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.27 0.628 . . . . 0.0 111.385 175.186 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.2 m -66.28 -55.47 15.91 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.01 0.823 . . . . 0.0 111.378 172.988 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -57.73 -33.53 68.55 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.944 0.793 . . . . 0.0 112.902 179.323 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.8 t -72.26 -49.46 42.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.905 1.282 . . . . 0.0 112.329 172.54 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 39.5 m -64.52 -30.4 71.43 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.987 0.812 . . . . 0.0 112.297 -178.107 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -50.95 -35.57 34.14 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.252 1.421 . . . . 0.0 113.529 170.529 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -90.06 -29.45 18.36 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 117.534 -1.222 . . . . 0.0 113.997 174.214 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 66.8 mt -66.58 -27.77 67.98 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.142 1.337 . . . . 0.0 112.388 176.047 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.1 t -50.5 -51.2 49.58 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.168 0.587 . . . . 0.0 111.887 173.505 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 15.6 t -68.85 -45.72 70.33 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.79 1.236 . . . . 0.0 111.511 170.415 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.53 -32.64 73.62 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -169.021 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 25.5 mtp-105 -75.8 -37.69 58.92 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.758 0.708 . . . . 0.0 112.535 168.945 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.5 -45.56 84.35 Favored Glycine 0 N--CA 1.469 0.873 0 C-N-CA 124.024 0.821 . . . . 0.0 112.646 -178.484 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.8 m -66.53 -5.59 11.88 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 126.472 1.909 . . . . 0.0 112.336 168.151 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.54 -7.57 57.41 Favored Glycine 0 C--N 1.338 0.675 0 C-N-CA 125.712 1.625 . . . . 0.0 115.315 175.989 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 37.5 mt -65.56 -25.67 67.53 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.934 1.294 . . . . 0.0 113.168 -169.128 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.6 m -119.63 139.29 47.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.14 1.376 . . . . 0.0 112.448 167.249 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 24.6 t -130.08 145.73 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 127.046 2.138 . . . . 0.0 109.681 -177.214 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.61 146.85 28.06 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 175.68 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.4 165.42 28.55 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.42 1.488 . . . . 0.0 110.188 172.544 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -89.55 138.04 31.81 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 118.393 -0.813 . . . . 0.0 109.496 165.259 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -95.76 -32.8 12.54 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.273 0.942 . . . . 0.0 112.166 167.277 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 146.77 -32.95 1.42 Allowed Glycine 0 N--CA 1.477 1.37 0 C-N-CA 125.873 1.702 . . . . 0.0 114.549 169.43 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 49.5 ttm-85 -89.17 -34.13 16.8 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 128.075 2.55 . . . . 0.0 111.652 170.523 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.54 179.86 8.78 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 128.084 2.553 . . . . 0.0 109.797 -172.582 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 15.9 m -85.98 161.43 2.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.456 166.723 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.0 ptt180 -138.38 156.17 47.85 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.044 1.737 . . . . 0.0 109.411 -178.619 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -90.88 148.68 22.31 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 164.395 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -148.49 164.73 33.29 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 123.682 0.793 . . . . 0.0 109.154 172.816 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -58.87 156.81 10.72 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 122.632 0.373 . . . . 0.0 111.859 169.92 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.73 -30.23 31.34 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -175.023 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.3 t0 174.98 167.36 0.28 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 129.976 3.311 . . . . 0.0 109.426 179.608 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 20.2 m -51.37 -22.94 3.25 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.283 1.833 . . . . 0.0 113.182 169.166 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.43 -58.39 8.21 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.343 1.057 . . . . 0.0 111.748 170.776 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 22.7 mt -65.35 -32.71 74.5 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.408 1.458 . . . . 0.0 110.841 176.034 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.12 -29.05 69.54 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.862 0.755 . . . . 0.0 111.073 -177.046 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -70.46 -53.91 14.44 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.731 1.212 . . . . 0.0 112.532 171.281 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.38 -40.01 96.08 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 120.622 1.555 . . . . 0.0 112.582 -178.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.34 -40.52 97.52 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.899 2.08 . . . . 0.0 113.165 169.89 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.85 -45.01 5.56 Favored Glycine 0 N--CA 1.476 1.343 0 C-N-CA 127.236 2.35 . . . . 0.0 114.701 -168.943 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.419 ' CD ' HH21 ' B' ' 84' ' ' ARG . 41.5 tp10 -62.3 -25.6 67.95 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.144 0.972 . . . . 0.0 108.617 165.204 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 20.6 tp 73.4 170.25 0.31 Allowed 'General case' 0 C--N 1.344 0.349 0 C-N-CA 130.162 3.385 . . . . 0.0 109.422 175.261 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.1 m -58.27 -5.39 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 O-C-N 120.24 -1.538 . . . . 0.0 113.573 168.125 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.472 ' C ' ' H ' ' A' ' 93' ' ' VAL . 19.7 mm-40 76.81 -24.87 0.21 Allowed 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 127.038 2.135 . . . . 0.0 111.844 165.409 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 2.3 p -62.89 29.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 128.595 2.758 . . . . 0.0 114.844 172.216 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.472 ' H ' ' C ' ' A' ' 91' ' ' GLN . 2.4 t 79.36 -22.08 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 130.217 3.407 . . . . 0.0 112.935 168.401 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.6 tp 132.16 99.8 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.771 1 C-N-CA 132.928 4.491 . . . . 0.0 107.674 -176.503 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.05 139.02 58.16 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 174.792 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 35.1 t -72.52 146.2 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 C-N-CA 124.658 1.183 . . . . 0.0 113.713 -169.024 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -77.21 51.24 0.82 Allowed 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 126.07 1.748 . . . . 0.0 113.291 173.203 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.42 ' HG1' ' CB ' ' B' ' 10' ' ' ALA . 8.6 p -122.19 151.45 40.99 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 125.748 1.619 . . . . 0.0 113.434 -176.025 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -88.35 115.17 25.66 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 165.791 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -140.43 140.14 22.19 Favored Pre-proline 0 CA--C 1.536 0.429 0 C-N-CA 124.121 0.968 . . . . 0.0 109.738 171.114 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -72.55 145.47 42.18 Favored 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 123.728 2.952 . . . . 0.0 113.77 -168.288 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 14.3 t -70.66 70.22 0.45 Allowed 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.376 1.47 . . . . 0.0 111.308 171.08 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 3.3 p -146.8 21.35 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -175.38 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . 70.14 -0.24 2.87 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 169.714 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.598 ' CD ' ' H ' ' A' ' 106' ' ' ARG . 0.0 OUTLIER -153.99 -171.61 3.94 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 127.545 2.338 . . . . 0.0 110.167 174.418 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.598 ' H ' ' CD ' ' A' ' 105' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.772 0 C-N-CA 129.817 3.247 . . . . 0.0 109.235 -168.85 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.42 ' CB ' ' HG1' ' A' ' 98' ' ' THR . . . . . . . . 0 N--CA 1.476 0.827 0 CA-C-O 119.396 -0.335 . . . . 0.0 111.36 . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -66.32 -41.25 89.92 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 119.758 -1.839 . . . . 0.0 113.504 -170.377 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.61 -23.36 66.8 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 119.645 1.111 . . . . 0.0 113.285 178.841 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . 0.474 HH21 ' CB ' ' B' ' 61' ' ' CYS . 3.4 tpt85 -82.25 -58.3 3.01 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.879 1.671 . . . . 0.0 110.759 169.004 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -64.75 -50.86 65.2 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 128.226 2.61 . . . . 0.0 112.655 -173.141 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.9 -39.08 97.59 Favored Glycine 0 CA--C 1.526 0.721 0 O-C-N 121.216 -0.927 . . . . 0.0 111.512 177.384 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 65.5 ttt180 -65.57 -34.54 78.47 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.64 0.776 . . . . 0.0 111.812 174.426 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.15 -24.97 65.16 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.473 1.033 . . . . 0.0 112.651 173.43 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.0 mp -101.7 -9.27 21.03 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.862 0.865 . . . . 0.0 113.088 174.571 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.19 -19.86 31.08 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.756 1.623 . . . . 0.0 113.242 167.233 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.495 ' CG ' HH11 ' B' ' 23' ' ' ARG . 1.5 m-20 -54.08 151.17 13.24 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 127.381 2.272 . . . . 0.0 113.571 173.055 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -66.92 -100.84 0.0 OUTLIER 'Trans proline' 0 CA--C 1.547 1.161 1 C-N-CA 127.194 5.262 . . . . 0.0 112.663 -171.91 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -47.46 -28.01 1.97 Allowed 'General case' 0 C--N 1.342 0.241 0 C-N-CA 126.467 1.907 . . . . 0.0 112.936 169.973 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . 0.671 HH21 ' CB ' ' B' ' 57' ' ' CYS . 0.2 OUTLIER -68.93 -47.93 64.5 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 119.65 1.113 . . . . 0.0 113.66 177.85 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 43.3 t -60.41 -42.18 95.43 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.866 1.212 . . . . 0.0 110.728 172.757 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 19.3 mmt-85 -58.03 -43.14 86.59 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 174.437 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.1 mt -47.37 -57.7 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 CA-C-N 118.782 0.719 . . . . 0.0 109.185 169.155 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 63.6 mt -62.22 -44.72 95.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 117.365 -1.303 . . . . 0.0 112.608 -171.167 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.7 m -61.49 -33.3 56.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 CA-C-N 120.391 1.451 . . . . 0.0 111.698 176.34 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.01 -17.22 47.57 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.929 0.891 . . . . 0.0 113.37 177.617 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 tp -72.55 -42.12 65.02 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 117.366 -1.302 . . . . 0.0 111.446 169.115 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.03 -51.09 25.55 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.829 2.052 . . . . 0.0 112.475 -173.229 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -99.51 10.79 40.73 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.546 1.938 . . . . 0.0 112.581 -178.338 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -119.07 -80.44 0.68 Allowed Glycine 0 C--N 1.34 0.796 0 C-N-CA 126.46 1.981 . . . . 0.0 112.821 -173.388 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 9.1 m 35.58 37.68 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 126.559 1.944 . . . . 0.0 115.169 -169.995 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -82.33 -71.94 0.46 Allowed 'General case' 0 C--O 1.223 -0.327 0 O-C-N 120.842 -1.161 . . . . 0.0 112.357 -171.756 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -136.01 -176.18 0.55 Allowed Pre-proline 0 CA--C 1.553 1.096 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -168.547 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -79.51 95.92 1.05 Allowed 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 121.734 1.623 . . . . 0.0 108.964 -174.386 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 80.54 29.59 43.4 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-O 119.177 -0.79 . . . . 0.0 113.92 -177.648 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -60.73 -22.47 64.03 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.317 1.559 . . . . 0.0 112.0 169.889 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 8.1 mt -48.34 -20.87 0.44 Allowed 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 127.368 2.267 . . . . 0.0 113.455 171.018 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.28 -28.89 70.03 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.961 0.801 . . . . 0.0 112.055 176.958 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.01 -50.74 12.45 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.324 0.65 . . . . 0.0 110.55 168.904 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -56.91 -37.5 71.53 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -177.248 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.6 mt -97.58 -13.74 21.43 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.334 1.453 . . . . 0.0 112.28 -177.497 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.19 -6.58 4.0 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.691 1.139 . . . . 0.0 114.532 -171.349 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -84.12 147.65 27.23 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.91 1.355 . . . . 0.0 110.042 -179.532 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.7 p -59.93 155.29 16.9 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 121.677 -0.639 . . . . 0.0 111.311 -177.881 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -53.15 -35.77 60.11 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.099 178.054 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 11.6 m -64.26 -58.63 5.98 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.017 0.927 . . . . 0.0 111.514 172.139 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -55.16 -36.36 65.75 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.444 1.02 . . . . 0.0 113.262 -178.255 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 59.5 t -76.53 -43.4 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.465 0.706 . . . . 0.0 112.346 174.467 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.5 m -62.37 -30.67 71.36 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 119.763 1.165 . . . . 0.0 112.882 178.972 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -56.11 -28.97 59.88 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.879 1.271 . . . . 0.0 113.201 171.603 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 -90.46 -30.5 17.29 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-O 117.507 -1.235 . . . . 0.0 114.036 169.613 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 91.1 mt -64.79 -38.3 90.51 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 120.656 1.571 . . . . 0.0 113.035 177.808 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 1.2 m -60.3 -29.8 69.07 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 179.831 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . 0.671 ' CB ' HH21 ' B' ' 23' ' ' ARG . 40.0 t -75.86 -41.05 53.42 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.318 0.963 . . . . 0.0 110.682 169.017 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.5 tp -57.79 -38.68 75.93 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 125.54 1.536 . . . . 0.0 112.597 -174.819 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 58.5 mtm-85 -73.03 -35.33 66.74 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 118.47 0.577 . . . . 0.0 112.098 174.458 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . 0.413 ' C ' ' H ' ' B' ' 62' ' ' GLY . . . -81.82 -44.16 7.9 Favored Glycine 0 N--CA 1.468 0.774 0 C-N-CA 124.188 0.899 . . . . 0.0 112.855 -170.287 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . 0.474 ' CB ' HH21 ' B' ' 13' ' ' ARG . 94.4 m -74.18 16.21 0.26 Allowed 'General case' 0 CA--C 1.57 1.73 0 C-N-CA 125.837 1.655 . . . . 0.0 112.183 169.538 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . 0.413 ' H ' ' C ' ' B' ' 60' ' ' GLY . . . 69.36 28.13 72.88 Favored Glycine 0 C--N 1.343 0.938 0 C-N-CA 127.38 2.419 . . . . 0.0 117.383 167.783 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 56.1 mt -92.96 -32.64 14.47 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.183 0.992 . . . . 0.0 113.272 -177.782 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -134.56 138.57 49.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 C-N-CA 125.469 1.508 . . . . 0.0 113.598 -175.72 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 97.1 t -126.15 136.19 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 126.956 2.102 . . . . 0.0 108.83 179.856 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -77.64 141.13 39.61 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.782 0.833 . . . . 0.0 112.141 177.346 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -141.85 154.74 45.37 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.9 0.88 . . . . 0.0 108.828 171.817 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -73.83 132.62 42.75 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 167.715 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.53 -31.84 42.15 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.475 0.71 . . . . 0.0 110.887 166.86 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 145.61 -35.78 1.39 Allowed Glycine 0 CA--C 1.533 1.168 0 C-N-CA 126.51 2.005 . . . . 0.0 113.506 173.92 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 56.4 ttm-85 -96.06 -36.08 11.14 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 127.146 2.179 . . . . 0.0 111.886 169.921 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.38 -171.09 3.71 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.484 1.513 . . . . 0.0 110.768 -178.736 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 17.6 m -100.62 146.0 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.569 1.148 . . . . 0.0 111.106 176.459 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.0 ptt180 -116.39 172.26 7.31 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 126.537 1.935 . . . . 0.0 109.764 177.732 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -111.5 110.68 21.22 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 167.898 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -108.43 143.84 36.83 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.502 0.592 . . . . 0.0 109.49 176.06 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 8.5 mt -52.97 144.17 15.53 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 122.952 0.501 . . . . 0.0 110.864 169.385 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.28 -30.24 70.35 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 113.747 1.018 . . . . 0.0 113.747 -168.136 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -158.03 155.64 29.69 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 122.737 1.256 . . . . 0.0 111.622 167.387 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -39.95 -32.23 0.15 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 129.751 3.221 . . . . 0.0 113.264 167.185 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -52.95 -51.57 60.96 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.608 1.563 . . . . 0.0 112.844 169.532 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 11.8 mt -69.0 -44.35 72.98 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.225 0.921 . . . . 0.0 110.049 -178.881 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.59 -33.56 55.28 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.252 1.021 . . . . 0.0 112.617 173.52 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . 0.419 HH21 ' CD ' ' A' ' 88' ' ' GLU . 5.4 mmm180 -69.61 -54.09 15.67 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.7 1.2 . . . . 0.0 113.479 173.28 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.31 -38.4 91.01 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 120.249 1.386 . . . . 0.0 112.672 178.619 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 60.1 tp -60.86 -41.52 96.08 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.099 1.76 . . . . 0.0 112.872 169.222 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.36 -44.91 6.37 Favored Glycine 0 N--CA 1.474 1.18 0 C-N-CA 127.167 2.318 . . . . 0.0 115.198 -169.062 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -63.15 -27.07 69.12 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 118.297 1.048 . . . . 0.0 109.156 166.641 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . 0.436 ' C ' ' H ' ' B' ' 91' ' ' GLN . 30.6 tp 77.18 163.05 0.23 Allowed 'General case' 0 C--N 1.345 0.38 0 C-N-CA 129.971 3.308 . . . . 0.0 109.487 173.313 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 14.9 m -54.21 -5.77 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 O-C-N 120.203 -1.561 . . . . 0.0 114.564 168.05 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.436 ' H ' ' C ' ' B' ' 89' ' ' LEU . 27.7 mm-40 72.13 -20.32 0.26 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.739 2.015 . . . . 0.0 114.218 164.491 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.2 p -65.66 38.98 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 131.045 3.738 . . . . 0.0 114.275 -177.931 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.1 t 70.97 17.42 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 C-N-CA 126.387 1.875 . . . . 0.0 111.897 175.127 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 56.8 tp 73.95 108.17 0.07 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 129.596 3.158 . . . . 0.0 109.371 -168.507 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -69.69 136.15 50.71 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 175.79 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 22.9 t -89.53 147.45 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 125.725 1.61 . . . . 0.0 113.004 -168.47 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -77.32 33.85 0.16 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 127.24 2.216 . . . . 0.0 114.611 174.144 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.5 p -87.1 150.35 24.06 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.362 1.465 . . . . 0.0 110.128 169.347 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -111.74 126.5 55.13 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 167.728 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 54.3 mm-40 -158.89 153.33 20.41 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 127.482 2.313 . . . . 0.0 108.338 -172.762 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . 0.43 ' C ' ' H ' ' B' ' 103' ' ' VAL . 57.6 Cg_endo -69.39 140.46 44.11 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 122.512 2.142 . . . . 0.0 111.589 178.379 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 44.6 t -67.13 25.13 0.02 OUTLIER 'General case' 0 CA--C 1.572 1.802 0 C-N-CA 128.468 2.707 . . . . 0.0 113.858 177.904 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . 0.43 ' H ' ' C ' ' B' ' 101' ' ' PRO . 4.3 p -97.51 24.69 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 129.058 2.943 . . . . 0.0 114.499 -167.447 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . 80.03 -31.02 0.13 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 127.284 2.234 . . . . 0.0 115.058 169.795 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -134.37 155.87 49.51 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.869 1.268 . . . . 0.0 112.32 176.588 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . 0.282 22.9 ttt180 . . . . . 0 N--CA 1.477 0.92 1 C-N-CA 134.154 4.981 . . . . 0.0 109.511 168.885 . . . . . . . . 2 1 . 1 . 027 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.7 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 pp -62.95 -38.53 91.41 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.451 1.023 . . . . 0.0 112.81 -169.356 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.49 -26.31 67.83 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 174.221 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.6 mmt-85 -79.33 -43.09 24.24 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.33 -0.843 . . . . 0.0 110.911 168.967 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -56.18 -48.12 76.96 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.904 1.682 . . . . 0.0 112.622 -177.07 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.61 -26.59 71.23 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-O 119.539 -0.589 . . . . 0.0 112.56 -177.02 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.5 tmm_? -70.75 -45.44 64.82 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 118.322 1.061 . . . . 0.0 108.688 166.8 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.01 -22.55 66.97 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.019 1.328 . . . . 0.0 113.988 -176.964 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.7 mp -99.9 -3.45 32.4 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.894 1.225 . . . . 0.0 113.125 168.949 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -86.76 1.38 52.41 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.555 1.142 . . . . 0.0 113.165 167.926 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.82 160.78 71.65 Favored Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 127.177 2.191 . . . . 0.0 114.145 -172.003 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -72.4 -121.68 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.125 1 C-N-CA 126.061 4.508 . . . . 0.0 110.139 173.079 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.9 m -56.97 -21.07 27.51 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.014 1.326 . . . . 0.0 113.405 179.946 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.4 ' HE ' ' CD1' ' A' ' 58' ' ' LEU . 0.5 OUTLIER -69.04 -39.64 79.08 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.6 1.546 . . . . 0.0 112.254 173.547 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 5.7 t -71.28 -28.08 63.88 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.661 -1.274 . . . . 0.0 111.483 169.623 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.9 tpp180 -61.68 -40.25 94.31 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 120.742 -1.224 . . . . 0.0 111.769 170.766 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.9 mm -57.17 -43.49 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 124.873 1.269 . . . . 0.0 112.43 171.585 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 71.6 mt -60.11 -47.0 87.72 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 119.129 -0.462 . . . . 0.0 111.74 174.769 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.4 p -76.55 -26.59 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -171.869 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.84 -21.52 37.54 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 173.334 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.3 tp -77.63 -29.43 51.76 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 120.947 1.703 . . . . 0.0 112.117 170.602 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.42 -49.68 17.77 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.84 2.056 . . . . 0.0 112.51 170.129 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -101.31 29.84 4.53 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 128.538 2.735 . . . . 0.0 110.55 174.703 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -128.02 -84.45 0.45 Allowed Glycine 0 CA--C 1.527 0.791 0 C-N-CA 125.6 1.571 . . . . 0.0 113.256 -177.542 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 26.9 m 31.77 31.4 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 118.347 2.721 . . . . 0.0 118.347 -171.172 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 96.3 m -83.3 -87.33 0.1 Allowed 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 125.316 1.446 . . . . 0.0 110.861 175.821 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -136.37 153.23 76.18 Favored Pre-proline 0 N--CA 1.472 0.63 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -169.569 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -56.53 135.02 68.05 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.991 1.794 . . . . 0.0 109.096 171.882 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.72 -5.89 67.87 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 117.874 -1.515 . . . . 0.0 114.854 -174.961 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.88 -28.89 64.6 Favored 'General case' 0 C--N 1.348 0.539 0 CA-C-N 120.499 2.149 . . . . 0.0 112.38 177.284 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.0 mt -69.09 -16.1 63.6 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 124.262 1.025 . . . . 0.0 111.952 -175.762 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.58 -47.54 66.51 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 119.772 1.169 . . . . 0.0 110.36 174.315 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.48 -39.97 85.26 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.849 -0.532 . . . . 0.0 111.789 172.587 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -71.78 -27.85 63.22 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -175.796 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 37.6 mt -95.96 -22.79 17.19 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.316 1.046 . . . . 0.0 112.16 173.749 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.54 9.81 86.72 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.319 0.961 . . . . 0.0 112.003 -167.97 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 80.3 mt -108.26 167.57 9.93 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.954 1.302 . . . . 0.0 112.445 -169.358 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.7 p -69.15 143.26 54.14 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.526 0.679 . . . . 0.0 112.537 -167.882 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -56.71 -31.49 64.56 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.44 1.096 . . . . 0.0 111.157 172.024 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 12.4 m -66.0 -54.43 26.24 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.14 0.976 . . . . 0.0 111.445 171.096 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -70.43 -35.46 73.41 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.464 1.029 . . . . 0.0 112.239 -175.531 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.3 t -61.78 -34.69 63.61 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 O-C-N 119.57 -1.956 . . . . 0.0 111.865 169.779 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 56.0 m -67.53 -41.93 83.57 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 120.134 1.334 . . . . 0.0 112.523 172.753 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -50.7 -45.98 58.63 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.66 0.784 . . . . 0.0 110.735 171.973 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -68.93 -33.9 74.5 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 -179.189 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 23.8 mt -88.89 -7.32 56.31 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.807 1.243 . . . . 0.0 113.988 -178.172 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.7 t -67.05 -51.18 57.82 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 120.194 1.361 . . . . 0.0 110.886 177.217 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 5.2 t -73.8 -39.84 63.83 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 122.893 0.477 . . . . 0.0 111.76 179.767 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.4 ' CD1' ' HE ' ' A' ' 23' ' ' ARG . 3.3 tp -55.25 -38.19 68.21 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.778 2.031 . . . . 0.0 113.556 -174.036 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.7 mtm180 -78.51 -23.11 46.49 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.46 1.104 . . . . 0.0 112.178 -179.741 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -80.49 -55.51 3.41 Favored Glycine 0 C--N 1.342 0.908 0 C-N-CA 125.861 1.696 . . . . 0.0 110.78 172.766 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 66.6 m -51.08 -16.12 0.42 Allowed 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 127.413 2.285 . . . . 0.0 113.164 173.184 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.35 -3.24 67.92 Favored Glycine 0 C--N 1.338 0.677 0 C-N-CA 125.91 1.719 . . . . 0.0 113.716 179.468 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 34.5 mt -57.17 -26.57 60.83 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 118.495 1.148 . . . . 0.0 112.323 -179.044 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 6.1 m -133.21 156.88 42.49 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.102 0 C-N-CA 126.488 1.915 . . . . 0.0 111.384 169.204 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.5 m -148.92 151.5 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 126.043 1.737 . . . . 0.0 111.349 -171.907 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -88.4 140.27 29.63 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.355 1.462 . . . . 0.0 112.416 176.94 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 90.2 m -160.84 158.83 29.04 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.774 1.63 . . . . 0.0 107.777 -179.892 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -84.97 138.15 32.66 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 121.57 1.986 . . . . 0.0 112.011 169.6 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.0 -10.2 57.26 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 169.866 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 131.29 -22.5 4.43 Favored Glycine 0 N--CA 1.474 1.205 0 C-N-CA 125.96 1.743 . . . . 0.0 114.751 174.697 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.94 5.71 0.3 Allowed 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.056 2.142 . . . . 0.0 113.886 -179.909 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -152.67 157.64 41.23 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 128.62 2.768 . . . . 0.0 108.043 168.641 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 5.6 p -79.78 145.85 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 168.642 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.9 ptt85 -124.7 148.2 48.16 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 125.535 1.534 . . . . 0.0 109.837 -177.494 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -100.42 135.08 42.41 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 105.443 -2.058 . . . . 0.0 105.443 164.902 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -145.87 158.3 43.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 118.19 -0.909 . . . . 0.0 111.541 -176.003 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 tp -56.53 154.86 8.0 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.064 0.945 . . . . 0.0 112.688 176.342 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.14 -11.08 3.27 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 117.83 2.53 . . . . 0.0 117.83 -175.898 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.0 t70 152.1 161.62 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 131.165 3.786 . . . . 0.0 109.549 -177.371 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -41.33 -22.51 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 129.372 3.069 . . . . 0.0 112.099 163.579 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -64.12 0.96 Allowed 'General case' 0 C--N 1.349 0.563 0 C-N-CA 126.621 1.968 . . . . 0.0 111.485 175.21 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 25.3 mt -56.27 -43.77 79.09 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.701 1.137 . . . . 0.0 108.741 173.928 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.53 -44.65 69.35 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.512 1.125 . . . . 0.0 112.148 -172.884 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -79.67 -15.09 58.22 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 115.706 1.743 . . . . 0.0 115.706 -175.887 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -92.78 -48.45 6.56 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.695 1.134 . . . . 0.0 110.956 170.278 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.5 tp -49.62 -45.83 48.62 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.641 1.976 . . . . 0.0 110.824 169.679 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.81 -19.33 79.31 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 126.796 2.141 . . . . 0.0 116.433 -170.925 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -101.54 -0.88 34.21 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 118.928 1.364 . . . . 0.0 113.047 170.208 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.6 tp 93.7 23.57 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 129.19 2.996 . . . . 0.0 113.68 169.219 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.285 3.9 t 71.34 37.98 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 125.47 1.508 . . . . 0.0 110.04 169.436 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 86.61 -21.98 0.18 Allowed 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.309 -0.869 . . . . 0.0 112.329 130.021 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.9 p -72.66 39.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 129.428 3.091 . . . . 0.0 112.566 171.94 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.6 m 52.44 10.61 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 128.627 2.771 . . . . 0.0 116.425 -179.903 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.8 tt 100.35 101.37 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 130.857 3.663 . . . . 0.0 108.829 -169.719 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -103.1 155.66 18.24 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.258 0.623 . . . . 0.0 111.035 170.255 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 31.3 m -98.24 150.25 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -171.681 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 59.7 p30 -99.57 -4.07 31.92 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 -179.713 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -75.71 40.0 0.18 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 127.708 2.403 . . . . 0.0 115.701 -167.015 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 45.8 t0 62.88 69.56 0.59 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.812 2.045 . . . . 0.0 110.081 170.66 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.97 164.57 33.23 Favored Pre-proline 0 CA--C 1.549 0.925 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.531 -169.879 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -83.21 172.75 10.41 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 124.292 3.328 . . . . 0.0 111.819 177.663 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 31.0 p -62.0 -52.8 62.54 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 123.073 1.416 . . . . 0.0 107.26 165.532 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 2.6 p 171.47 -50.25 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.421 1 C-N-CA 133.032 4.533 . . . . 0.0 109.922 167.116 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.19 -29.0 64.63 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -169.916 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -81.01 140.13 35.35 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.146 0.978 . . . . 0.0 110.653 173.978 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 39.3 ttt85 . . . . . 0 N--CA 1.472 0.636 0 O-C-N 121.523 -0.736 . . . . 0.0 112.233 170.657 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.485 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 pp -60.23 -34.82 74.22 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.63 1.105 . . . . 0.0 113.433 -167.514 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.67 -27.85 68.97 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 118.624 0.647 . . . . 0.0 112.49 175.548 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 1.3 mmt-85 -77.16 -26.36 52.92 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 116.854 -1.546 . . . . 0.0 113.413 176.979 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.71 -63.97 1.03 Allowed 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.785 1.175 . . . . 0.0 109.5 170.928 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.27 -37.71 95.31 Favored Glycine 0 N--CA 1.471 0.972 0 CA-C-N 118.22 0.464 . . . . 0.0 112.704 -172.764 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -46.58 88.98 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.698 0.799 . . . . 0.0 111.292 173.799 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.55 -14.72 61.7 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 118.239 -0.886 . . . . 0.0 112.893 -179.625 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 10.6 mp -93.39 -24.21 18.15 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.169 0.895 . . . . 0.0 112.607 170.624 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.18 -16.64 57.71 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.894 1.678 . . . . 0.0 113.776 169.443 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -59.36 130.64 87.5 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 126.423 1.889 . . . . 0.0 109.511 176.643 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -48.92 -72.3 0.05 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.554 1 C-N-CA 125.869 4.379 . . . . 0.0 111.918 -168.59 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 70.8 m -91.56 -15.43 28.69 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 117.914 -1.041 . . . . 0.0 112.082 -173.739 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 48.4 mtt180 -66.1 -33.97 76.99 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 121.415 1.916 . . . . 0.0 110.779 167.997 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 42.4 t -56.75 -46.03 81.64 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 120.024 1.284 . . . . 0.0 111.15 167.309 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -60.88 -46.71 89.55 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.56 0.744 . . . . 0.0 111.866 176.539 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.6 mm -57.85 -49.93 79.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.953 1.301 . . . . 0.0 112.06 174.706 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 85.8 mt -62.11 -45.34 93.89 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.092 0.957 . . . . 0.0 111.496 -178.767 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 5.7 p -74.81 -32.5 28.37 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 CA-C-N 118.868 0.758 . . . . 0.0 112.979 -179.501 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.95 -28.83 64.77 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.494 -0.754 . . . . 0.0 111.875 173.857 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.7 tp -65.3 -36.27 83.54 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-N 119.973 1.26 . . . . 0.0 113.507 175.509 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.96 -40.57 30.93 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.999 2.52 . . . . 0.0 113.077 171.414 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -98.24 9.14 43.68 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 127.023 2.129 . . . . 0.0 112.307 179.499 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -126.0 -82.61 0.46 Allowed Glycine 0 CA--C 1.527 0.815 0 C-N-CA 124.746 1.165 . . . . 0.0 115.147 -169.725 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 34.6 m 36.93 32.13 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 127.884 2.474 . . . . 0.0 116.707 -168.57 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 68.2 m -79.75 -90.65 0.05 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.662 0.785 . . . . 0.0 111.019 179.716 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -136.72 154.65 76.64 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -169.174 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -55.89 125.69 19.94 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.316 2.011 . . . . 0.0 109.696 175.55 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 90.03 -7.27 81.96 Favored Glycine 0 CA--C 1.533 1.178 0 CA-C-O 117.6 -1.667 . . . . 0.0 115.348 -174.409 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -27.05 63.17 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.666 2.233 . . . . 0.0 112.137 178.938 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 2.1 mp -71.35 -18.88 62.36 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-O 117.913 -1.042 . . . . 0.0 113.075 -177.653 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.09 -40.9 97.24 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.88 1.218 . . . . 0.0 111.206 172.443 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.04 -44.13 66.43 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.652 -0.655 . . . . 0.0 111.714 170.122 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.96 -29.23 70.65 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -177.714 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 45.9 mt -103.76 -14.06 16.21 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.336 1.454 . . . . 0.0 113.824 179.18 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.98 -0.51 45.59 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 119.004 0.82 . . . . 0.0 113.797 -169.153 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 43.3 mt -92.37 157.96 16.33 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.757 1.279 . . . . 0.0 111.653 -171.38 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 13.3 p -62.25 147.43 48.02 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.134 0.492 . . . . 0.0 110.91 -174.594 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 ptp180 -57.94 -33.6 68.98 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 122.148 -0.345 . . . . 0.0 111.834 175.883 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 15.9 m -65.68 -49.29 69.11 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.649 0.779 . . . . 0.0 111.532 171.345 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -66.07 -43.03 88.57 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 118.897 0.771 . . . . 0.0 111.246 -178.612 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 4.2 t -59.88 -32.04 48.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 O-C-N 119.303 -2.123 . . . . 0.0 112.55 170.371 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 54.8 m -67.66 -39.93 84.5 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.922 1.237 . . . . 0.0 113.204 172.468 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -50.15 -46.79 54.3 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.976 0.911 . . . . 0.0 110.715 171.215 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -67.18 -45.42 77.0 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 118.523 -0.751 . . . . 0.0 112.162 -179.311 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 32.2 mt -73.49 -22.55 60.11 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.963 1.098 . . . . 0.0 113.963 -177.828 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -56.49 -53.11 61.27 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.137 1.335 . . . . 0.0 113.685 -176.758 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 2.3 t -70.64 -40.17 73.24 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 118.654 0.661 . . . . 0.0 110.727 177.507 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 2.0 tp -56.23 -38.39 70.99 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 127.796 2.439 . . . . 0.0 114.743 -173.32 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 46.9 mtm105 -78.76 -16.05 57.68 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.276 1.03 . . . . 0.0 112.757 177.43 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -85.4 -54.39 2.84 Favored Glycine 0 C--N 1.341 0.847 0 C-N-CA 125.82 1.676 . . . . 0.0 111.025 169.715 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 99.4 m -50.94 -16.26 0.41 Allowed 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 127.549 2.34 . . . . 0.0 113.296 175.162 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.11 -4.18 59.19 Favored Glycine 0 C--N 1.338 0.684 0 C-N-CA 125.99 1.757 . . . . 0.0 113.526 -178.394 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 68.3 mt -56.11 -28.65 58.65 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.633 1.217 . . . . 0.0 112.286 178.707 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 8.1 m -132.22 155.64 41.68 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 C-N-CA 126.025 1.73 . . . . 0.0 111.451 169.642 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 1.7 m -147.63 151.63 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.73 1.612 . . . . 0.0 111.443 -170.213 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -94.13 140.25 29.98 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.442 1.497 . . . . 0.0 111.544 178.006 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 47.7 m -163.15 171.97 15.54 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.547 1.539 . . . . 0.0 108.375 -174.442 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -88.15 145.04 26.13 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 121.04 1.746 . . . . 0.0 111.878 167.807 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.19 -44.71 13.68 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.461 -0.774 . . . . 0.0 111.328 170.533 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.25 -25.55 0.03 OUTLIER Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.553 1.549 . . . . 0.0 114.266 171.368 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.76 -29.73 0.78 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.042 1.737 . . . . 0.0 112.751 176.952 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -117.38 166.55 12.18 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.326 2.25 . . . . 0.0 110.255 176.982 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 8.7 p -79.78 147.93 6.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.641 172.255 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 14.0 ptt85 -130.65 160.93 32.77 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 127.983 2.513 . . . . 0.0 109.646 -177.306 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 21.2 m-30 -104.59 146.56 28.73 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 161.924 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -148.72 157.97 43.82 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 124.376 1.07 . . . . 0.0 110.299 178.807 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 58.3 mt -62.56 155.28 26.34 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.604 0.638 . . . . 0.0 111.529 172.279 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -50.49 -21.5 1.52 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 128.155 2.582 . . . . 0.0 117.3 -176.128 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 8.3 t70 167.4 168.2 0.03 OUTLIER 'General case' 0 C--O 1.24 0.558 0 C-N-CA 130.669 3.588 . . . . 0.0 108.282 177.167 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -42.02 -20.25 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.782 2.433 . . . . 0.0 111.778 162.087 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -63.18 1.3 Allowed 'General case' 0 C--N 1.346 0.415 0 C-N-CA 127.885 2.474 . . . . 0.0 111.742 175.5 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 34.1 mt -65.1 -35.86 82.46 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.384 0.993 . . . . 0.0 109.683 176.25 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.65 -41.72 82.05 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 177.238 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -81.76 -21.59 37.73 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -176.678 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -85.84 -44.31 12.55 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.024 0.829 . . . . 0.0 111.567 171.204 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.74 -39.93 88.13 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 122.762 0.425 . . . . 0.0 111.042 175.564 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.15 -18.96 58.75 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.686 1.612 . . . . 0.0 115.638 -176.698 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.6 -2.23 25.38 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 169.877 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 17.6 tp 106.17 2.26 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 130.596 3.559 . . . . 0.0 114.476 167.542 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . 0.306 2.9 t 80.58 40.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 125.939 1.696 . . . . 0.0 110.068 -177.871 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 86.81 -26.41 0.09 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.367 -0.833 . . . . 0.0 113.049 127.046 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 13.7 p -68.58 31.1 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.918 1 C-N-CA 131.787 4.035 . . . . 0.0 113.595 175.955 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 31.1 m 47.08 25.62 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 127.334 2.254 . . . . 0.0 115.84 -177.107 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt 97.74 98.78 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 130.502 3.521 . . . . 0.0 110.506 -179.348 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -102.25 144.13 31.15 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.872 -0.517 . . . . 0.0 110.691 169.567 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 33.4 m -90.6 156.65 3.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 C-N-CA 124.272 1.029 . . . . 0.0 113.375 -173.327 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -102.19 -8.14 21.59 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 178.005 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.77 44.07 0.16 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 128.169 2.588 . . . . 0.0 116.333 -166.142 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 43.8 t0 56.46 64.87 1.56 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 127.465 2.306 . . . . 0.0 110.048 168.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.9 167.91 16.77 Favored Pre-proline 0 CA--C 1.556 1.207 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.388 -177.814 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -80.42 173.84 11.94 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.685 2.924 . . . . 0.0 112.118 -179.198 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 30.0 p -58.93 -50.11 75.29 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 166.501 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 4.8 p 168.37 -47.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.384 1 C-N-CA 132.498 4.319 . . . . 0.0 109.9 167.629 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.26 -34.61 68.36 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.82 1.248 . . . . 0.0 113.675 -170.185 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -76.26 150.43 37.0 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.588 1.155 . . . . 0.0 110.563 174.238 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 43.4 ttt85 . . . . . 0 N--CA 1.472 0.648 0 O-C-N 121.261 -0.9 . . . . 0.0 112.568 173.425 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.247 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 pp -57.8 -37.27 73.44 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.859 0.754 . . . . 0.0 111.588 179.345 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.29 -11.2 60.61 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.167 0.987 . . . . 0.0 113.27 -179.176 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.0 mmp_? -108.5 -25.62 10.84 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.731 -1.231 . . . . 0.0 113.354 171.215 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -53.82 -45.78 70.95 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.408 1.083 . . . . 0.0 109.464 169.267 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.03 -36.6 93.24 Favored Glycine 0 CA--C 1.535 1.287 0 CA-C-O 119.349 -0.695 . . . . 0.0 113.365 175.148 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -45.65 92.09 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 118.975 1.388 . . . . 0.0 110.311 177.602 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.46 98.09 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.565 1.146 . . . . 0.0 111.94 176.756 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.6 mt -78.61 -15.11 58.91 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 117.918 -1.039 . . . . 0.0 113.271 177.612 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.86 -26.8 25.46 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 169.74 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -47.83 143.37 6.24 Favored Pre-proline 0 CA--C 1.543 0.689 0 C-N-CA 126.069 1.747 . . . . 0.0 113.571 -173.865 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -61.15 -74.62 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.607 1 C-N-CA 125.604 4.202 . . . . 0.0 111.956 -169.762 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 46.7 m -59.1 -37.94 78.35 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 121.834 -0.541 . . . . 0.0 110.429 172.092 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.55 -32.38 68.04 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -169.019 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.7 t -64.88 -46.89 79.89 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 121.369 1.895 . . . . 0.0 108.273 167.28 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 32.9 ttm-85 -62.55 -15.83 52.87 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.157 1.383 . . . . 0.0 114.661 175.28 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.3 mt -71.71 -55.93 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 CA-C-N 121.46 1.937 . . . . 0.0 108.886 167.571 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.02 -33.24 70.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 117.889 -1.053 . . . . 0.0 113.685 -172.269 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.4 m -60.48 -27.25 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 CA-C-N 119.658 1.117 . . . . 0.0 112.072 173.974 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -104.17 8.05 36.24 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.616 1.966 . . . . 0.0 112.398 -179.038 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -104.94 -22.12 13.19 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.016 1.726 . . . . 0.0 113.061 172.013 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.14 -59.14 5.75 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.411 1.885 . . . . 0.0 107.007 166.298 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -96.77 35.52 1.52 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 128.213 2.605 . . . . 0.0 112.202 173.716 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -110.61 -98.89 2.51 Favored Glycine 0 N--CA 1.472 1.049 0 O-C-N 120.889 -1.132 . . . . 0.0 113.721 -172.152 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.4 m 43.35 14.67 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 N-CA-C 120.268 3.433 . . . . 0.0 120.268 173.07 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 72.6 m -80.7 -89.88 0.06 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.347 0.976 . . . . 0.0 111.058 175.699 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -133.02 158.14 76.6 Favored Pre-proline 0 CA--C 1.55 0.977 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -168.077 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -59.57 131.22 39.15 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.438 2.759 . . . . 0.0 110.717 177.867 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.09 -2.47 18.6 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-O 117.783 -1.565 . . . . 0.0 115.079 -179.072 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.6 pp0? -60.21 -30.32 69.3 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 120.468 2.134 . . . . 0.0 111.71 -178.637 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 mt -46.87 -26.95 1.08 Allowed 'General case' 0 C--O 1.219 -0.535 0 C-N-CA 126.141 1.777 . . . . 0.0 112.992 174.555 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.74 -39.71 71.53 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 175.096 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.68 -42.77 57.83 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.139 0.881 . . . . 0.0 111.467 172.361 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -31.2 70.38 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 125.689 1.596 . . . . 0.0 113.698 -178.502 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 25.7 mt -103.18 -13.98 16.56 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.814 2.046 . . . . 0.0 113.521 178.854 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.33 3.92 67.35 Favored Glycine 0 CA--C 1.538 1.512 0 C-N-CA 125.164 1.364 . . . . 0.0 114.569 -171.084 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.5 mt -93.04 169.06 10.71 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.758 1.223 . . . . 0.0 112.142 -171.258 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.419 HG21 ' H ' ' A' ' 50' ' ' ASN . 1.3 t -70.65 141.72 51.65 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 120.915 -1.116 . . . . 0.0 110.857 169.339 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -62.78 -11.67 19.3 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.06 0.944 . . . . 0.0 112.949 169.695 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 41.0 t -71.0 -58.44 3.57 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.555 1.142 . . . . 0.0 111.157 167.811 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.419 ' H ' HG21 ' A' ' 47' ' ' THR . 41.6 t-20 -55.08 -49.33 71.93 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.851 1.66 . . . . 0.0 110.811 173.394 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 5.0 t -60.08 -44.59 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-O 117.91 -1.043 . . . . 0.0 112.302 175.326 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 60.0 m -69.76 -35.66 75.12 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 121.335 1.88 . . . . 0.0 113.705 -179.686 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -50.54 -46.58 57.54 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.536 0.734 . . . . 0.0 110.887 172.14 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -82.2 -13.04 57.71 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 175.82 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 92.3 mt -78.78 -26.72 44.46 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 122.117 2.235 . . . . 0.0 110.906 168.637 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.0 m -45.51 -55.93 5.65 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.662 1.119 . . . . 0.0 113.08 172.917 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 1.7 t -93.2 4.64 53.66 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 179.388 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.7 tp -83.72 -40.68 18.56 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.871 -1.143 . . . . 0.0 108.657 167.159 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.2 mtm105 -76.86 -28.76 55.56 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.618 1.567 . . . . 0.0 110.585 173.552 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.71 -64.25 3.55 Favored Glycine 0 C--N 1.345 1.05 0 C-N-CA 125.431 1.491 . . . . 0.0 110.909 174.744 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 49.5 m -65.89 5.72 0.45 Allowed 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 125.7 1.6 . . . . 0.0 114.6 176.202 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.62 -2.4 31.59 Favored Glycine 0 N--CA 1.471 0.974 0 C-N-CA 126.03 1.776 . . . . 0.0 114.973 176.031 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 72.1 mt -59.85 -25.67 65.22 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.718 1.259 . . . . 0.0 113.51 -175.689 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.7 m -123.83 140.77 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.755 1.622 . . . . 0.0 111.815 169.002 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 51.6 t -118.61 138.64 48.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 127.18 2.192 . . . . 0.0 110.025 -175.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.436 ' C ' ' HG1' ' A' ' 67' ' ' THR . . . -76.49 143.05 40.7 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.605 1.162 . . . . 0.0 111.254 172.574 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.436 ' HG1' ' C ' ' A' ' 66' ' ' ALA . 2.8 m -164.72 150.04 9.89 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 120.256 -1.528 . . . . 0.0 109.644 -176.788 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -84.16 126.34 33.02 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.166 1.348 . . . . 0.0 110.061 165.557 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.282 0.0 OUTLIER -74.34 -41.47 61.03 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.477 0.581 . . . . 0.0 111.844 174.817 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 162.08 -30.36 0.3 Allowed Glycine 0 CA--C 1.531 1.073 0 C-N-CA 125.476 1.512 . . . . 0.0 114.116 169.724 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -112.58 -17.82 12.53 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 127.055 2.142 . . . . 0.0 112.61 172.116 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -151.21 164.27 36.95 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.81 2.444 . . . . 0.0 110.415 -171.913 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 4.2 p -82.55 152.89 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 123.559 0.743 . . . . 0.0 110.51 168.833 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.2 ptt180 -136.96 162.34 33.54 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 126.316 1.846 . . . . 0.0 111.3 -172.755 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -116.68 123.46 47.3 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.142 0.977 . . . . 0.0 108.466 166.463 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -125.3 149.11 48.38 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 117.011 -1.471 . . . . 0.0 110.989 -178.531 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.7 mp -61.0 151.28 31.03 Favored 'General case' 0 C--N 1.348 0.508 0 C-N-CA 118.697 -1.201 . . . . 0.0 108.562 170.291 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.04 -28.78 69.31 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 114.534 -1.212 . . . . 0.0 113.924 -168.912 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -171.7 161.66 6.09 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.644 2.378 . . . . 0.0 111.169 169.604 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.1 m -34.99 -32.73 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 131.024 3.729 . . . . 0.0 113.434 165.505 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -59.8 -56.0 27.3 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.895 1.678 . . . . 0.0 111.078 175.471 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -39.49 89.99 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 120.462 1.483 . . . . 0.0 110.977 176.827 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.7 -37.49 73.58 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-O 119.023 -0.513 . . . . 0.0 112.299 176.779 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -67.17 -45.79 75.96 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 119.433 1.015 . . . . 0.0 113.173 176.929 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.82 -42.94 80.74 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.44 1.018 . . . . 0.0 110.423 -177.229 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -61.83 -28.64 69.63 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 170.854 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.6 -30.18 76.86 Favored Glycine 0 CA--C 1.538 1.528 0 O-C-N 121.0 -1.062 . . . . 0.0 113.917 169.585 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.431 ' C ' ' H ' ' A' ' 90' ' ' VAL . 10.8 pt-20 -101.43 22.62 12.3 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 119.089 1.445 . . . . 0.0 111.698 166.551 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 19.4 tp 63.9 -40.88 0.23 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 131.005 3.722 . . . . 0.0 114.254 -171.694 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.431 ' H ' ' C ' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -170.8 -61.84 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 128.975 2.91 . . . . 0.0 108.481 -172.431 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 174.06 -35.06 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 126.347 1.859 . . . . 0.0 111.126 -173.371 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.1 p -73.48 26.33 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -171.39 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 62.87 25.27 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 125.107 1.363 . . . . 0.0 111.985 172.811 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.5 mp 90.95 95.44 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 131.573 3.949 . . . . 0.0 112.457 175.573 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.93 152.93 44.77 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 166.278 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 3.4 t -79.33 139.29 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.612 1.565 . . . . 0.0 112.504 -167.718 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -71.29 4.2 3.07 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 125.48 1.512 . . . . 0.0 114.514 174.55 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 26.0 p -72.14 111.62 7.52 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 120.88 -1.138 . . . . 0.0 108.218 168.872 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -76.16 113.11 13.33 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 174.35 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -129.97 154.61 81.22 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-O 117.606 -1.188 . . . . 0.0 107.817 179.773 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -67.37 -18.93 49.99 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.505 2.137 . . . . 0.0 114.19 179.365 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . 0.394 1.8 t 136.06 -165.63 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.773 1 C-N-CA 134.117 4.967 . . . . 0.0 112.373 167.221 . . . . . . . . 3 2 . 1 . 029 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 42.0 t -110.62 -47.36 6.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 111.586 -2.552 . . . . 0.0 110.707 -165.156 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -134.31 32.28 3.41 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.139 1.376 . . . . 0.0 111.382 166.481 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -141.94 173.71 11.26 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.226 1.41 . . . . 0.0 108.478 169.245 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.4 ptt180 . . . . . 0 CA--C 1.528 0.097 0 C-N-CA 123.868 0.867 . . . . 0.0 112.02 -179.816 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.519 0 CA-C-O 119.342 -0.361 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 pp -59.76 -40.78 89.32 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.586 1.085 . . . . 0.0 113.009 -175.326 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.97 -14.29 62.64 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.213 1.005 . . . . 0.0 112.975 175.905 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 15.7 mmp_? -93.14 -33.56 13.99 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 120.764 -1.21 . . . . 0.0 112.22 169.473 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -57.3 -55.44 34.79 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.527 1.058 . . . . 0.0 109.317 169.725 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.56 -33.83 88.27 Favored Glycine 0 CA--C 1.53 0.996 0 CA-C-N 118.715 0.689 . . . . 0.0 112.311 -178.447 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -46.99 87.53 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 118.347 1.074 . . . . 0.0 110.207 171.33 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.67 -15.83 63.17 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.42 1.488 . . . . 0.0 113.506 -178.177 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.3 mp -102.71 -12.73 17.44 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.972 0.909 . . . . 0.0 112.586 169.272 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.45 -7.93 59.65 Favored 'General case' 0 CA--C 1.554 1.134 0 N-CA-C 116.985 2.217 . . . . 0.0 116.985 174.573 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.423 ' CG ' HH21 ' B' ' 23' ' ' ARG . 20.0 m-20 -73.0 161.72 78.04 Favored Pre-proline 0 CA--C 1.543 0.707 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -168.822 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -58.82 -70.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.868 1 C-N-CA 125.455 4.103 . . . . 0.0 111.518 168.465 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 24.6 m -75.68 -43.03 49.47 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 117.902 -1.047 . . . . 0.0 111.939 -179.506 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . 0.423 HH21 ' CG ' ' B' ' 20' ' ' ASP . 0.3 OUTLIER -64.29 -40.27 95.61 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 121.006 1.73 . . . . 0.0 115.211 -169.643 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 14.6 t -60.85 -45.06 96.0 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 120.153 1.342 . . . . 0.0 110.351 170.867 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 33.0 ttm-85 -62.49 -23.67 67.05 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.464 1.106 . . . . 0.0 113.556 175.364 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 mt -67.99 -57.13 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 120.156 1.344 . . . . 0.0 107.837 166.928 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 61.8 mt -55.6 -41.83 73.99 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 117.715 -1.136 . . . . 0.0 112.743 -174.367 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.1 m -61.35 -30.72 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-N 119.896 1.225 . . . . 0.0 112.65 176.652 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -95.62 -3.81 45.6 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.302 1.441 . . . . 0.0 112.525 -176.291 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.67 -23.01 20.88 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 175.945 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.14 -61.21 2.37 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 128.806 2.842 . . . . 0.0 110.167 170.574 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -91.66 7.83 39.71 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 126.593 1.957 . . . . 0.0 113.078 175.655 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.87 -85.9 1.17 Allowed Glycine 0 N--CA 1.47 0.909 0 C-N-CA 125.02 1.295 . . . . 0.0 114.179 -168.376 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 20.9 m 39.14 15.83 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 N-CA-C 120.95 3.685 . . . . 0.0 120.95 179.793 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 69.6 m -79.39 -91.45 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.465 1.03 . . . . 0.0 111.791 -178.12 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -137.88 161.56 59.27 Favored Pre-proline 0 CA--C 1.555 1.161 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -168.216 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -55.61 132.41 51.95 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 123.285 2.657 . . . . 0.0 110.396 174.943 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.05 -6.57 26.92 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 117.686 -1.619 . . . . 0.0 114.827 -179.341 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 2.6 pp0? -56.67 -36.14 69.23 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.686 1.743 . . . . 0.0 111.292 -179.689 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 8.7 mt -50.17 -32.84 17.24 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 125.103 1.361 . . . . 0.0 112.235 176.42 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.8 -53.16 58.85 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.496 0.589 . . . . 0.0 111.334 -177.751 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.5 -39.07 88.5 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.078 0.551 . . . . 0.0 112.083 175.797 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -63.23 -27.23 69.21 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.835 1.654 . . . . 0.0 113.708 179.175 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 18.0 mt -99.15 -21.48 16.12 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 126.144 1.778 . . . . 0.0 112.818 175.385 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.7 10.84 83.73 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 124.957 1.265 . . . . 0.0 113.737 -170.411 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 69.6 mt -105.87 168.87 8.83 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.381 1.473 . . . . 0.0 112.53 -170.727 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 47' ' ' THR . . . . . 0.498 HG21 ' H ' ' B' ' 50' ' ' ASN . 3.3 t -71.96 138.34 47.97 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 120.798 -1.188 . . . . 0.0 111.748 170.276 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 23.2 ptt180 -59.72 -17.39 34.35 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.165 1.386 . . . . 0.0 112.587 169.628 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 39.2 t -66.79 -58.13 5.66 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 119.91 1.232 . . . . 0.0 112.142 168.882 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . 0.498 ' H ' HG21 ' B' ' 47' ' ' THR . 35.0 t-20 -56.84 -51.71 67.95 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.501 1.521 . . . . 0.0 110.548 173.285 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 94.0 t -62.01 -37.65 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-O 118.305 -0.855 . . . . 0.0 112.02 -178.647 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 24.5 m -74.91 -35.49 62.22 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 120.89 1.677 . . . . 0.0 113.857 175.648 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -50.88 -45.28 59.95 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.127 0.876 . . . . 0.0 111.64 170.628 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -75.64 -19.82 58.92 Favored 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 174.673 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 28.5 mt -80.02 -20.68 44.79 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.501 1.5 . . . . 0.0 113.192 171.586 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 43.4 m -44.09 -55.86 4.44 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 120.161 1.346 . . . . 0.0 112.323 172.416 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.8 t -93.44 -10.79 33.88 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 179.28 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.4 tp -69.34 -34.62 74.9 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.446 -1.408 . . . . 0.0 109.621 168.645 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 74.7 mtm180 -80.77 -22.26 40.3 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.798 1.239 . . . . 0.0 112.683 169.72 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -69.79 -65.44 2.56 Favored Glycine 0 N--CA 1.472 1.092 0 C-N-CA 125.21 1.386 . . . . 0.0 111.571 175.7 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 56.3 m -67.23 5.12 0.77 Allowed 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 125.796 1.639 . . . . 0.0 114.338 175.23 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.07 6.53 79.64 Favored Glycine 0 C--N 1.343 0.961 0 O-C-N 120.85 -1.157 . . . . 0.0 114.188 172.57 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 98.4 mt -62.12 -31.41 71.86 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.748 1.219 . . . . 0.0 112.929 179.605 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 1.6 m -125.18 136.02 62.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 126.214 1.805 . . . . 0.0 112.333 170.99 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 47.3 t -119.11 137.98 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 127.357 2.263 . . . . 0.0 111.35 -171.242 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . 0.457 ' C ' ' HG1' ' B' ' 67' ' ' THR . . . -80.22 142.75 34.36 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.831 1.252 . . . . 0.0 112.613 173.463 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 67' ' ' THR . . . . . 0.457 ' HG1' ' C ' ' B' ' 66' ' ' ALA . 1.9 m -167.4 142.49 3.93 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 117.034 -1.46 . . . . 0.0 111.768 -173.993 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -74.72 121.03 21.07 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 121.31 1.868 . . . . 0.0 109.276 165.658 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.305 0.0 OUTLIER -68.24 -55.72 11.22 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 118.234 -0.888 . . . . 0.0 109.858 175.185 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -173.55 -32.7 0.03 OUTLIER Glycine 0 CA--C 1.535 1.287 0 C-N-CA 125.769 1.652 . . . . 0.0 113.984 169.171 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 29.2 tpt180 -114.0 -19.45 11.41 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.601 2.36 . . . . 0.0 113.413 176.729 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -149.55 164.9 33.8 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 128.468 2.707 . . . . 0.0 109.926 -170.821 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 4.2 p -79.32 147.15 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 121.22 -0.925 . . . . 0.0 109.845 168.672 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -128.68 160.96 30.83 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 127.043 2.137 . . . . 0.0 110.674 -176.18 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -111.39 121.4 45.13 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 106.873 -1.529 . . . . 0.0 106.873 167.069 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -123.42 154.65 38.75 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 117.156 -1.402 . . . . 0.0 111.243 174.741 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 mp -66.87 152.8 44.94 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 117.771 -1.572 . . . . 0.0 106.886 166.602 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.8 -24.05 67.56 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -170.401 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -173.66 161.34 3.91 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.931 1.692 . . . . 0.0 112.157 171.197 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -36.92 -34.55 0.08 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 130.504 3.521 . . . . 0.0 113.523 166.251 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 22.1 t60 -62.82 -52.44 63.14 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.707 1.203 . . . . 0.0 110.425 177.854 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -41.65 93.64 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 120.471 1.487 . . . . 0.0 111.076 175.206 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.26 -35.04 69.25 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 178.104 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 3.2 ptm85 -74.21 -39.1 63.36 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 177.566 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.15 -44.41 84.22 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.452 1.024 . . . . 0.0 110.058 176.144 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -54.33 -42.27 70.01 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.248 0.619 . . . . 0.0 111.597 169.76 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -60.83 -19.84 56.3 Favored Glycine 0 CA--C 1.541 1.683 0 C-N-CA 124.858 1.218 . . . . 0.0 115.184 177.037 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . 0.253 9.7 pt-20 -121.14 25.49 9.53 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.343 1.571 . . . . 0.0 112.626 165.961 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 58.0 tp 66.54 -49.3 0.45 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 131.229 3.812 . . . . 0.0 113.058 -173.363 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 33.5 t -153.48 -51.76 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 C-N-CA 128.649 2.78 . . . . 0.0 107.87 169.502 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 175.54 -22.06 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.992 1.317 . . . . 0.0 114.452 -160.619 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 8.4 p -74.49 26.64 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 O-C-N 120.247 -1.533 . . . . 0.0 113.508 -178.283 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 61.18 28.05 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.919 0 C-N-CA 124.346 1.058 . . . . 0.0 111.319 176.137 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.8 mp 75.13 111.35 0.07 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 130.247 3.419 . . . . 0.0 113.435 -171.902 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -76.31 169.47 18.16 Favored 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 163.307 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 16.0 t -82.24 141.1 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 O-C-N 120.832 -1.167 . . . . 0.0 112.814 -168.793 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -75.18 61.11 1.11 Allowed 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.565 1.146 . . . . 0.0 112.254 167.968 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 18.1 p -127.0 135.85 51.42 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 125.952 1.701 . . . . 0.0 107.75 168.39 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -87.86 116.98 26.4 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 170.105 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -144.33 160.59 48.04 Favored Pre-proline 0 CA--C 1.544 0.736 0 C-N-CA 125.425 1.49 . . . . 0.0 108.514 -172.912 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -78.25 40.53 0.9 Allowed 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.91 3.74 . . . . 0.0 113.781 175.516 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 1.8 t 58.5 -146.23 0.53 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.625 1.97 . . . . 0.0 113.082 -178.145 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 21.9 t -122.8 -45.35 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.921 1.288 . . . . 0.0 112.729 -168.13 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -132.69 40.99 3.22 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.908 1.283 . . . . 0.0 111.053 168.981 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.95 -170.1 2.1 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 128.225 2.61 . . . . 0.0 107.472 171.572 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . 0.311 31.5 ptt180 . . . . . 0 N--CA 1.485 1.296 0 C-N-CA 128.135 2.574 . . . . 0.0 115.644 168.195 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.416 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.0 tp -56.41 -34.16 66.49 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 120.606 -1.309 . . . . 0.0 112.188 173.663 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -49.05 -39.09 26.14 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.17 1.788 . . . . 0.0 112.354 169.888 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -14.76 56.16 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 126.109 1.764 . . . . 0.0 112.845 -176.862 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -72.01 -58.01 3.8 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.782 0.833 . . . . 0.0 108.954 167.006 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -57.65 -32.46 65.28 Favored Glycine 0 C--N 1.337 0.622 0 CA-C-O 118.681 -1.066 . . . . 0.0 112.263 -169.789 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.42 -22.26 65.54 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.044 1.422 . . . . 0.0 111.552 177.267 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -80.78 -17.14 51.87 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.324 -1.485 . . . . 0.0 113.699 172.325 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.7 mp -103.34 -18.14 14.98 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.527 0.731 . . . . 0.0 112.224 172.425 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.77 15.63 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 129.366 3.066 . . . . 0.0 116.355 177.071 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.97 145.38 30.39 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 126.554 1.942 . . . . 0.0 109.418 -177.168 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -62.48 -84.96 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.68 1 C-N-CA 126.059 4.506 . . . . 0.0 112.309 -169.298 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 85.8 m -44.45 -40.72 5.73 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 126.203 1.801 . . . . 0.0 111.282 170.857 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.8 ttp180 -74.6 -32.65 62.42 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 116.249 1.944 . . . . 0.0 116.249 -168.667 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 50.5 t -63.37 -39.79 95.49 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 120.377 1.444 . . . . 0.0 109.616 168.287 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 39.2 mtt180 -65.17 -40.1 93.83 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.429 1.092 . . . . 0.0 111.459 176.63 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 8.7 mt -47.6 -56.45 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-N 119.623 1.101 . . . . 0.0 110.981 167.541 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 74.6 mt -60.04 -44.65 94.51 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.263 -1.335 . . . . 0.0 112.695 -178.222 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -66.09 -31.38 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 120.18 1.355 . . . . 0.0 113.251 174.456 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.78 7.34 21.01 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.789 2.035 . . . . 0.0 114.433 173.611 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.1 mt -101.44 -28.91 12.31 Favored 'General case' 0 N--CA 1.435 -1.177 0 C-N-CA 126.917 2.087 . . . . 0.0 113.054 167.374 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 mt -62.41 -42.14 99.21 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 124.435 1.085 . . . . 0.0 109.169 168.588 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -124.59 86.96 2.64 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.9 2.08 . . . . 0.0 110.91 169.91 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -171.34 -86.21 0.06 OUTLIER Glycine 0 N--CA 1.474 1.216 0 C-N-CA 127.263 2.363 . . . . 0.0 113.227 174.415 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 18.5 m 37.36 38.31 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 127.485 2.314 . . . . 0.0 116.79 -179.267 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 9.4 m -83.76 -79.53 0.2 Allowed 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 126.374 1.87 . . . . 0.0 110.568 -176.729 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -147.83 145.34 20.86 Favored Pre-proline 0 N--CA 1.475 0.784 0 C-N-CA 125.696 1.598 . . . . 0.0 110.209 -172.226 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.97 -10.34 22.55 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.023 2.482 . . . . 0.0 116.676 -169.138 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.65 -2.39 40.28 Favored Glycine 0 CA--C 1.539 1.562 0 CA-C-N 119.885 1.22 . . . . 0.0 114.871 169.219 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.461 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -60.46 -29.4 69.02 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.034 1.334 . . . . 0.0 113.292 -171.959 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 29.4 mt -49.97 -28.28 6.6 Favored 'General case' 0 C--O 1.218 -0.588 0 C-N-CA 125.878 1.671 . . . . 0.0 111.808 179.602 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -75.07 -32.95 61.61 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -173.616 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.89 -36.57 28.01 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.153 0.501 . . . . 0.0 110.697 169.037 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.461 ' CD2' HE22 ' A' ' 39' ' ' GLN . 11.3 t60 -73.39 -31.59 63.98 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 -174.131 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.8 mt -96.09 -19.43 19.42 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.692 1.597 . . . . 0.0 112.676 172.66 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.07 -5.12 20.53 Favored Glycine 0 CA--C 1.536 1.386 0 CA-C-O 118.832 -0.982 . . . . 0.0 113.594 -168.471 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -73.71 133.71 43.4 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.608 1.563 . . . . 0.0 109.891 175.578 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.4 t -60.83 146.02 47.81 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.646 1.112 . . . . 0.0 111.511 -177.283 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.0 -29.72 57.94 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 -174.659 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.2 m -63.86 -48.76 75.45 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.059 0.845 . . . . 0.0 112.374 170.408 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -64.37 -46.27 84.13 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.901 1.68 . . . . 0.0 110.968 178.039 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 1.2 t -56.66 -44.57 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 124.17 0.988 . . . . 0.0 111.905 170.181 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 97.2 p -67.62 -38.38 83.83 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.725 1.148 . . . . 0.0 113.971 179.423 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -56.94 -52.19 66.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.748 1.219 . . . . 0.0 109.839 174.976 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -72.15 -27.59 62.69 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 120.825 -1.172 . . . . 0.0 113.983 177.464 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 34.6 mt -67.85 -33.13 74.17 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 121.473 1.942 . . . . 0.0 112.566 169.59 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.7 m -59.51 -34.59 72.8 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.404 0.682 . . . . 0.0 112.006 -177.939 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.405 ' SG ' ' HB3' ' B' ' 104' ' ' ALA . 34.1 t -75.87 -43.07 47.33 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.673 -0.642 . . . . 0.0 111.912 173.624 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.3 tp -71.32 -39.4 71.43 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.589 1.556 . . . . 0.0 112.848 -169.243 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -74.09 -7.86 54.05 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.605 1.162 . . . . 0.0 111.766 173.186 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -100.05 -40.39 3.08 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.749 1.642 . . . . 0.0 113.452 172.997 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.3 m -75.35 1.11 14.64 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.043 1.737 . . . . 0.0 112.688 170.661 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.24 2.92 80.78 Favored Glycine 0 N--CA 1.467 0.709 0 C-N-CA 127.42 2.438 . . . . 0.0 116.494 166.778 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 76.5 mt -71.43 -20.04 62.16 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.623 1.712 . . . . 0.0 113.893 -175.001 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 6.3 m -126.97 140.35 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.226 1.411 . . . . 0.0 113.791 -178.559 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.1 t -141.33 142.24 29.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.974 -170.821 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.14 148.02 23.24 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.357 1.463 . . . . 0.0 113.582 171.833 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -135.49 178.6 6.91 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.124 1.769 . . . . 0.0 106.964 167.923 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -96.11 128.79 43.34 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 166.368 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -19.43 60.06 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.25 1.02 . . . . 0.0 112.492 168.948 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 128.16 -40.95 1.65 Allowed Glycine 0 N--CA 1.471 1.002 0 C-N-CA 125.526 1.536 . . . . 0.0 112.381 172.85 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -91.94 -38.1 12.47 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.599 1.959 . . . . 0.0 110.733 171.819 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.23 -175.84 4.59 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.945 2.098 . . . . 0.0 110.693 177.793 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.6 151.42 5.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 C-N-CA 123.481 0.712 . . . . 0.0 109.838 168.013 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -120.91 -173.31 2.57 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 126.918 2.087 . . . . 0.0 108.861 167.234 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -145.07 161.29 39.81 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.65 1.18 . . . . 0.0 108.122 -179.393 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -166.9 159.49 13.54 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 120.669 1.577 . . . . 0.0 112.887 -168.957 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -60.7 137.11 58.22 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 165.668 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.32 -23.38 66.73 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.785 1.402 . . . . 0.0 114.785 -173.8 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -159.23 161.72 36.09 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.267 1.027 . . . . 0.0 113.17 168.722 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 54.6 p -42.91 -35.33 1.17 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.572 1.949 . . . . 0.0 112.76 166.877 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -48.81 77.68 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.581 1.552 . . . . 0.0 112.764 177.661 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.7 mt -69.65 -47.24 64.03 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.75 1.159 . . . . 0.0 109.003 179.226 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.03 -16.82 3.12 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.853 1.661 . . . . 0.0 114.552 172.437 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -79.23 -67.05 0.79 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.821 1.248 . . . . 0.0 109.996 176.373 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.72 -32.49 72.72 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 178.941 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 tp -68.17 -32.61 72.98 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.766 1.627 . . . . 0.0 111.441 169.662 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.17 -36.52 9.87 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 127.273 2.368 . . . . 0.0 115.632 -172.02 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.83 -9.76 58.86 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 119.75 1.775 . . . . 0.0 112.853 169.17 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.428 ' C ' ' H ' ' A' ' 91' ' ' GLN . 6.2 tt 67.87 142.31 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 127.002 2.121 . . . . 0.0 108.031 -170.906 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 33.9 m -69.71 19.41 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 O-C-N 120.328 -1.483 . . . . 0.0 114.091 -175.107 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.428 ' H ' ' C ' ' A' ' 89' ' ' LEU . 47.3 mm-40 77.08 -13.88 0.9 Allowed 'General case' 0 N--CA 1.447 -0.598 0 O-C-N 120.685 -1.26 . . . . 0.0 113.707 156.519 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.2 p -68.38 35.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 126.966 2.106 . . . . 0.0 115.605 -177.105 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.3 t 69.07 4.76 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 125.941 1.696 . . . . 0.0 112.529 173.055 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.8 mp 97.34 105.49 0.01 OUTLIER 'General case' 0 C--N 1.348 0.521 0 C-N-CA 131.302 3.841 . . . . 0.0 110.259 -170.447 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.76 66.05 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 126.962 2.105 . . . . 0.0 114.459 176.462 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.1 m -52.49 138.19 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 O-C-N 121.568 -0.707 . . . . 0.0 110.412 168.563 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -59.35 -30.99 68.79 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.396 0.678 . . . . 0.0 112.44 -168.449 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.1 m 70.61 151.46 0.1 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 128.315 2.646 . . . . 0.0 111.633 178.524 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -87.36 1.34 53.6 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.859 1.664 . . . . 0.0 114.151 175.261 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.2 146.91 35.77 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 115.073 1.509 . . . . 0.0 115.073 -166.998 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -94.48 17.96 0.86 Allowed 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 124.029 3.153 . . . . 0.0 114.438 -178.325 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.5 t -71.19 173.15 8.04 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 124.65 2.167 . . . . 0.0 113.893 -177.871 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 97.4 t -69.26 -22.39 25.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 126.179 1.791 . . . . 0.0 111.288 -178.883 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -83.84 2.42 38.37 Favored 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 -178.888 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.4 pm0 -151.54 -148.07 0.25 Allowed 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.821 1.648 . . . . 0.0 112.923 -179.422 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 66.1 mtp180 . . . . . 0 N--CA 1.477 0.88 0 C-N-CA 131.241 3.816 . . . . 0.0 113.921 169.184 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.22 0 CA-C-O 122.192 0.996 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.44 -11.25 6.31 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.526 168.769 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.51 -45.88 63.03 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.009 0.924 . . . . 0.0 111.533 167.701 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -30.24 67.14 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.226 1.81 . . . . 0.0 111.934 175.442 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -81.39 -46.71 14.24 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.056 -1.027 . . . . 0.0 111.358 172.619 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.59 -32.3 68.82 Favored Glycine 0 C--O 1.219 -0.83 0 C-N-CA 124.493 1.044 . . . . 0.0 111.803 -178.165 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.6 -32.28 72.05 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.001 1.401 . . . . 0.0 111.171 173.739 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -80.63 -20.58 42.84 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 176.189 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.5 mp -101.78 -23.04 14.25 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 118.951 0.796 . . . . 0.0 112.761 175.198 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -83.64 37.76 0.6 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.372 1.469 . . . . 0.0 114.877 178.132 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.94 142.39 24.53 Favored Pre-proline 0 CA--C 1.55 0.947 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 168.181 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -59.0 -85.38 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.785 1 C-N-CA 125.793 4.329 . . . . 0.0 112.676 -167.482 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 58.9 m -49.58 -33.93 16.38 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 126.357 1.863 . . . . 0.0 112.507 170.09 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 18.2 ttp180 -72.08 -38.87 69.33 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -170.824 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 37.1 t -56.93 -39.95 75.46 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.249 0.931 . . . . 0.0 110.369 168.709 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 16.1 mtt-85 -64.59 -38.92 92.65 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-O 118.485 -0.769 . . . . 0.0 113.061 175.161 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 3.0 mt -52.09 -49.61 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 CA-C-N 120.069 1.304 . . . . 0.0 111.835 169.426 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 92.6 mt -65.4 -47.12 77.4 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.939 -178.242 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.24 -33.85 65.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 118.911 0.778 . . . . 0.0 112.562 178.099 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.1 -9.25 59.07 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.84 1.256 . . . . 0.0 113.419 174.265 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 5.6 mt -82.9 -37.96 23.52 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 117.361 -1.304 . . . . 0.0 112.353 167.079 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.2 mt -55.82 -46.22 78.14 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 125.195 1.56 . . . . 0.0 110.754 175.498 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -107.03 46.41 0.93 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 129.037 2.935 . . . . 0.0 110.453 177.762 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -150.9 -84.29 0.05 OUTLIER Glycine 0 N--CA 1.47 0.952 0 N-CA-C 116.996 1.559 . . . . 0.0 116.996 -176.261 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 34.9 m 49.57 -12.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 C-N-CA 129.175 2.99 . . . . 0.0 118.849 -168.348 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 51.9 m -37.01 -82.23 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 127.016 2.126 . . . . 0.0 116.368 -167.368 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -149.64 143.88 17.23 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 126.364 1.865 . . . . 0.0 109.809 -174.656 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -65.7 -7.18 15.69 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 124.07 3.18 . . . . 0.0 116.88 -168.686 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.9 -14.3 21.42 Favored Glycine 0 CA--C 1.536 1.366 0 CA-C-N 120.078 1.308 . . . . 0.0 115.161 171.053 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -69.92 -19.85 63.38 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.146 1.535 . . . . 0.0 115.146 -169.072 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 20.7 mt -44.51 -32.28 1.36 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.019 1.328 . . . . 0.0 112.333 175.928 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.16 -40.41 77.2 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -178.078 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.72 -43.38 37.68 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.141 0.496 . . . . 0.0 110.92 174.747 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -64.78 -24.09 67.45 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.79 1.236 . . . . 0.0 113.792 -177.011 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 20.4 mt -109.39 -18.12 13.63 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.224 1.809 . . . . 0.0 113.799 179.043 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.48 -9.59 54.35 Favored Glycine 0 CA--C 1.536 1.346 0 CA-C-O 118.383 -1.232 . . . . 0.0 114.487 -169.941 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.04 131.94 45.11 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.889 2.076 . . . . 0.0 111.786 177.541 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 6.1 t -59.81 140.49 56.53 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 119.985 -1.697 . . . . 0.0 109.242 168.935 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.58 -21.0 59.7 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -174.497 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 5.7 m -64.44 -48.55 74.9 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.946 1.248 . . . . 0.0 111.272 169.488 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -70.46 -38.9 74.53 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.538 -0.726 . . . . 0.0 111.23 176.248 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -62.15 -35.87 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 O-C-N 120.877 -1.139 . . . . 0.0 111.978 172.352 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 96.2 p -67.91 -30.22 69.49 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 120.038 1.29 . . . . 0.0 114.404 175.661 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 55.5 t-20 -60.3 -59.87 4.72 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.678 0.791 . . . . 0.0 110.589 178.94 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -67.94 -19.37 64.97 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 176.511 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 40.0 mt -73.78 -29.24 62.08 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 121.377 1.899 . . . . 0.0 112.493 169.493 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 45.4 m -61.88 -29.18 70.02 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.429 0.559 . . . . 0.0 111.807 175.942 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.4 t -80.37 -50.72 9.76 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 118.881 0.764 . . . . 0.0 111.388 169.163 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.7 tp -58.12 -41.05 82.8 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.099 0.96 . . . . 0.0 113.016 -172.642 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 82.8 mtt180 -82.34 -6.42 59.25 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.545 1.538 . . . . 0.0 113.167 179.353 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -97.74 -43.96 2.78 Favored Glycine 0 N--CA 1.472 1.04 0 C-N-CA 124.758 1.171 . . . . 0.0 111.666 172.086 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 80.8 m -75.87 9.03 2.6 Favored 'General case' 0 CA--C 1.557 1.212 0 C-N-CA 127.463 2.305 . . . . 0.0 113.849 177.329 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.19 11.34 81.9 Favored Glycine 0 N--CA 1.471 1.022 0 C-N-CA 128.242 2.829 . . . . 0.0 117.216 167.493 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 95.5 mt -80.82 -21.88 40.47 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 118.799 1.3 . . . . 0.0 114.105 -173.846 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 5.2 m -137.63 149.51 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 125.303 1.441 . . . . 0.0 113.915 -174.601 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 77.3 t -145.01 147.17 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -176.996 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.72 147.98 28.96 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 127.737 2.415 . . . . 0.0 112.065 169.8 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -136.78 170.61 15.8 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.379 1.872 . . . . 0.0 107.395 175.658 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -81.41 133.0 35.35 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 162.929 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.52 -9.1 58.64 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 119.279 0.945 . . . . 0.0 112.842 167.985 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 126.29 -15.55 6.81 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 126.224 1.869 . . . . 0.0 113.754 173.452 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.48 -40.57 0.51 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.042 2.137 . . . . 0.0 110.616 -172.887 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -127.64 177.45 6.78 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 128.468 2.707 . . . . 0.0 108.063 167.738 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 2.3 m -86.48 143.55 11.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 123.152 0.581 . . . . 0.0 109.609 165.731 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 12.3 ptt180 -106.17 -176.44 3.08 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 127.127 2.171 . . . . 0.0 108.64 172.202 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . 0.254 0.2 OUTLIER -143.76 171.54 14.07 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 124.709 1.204 . . . . 0.0 109.696 171.618 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -174.27 159.36 3.12 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.622 1.569 . . . . 0.0 111.687 -169.38 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -60.51 142.22 55.54 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 164.864 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.43 -23.26 65.7 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -174.841 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -157.56 159.36 37.04 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 168.366 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 56.6 p -44.25 -34.93 2.06 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 113.683 -1.598 . . . . 0.0 112.002 165.295 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.93 -45.65 93.85 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.582 1.553 . . . . 0.0 111.915 -179.489 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 9.0 mt -69.06 -45.64 69.88 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.447 1.021 . . . . 0.0 109.53 174.684 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.63 -20.73 50.22 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.965 1.306 . . . . 0.0 113.797 178.008 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -75.11 -66.52 0.75 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.591 1.556 . . . . 0.0 110.404 177.518 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.33 -36.26 79.65 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.022 0.828 . . . . 0.0 113.208 178.632 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 49.8 tp -61.89 -38.07 86.97 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.724 1.21 . . . . 0.0 111.13 169.494 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -78.97 -42.69 11.98 Favored Glycine 0 C--N 1.341 0.815 0 C-N-CA 127.509 2.481 . . . . 0.0 114.968 -171.754 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.22 -12.02 60.98 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.142 1.471 . . . . 0.0 112.484 168.843 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 89' ' ' LEU . . . . . 0.418 ' C ' ' H ' ' B' ' 91' ' ' GLN . 9.7 tt 72.22 142.41 0.06 Allowed 'General case' 0 C--N 1.342 0.279 0 C-N-CA 127.554 2.341 . . . . 0.0 108.849 175.539 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 33.7 m -60.4 12.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 116.819 2.155 . . . . 0.0 116.819 -173.489 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 91' ' ' GLN . . . . . 0.418 ' H ' ' C ' ' B' ' 89' ' ' LEU . 26.0 mm-40 78.43 -18.79 0.48 Allowed 'General case' 0 CA--C 1.535 0.367 0 O-C-N 120.347 -1.47 . . . . 0.0 114.281 155.865 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 2.8 p -66.8 32.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 126.795 2.038 . . . . 0.0 115.132 177.517 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 61.77 10.95 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 C-N-CA 125.645 1.578 . . . . 0.0 113.509 -179.686 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 10.1 mp 86.04 115.67 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 131.35 3.86 . . . . 0.0 109.709 -168.58 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -72.05 146.18 47.77 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-O 121.475 0.655 . . . . 0.0 110.688 167.172 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 31.9 m -126.58 164.5 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 127.884 2.474 . . . . 0.0 109.138 -173.787 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -64.04 -29.4 70.55 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 122.96 0.504 . . . . 0.0 111.888 -171.084 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 86.1 153.77 0.07 Allowed 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 130.752 3.621 . . . . 0.0 112.718 169.302 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 -91.81 -12.33 34.06 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 126.051 1.741 . . . . 0.0 113.154 169.447 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -123.52 122.37 26.61 Favored Pre-proline 0 CA--C 1.542 0.654 0 CA-C-O 117.82 -1.086 . . . . 0.0 110.149 169.561 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -80.82 151.58 18.98 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 124.272 3.315 . . . . 0.0 111.584 169.071 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 44.2 t -147.15 177.7 8.97 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 124.485 2.088 . . . . 0.0 112.168 -179.489 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 23.0 t -75.72 -20.37 15.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 C-N-CA 126.838 2.055 . . . . 0.0 110.223 175.936 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . 0.405 ' HB3' ' SG ' ' A' ' 57' ' ' CYS . . . -68.93 5.59 1.1 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.769 1.627 . . . . 0.0 114.207 168.189 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -165.84 -138.3 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.567 1.147 . . . . 0.0 113.472 -169.879 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 52.8 mtp180 . . . . . 0 CA--C 1.554 1.097 1 C-N-CA 133.919 4.887 . . . . 0.0 111.185 -175.302 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.44 -6.39 55.17 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -175.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.6 mmp_? -90.47 -50.57 5.87 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.704 1.202 . . . . 0.0 108.96 167.031 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -44.01 -71.86 0.07 Allowed 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 127.87 2.468 . . . . 0.0 109.981 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -83.09 -8.19 85.95 Favored Glycine 0 CA--C 1.526 0.744 0 C-N-CA 119.112 -1.518 . . . . 0.0 115.259 -168.066 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.36 -45.66 53.68 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.482 1.641 . . . . 0.0 108.245 168.381 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.24 -23.4 57.52 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 118.084 -0.96 . . . . 0.0 112.804 174.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 18' ' ' LEU . 4.8 tp -80.71 -34.89 34.21 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.508 1.049 . . . . 0.0 112.249 179.278 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -104.7 71.3 0.97 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 122.256 1.027 . . . . 0.0 110.463 169.354 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.488 ' CG ' ' HE ' ' A' ' 23' ' ' ARG . 4.0 t70 -132.59 143.17 47.6 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.93 1.292 . . . . 0.0 110.284 171.095 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -41.06 -68.21 0.1 Allowed 'Trans proline' 0 C--N 1.356 0.969 1 C-N-CA 127.012 5.141 . . . . 0.0 113.75 -173.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.23 -32.86 29.53 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 116.896 -1.525 . . . . 0.0 110.801 -175.487 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.488 ' HE ' ' CG ' ' A' ' 20' ' ' ASP . 16.7 mtm180 -67.72 -41.48 83.46 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 116.256 -1.831 . . . . 0.0 113.893 -177.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 38.7 t -55.52 -42.72 74.92 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 121.658 2.026 . . . . 0.0 110.545 170.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.89 -45.18 94.87 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.156 0.982 . . . . 0.0 113.184 175.319 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.6 mt -53.69 -56.55 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 124.395 1.078 . . . . 0.0 110.366 171.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 90.1 mt -61.66 -40.76 96.07 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.835 0.854 . . . . 0.0 111.713 -169.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.6 p -73.99 -30.3 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 175.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.21 -23.89 47.29 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.053 0.941 . . . . 0.0 113.522 174.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.438 ' O ' HG13 ' A' ' 34' ' ' VAL . 4.4 tp -63.35 -44.26 95.34 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 121.09 -1.006 . . . . 0.0 110.987 173.306 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -47.86 -49.06 30.64 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 128.396 2.678 . . . . 0.0 112.226 177.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -93.6 14.6 18.42 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 127.444 2.298 . . . . 0.0 112.619 -179.221 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -134.95 -85.82 0.22 Allowed Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.568 1.556 . . . . 0.0 114.442 -175.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.556 HG12 ' HA ' ' A' ' 76' ' ' ALA . 27.8 m 41.38 30.28 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 126.771 2.029 . . . . 0.0 115.388 -168.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 2.3 m -80.39 -86.53 0.08 Allowed 'General case' 0 C--O 1.224 -0.266 0 O-C-N 121.822 -0.549 . . . . 0.0 110.654 -178.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -135.43 161.97 60.09 Favored Pre-proline 0 CA--C 1.538 0.5 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -169.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -54.07 124.15 15.24 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.377 2.718 . . . . 0.0 110.476 174.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.37 3.3 88.58 Favored Glycine 0 CA--C 1.528 0.882 0 CA-C-O 117.25 -1.861 . . . . 0.0 114.815 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.49 -30.58 70.7 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 121.012 2.406 . . . . 0.0 111.276 169.138 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.5 mt -53.7 -20.13 5.02 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 124.984 1.314 . . . . 0.0 112.674 172.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.29 -34.78 75.77 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.825 0.739 . . . . 0.0 111.319 176.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.43 -45.64 53.26 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.065 0.546 . . . . 0.0 111.159 175.031 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -60.17 -32.41 71.04 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 177.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 35.7 mt -103.3 -20.16 14.21 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -174.073 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.71 7.07 68.55 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.027 0.823 . . . . 0.0 113.905 -169.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.6 mt -108.69 150.48 27.5 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.945 1.298 . . . . 0.0 110.959 -174.481 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.0 p -60.87 145.74 49.03 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.315 0.578 . . . . 0.0 111.667 -169.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 40.5 ptt180 -59.54 -32.88 70.73 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 -177.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.4 m -64.6 -54.82 26.01 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.553 0.741 . . . . 0.0 111.29 169.725 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 55.9 t-20 -55.75 -54.1 48.58 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.794 1.238 . . . . 0.0 111.177 -178.006 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 97.4 t -58.38 -40.11 76.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 O-C-N 121.457 -0.777 . . . . 0.0 111.8 176.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 47.2 m -71.4 -28.65 64.16 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 114.217 1.191 . . . . 0.0 114.217 -177.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -49.27 -46.91 46.93 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.004 1.322 . . . . 0.0 111.59 173.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 3.9 m80 -65.28 -27.05 68.36 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 60.3 mt -67.52 -31.03 70.86 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 118.833 0.742 . . . . 0.0 111.118 176.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 68.7 m -62.94 -8.07 6.45 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 174.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.434 ' CB ' HH11 ' A' ' 23' ' ' ARG . 43.2 t -99.16 -46.76 5.45 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 118.942 0.792 . . . . 0.0 111.514 164.855 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.4 tp -58.26 -36.08 72.71 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.178 2.591 . . . . 0.0 113.515 -168.128 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 80.2 mtm-85 -68.18 -41.71 81.04 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.626 0.771 . . . . 0.0 110.867 175.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -73.19 -36.66 55.89 Favored Glycine 0 N--CA 1.472 1.05 0 C-N-CA 124.094 0.854 . . . . 0.0 111.498 -177.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 27.4 m -67.26 -2.89 6.58 Favored 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 125.889 1.676 . . . . 0.0 113.398 168.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.22 -4.92 65.02 Favored Glycine 0 N--CA 1.47 0.929 0 C-N-CA 127.06 2.267 . . . . 0.0 114.829 174.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 73.5 mt -73.88 -20.71 60.33 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -169.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.6 m -134.21 144.99 33.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 C-N-CA 125.194 1.398 . . . . 0.0 111.941 177.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.4 t -127.23 138.43 54.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 125.161 1.384 . . . . 0.0 109.72 176.257 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.51 136.08 33.29 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.822 0.849 . . . . 0.0 111.003 173.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.98 179.79 5.38 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.938 2.095 . . . . 0.0 108.133 -175.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -119.26 147.83 43.82 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.945 1.698 . . . . 0.0 108.371 165.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.27 1.3 pp20? -119.66 -148.93 0.42 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.694 1.198 . . . . 0.0 111.578 176.154 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -70.38 -18.36 75.16 Favored Glycine 0 CA--C 1.535 1.341 0 CA-C-N 121.52 1.964 . . . . 0.0 115.251 -175.125 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.5 mmt180 -148.68 -17.82 0.32 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.538 1.681 . . . . 0.0 115.538 -177.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.55 -179.83 7.15 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 122.221 2.282 . . . . 0.0 112.335 -178.169 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 29.7 m -84.31 149.17 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.403 1.081 . . . . 0.0 111.253 172.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.1 ptt180 -126.67 170.93 11.6 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.782 1.233 . . . . 0.0 110.299 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -127.3 125.28 40.57 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.743 1.217 . . . . 0.0 109.611 169.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.556 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -128.73 153.81 46.99 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.547 1.539 . . . . 0.0 111.638 -177.577 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 82.8 mt -58.4 151.69 19.38 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 122.83 0.452 . . . . 0.0 109.858 170.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -49.03 -41.87 36.32 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.006 1.322 . . . . 0.0 114.031 -172.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -170.57 166.43 8.22 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 127.412 2.285 . . . . 0.0 109.135 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.1 m -36.24 -37.98 0.13 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 129.687 3.195 . . . . 0.0 112.297 165.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -44.19 -60.1 2.05 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 127.343 2.257 . . . . 0.0 113.394 171.564 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 13.4 mt -76.51 -34.98 58.58 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.255 0.934 . . . . 0.0 110.607 -177.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.17 -32.38 72.12 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 118.826 0.739 . . . . 0.0 112.733 176.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -77.47 -59.54 2.74 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.0 0.92 . . . . 0.0 110.941 176.52 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.85 -34.56 76.19 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tt -66.51 -46.44 76.23 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.238 -0.914 . . . . 0.0 108.858 168.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.02 -11.0 69.53 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 127.165 2.317 . . . . 0.0 117.078 -176.469 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -71.08 -40.03 71.81 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-N 121.728 2.764 . . . . 0.0 108.079 165.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 46.4 tp 90.91 112.62 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 131.628 3.971 . . . . 0.0 106.827 -167.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.5 m -39.31 -3.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 130.404 3.482 . . . . 0.0 117.925 169.218 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 78.57 -28.79 0.15 Allowed 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 128.696 2.798 . . . . 0.0 112.814 164.098 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 8.0 p -59.18 35.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 C-N-CA 129.484 3.114 . . . . 0.0 115.697 173.518 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.0 t 73.84 5.06 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.891 0 C-N-CA 128.436 2.694 . . . . 0.0 112.025 169.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 85.1 104.52 0.05 OUTLIER 'General case' 0 C--N 1.346 0.439 0 C-N-CA 130.578 3.551 . . . . 0.0 106.226 -169.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.99 122.37 14.14 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.644 -0.66 . . . . 0.0 110.947 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.4 t -129.86 157.5 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 126.699 2.0 . . . . 0.0 106.688 168.13 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -54.52 123.6 13.58 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.724 0.809 . . . . 0.0 110.455 168.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -151.11 145.26 25.34 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.601 1.56 . . . . 0.0 108.728 -169.541 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -85.91 67.2 9.94 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.303 1.441 . . . . 0.0 110.529 -171.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -120.8 136.69 25.67 Favored Pre-proline 0 CA--C 1.551 1.012 0 O-C-N 121.195 -0.94 . . . . 0.0 111.171 176.122 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -85.63 -166.59 0.34 Allowed 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 124.755 3.637 . . . . 0.0 114.877 -166.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 8.6 t . . . . . 0 CA--C 1.551 1.008 0 C-N-CA 126.32 1.848 . . . . 0.0 112.307 173.3 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.0 tt . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.14 1.5 18.06 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.219 1.562 . . . . 0.0 115.219 -177.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -107.08 -54.02 2.53 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.795 2.038 . . . . 0.0 110.138 168.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -43.3 -56.67 3.39 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 127.513 2.325 . . . . 0.0 110.41 174.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.66 -35.08 62.58 Favored Glycine 0 C--N 1.339 0.706 0 C-N-CA 120.357 -0.925 . . . . 0.0 113.64 -172.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.31 -38.01 71.75 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.363 1.082 . . . . 0.0 109.912 -179.04 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.51 -32.53 58.35 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 117.192 -1.385 . . . . 0.0 113.221 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.8 mp -81.14 -37.07 29.43 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 120.886 1.676 . . . . 0.0 112.435 178.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -90.95 70.55 6.42 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.532 1.06 . . . . 0.0 111.858 173.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -146.06 141.29 16.41 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 125.702 1.601 . . . . 0.0 110.49 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -45.43 -62.56 0.43 Allowed 'Trans proline' 0 C--N 1.357 0.979 1 C-N-CA 126.574 4.849 . . . . 0.0 113.053 -173.436 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 1.2 p -84.01 -38.83 20.41 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-O 116.813 -1.565 . . . . 0.0 110.714 -175.06 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 25.1 mtm180 -67.51 -36.35 80.87 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 121.195 1.816 . . . . 0.0 114.02 -175.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 43.5 t -56.34 -47.44 78.81 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 121.073 1.761 . . . . 0.0 109.784 169.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.1 -36.31 81.34 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.054 1.341 . . . . 0.0 113.249 177.264 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 3.2 mt -60.41 -61.93 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.109 0.964 . . . . 0.0 109.565 171.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 90.8 mt -56.95 -43.58 81.69 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 124.318 1.012 . . . . 0.0 111.168 -169.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 6.3 p -69.51 -31.52 49.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.34 -16.65 48.49 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.163 0.892 . . . . 0.0 113.27 175.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 3.5 tp -71.8 -37.72 70.35 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.223 -0.923 . . . . 0.0 112.288 172.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -45.8 -47.97 15.65 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.254 2.222 . . . . 0.0 111.65 170.371 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -100.17 22.39 11.49 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 127.23 2.212 . . . . 0.0 112.704 176.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -128.81 -95.1 0.8 Allowed Glycine 0 N--CA 1.476 1.305 0 C-N-CA 126.0 1.762 . . . . 0.0 114.67 -173.232 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 34' ' ' VAL . . . . . 0.612 HG12 ' HA ' ' B' ' 76' ' ' ALA . 32.9 m 39.16 35.39 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 128.095 2.558 . . . . 0.0 116.64 -169.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 88.9 m -82.18 -106.8 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 122.91 0.484 . . . . 0.0 111.07 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -125.54 165.57 25.88 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 -169.338 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -55.47 124.25 15.82 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 122.557 2.171 . . . . 0.0 110.684 177.573 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.15 -1.34 88.85 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 117.82 -1.545 . . . . 0.0 115.267 -175.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -26.09 64.55 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 121.054 2.427 . . . . 0.0 113.663 177.91 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 10.3 mt -64.94 -18.61 65.39 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 123.752 0.821 . . . . 0.0 111.735 177.301 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.7 -36.98 72.7 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.86 0.754 . . . . 0.0 112.188 174.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.82 -41.43 68.21 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.838 0.745 . . . . 0.0 111.234 174.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -64.26 -33.21 75.3 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 177.467 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 38.5 mt -104.7 -21.15 13.43 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -172.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.29 -1.48 42.16 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 124.959 1.266 . . . . 0.0 113.944 -169.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 86.8 mt -93.73 153.25 18.43 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.28 1.432 . . . . 0.0 110.552 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 29.9 p -63.75 150.65 44.07 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 121.214 -0.929 . . . . 0.0 111.924 -169.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 40.9 ptt180 -59.43 -24.77 63.78 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 175.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 4.4 m -68.51 -59.8 2.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.52 1.528 . . . . 0.0 110.463 168.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -48.51 -56.76 7.44 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.359 1.864 . . . . 0.0 111.363 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 24.5 t -67.07 -35.31 74.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 O-C-N 121.085 -1.009 . . . . 0.0 112.732 -174.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 52.8 m -68.74 -28.83 67.17 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 34.5 t-20 -51.14 -51.41 53.85 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.855 1.262 . . . . 0.0 111.222 172.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -68.07 -28.43 67.35 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.963 -1.086 . . . . 0.0 113.086 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 92.9 mt -65.04 -30.21 71.17 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.646 -0.659 . . . . 0.0 111.236 173.553 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 66.3 m -67.63 -7.13 24.04 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 53.3 t -95.71 -44.18 7.56 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.672 0.789 . . . . 0.0 110.544 164.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 7.7 tp -64.14 -37.83 88.85 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 127.621 2.368 . . . . 0.0 113.179 -168.16 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 75.9 mtm-85 -70.93 -22.43 62.24 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.13 0.572 . . . . 0.0 112.001 174.169 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -86.55 -37.95 8.5 Favored Glycine 0 N--CA 1.473 1.164 0 C-N-CA 124.86 1.219 . . . . 0.0 111.423 178.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 48.2 m -68.26 -4.21 13.44 Favored 'General case' 0 CA--C 1.56 1.348 0 C-N-CA 125.906 1.683 . . . . 0.0 112.032 168.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.23 -22.75 6.77 Favored Glycine 0 N--CA 1.47 0.955 0 C-N-CA 128.479 2.942 . . . . 0.0 114.868 177.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 89.8 mt -52.59 -22.16 4.68 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 129.285 3.034 . . . . 0.0 116.235 -168.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.95 138.42 54.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 125.02 1.328 . . . . 0.0 109.648 172.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 41.4 t -114.27 122.56 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 125.073 1.349 . . . . 0.0 108.812 178.131 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -88.41 119.29 28.71 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.609 1.164 . . . . 0.0 109.7 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.446 ' HB ' ' HG2' ' B' ' 74' ' ' ARG . 0.2 OUTLIER -123.7 -177.17 3.66 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 127.059 2.144 . . . . 0.0 109.711 -167.686 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -123.08 142.59 50.71 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.699 2.0 . . . . 0.0 108.784 166.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -113.25 -149.37 0.45 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.442 1.497 . . . . 0.0 111.813 176.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -71.21 -19.92 77.71 Favored Glycine 0 CA--C 1.535 1.342 0 O-C-N 119.801 -1.812 . . . . 0.0 114.81 -173.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 36.8 mmt180 -144.81 -18.6 0.52 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.547 1.539 . . . . 0.0 115.087 -177.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.47 -179.17 7.0 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 121.704 2.047 . . . . 0.0 113.174 -175.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 18.6 m -87.25 150.94 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 124.553 1.141 . . . . 0.0 111.345 177.074 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 74' ' ' ARG . . . . . 0.446 ' HG2' ' HB ' ' B' ' 67' ' ' THR . 15.1 ptt180 -135.85 169.75 17.08 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.995 0.918 . . . . 0.0 110.761 -174.704 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 40.0 m-85 -123.64 113.89 19.27 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 168.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 76' ' ' ALA . . . . . 0.612 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -109.29 156.06 20.41 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.727 1.211 . . . . 0.0 111.161 177.085 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 82.8 mt -59.17 150.02 26.56 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.754 0.707 . . . . 0.0 109.499 169.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -51.57 -35.55 41.64 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.393 1.077 . . . . 0.0 113.818 -171.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -173.31 168.69 4.61 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.882 2.473 . . . . 0.0 109.176 175.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -34.07 -35.6 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 129.655 3.182 . . . . 0.0 112.307 164.321 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -37.64 -67.41 0.19 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 127.703 2.401 . . . . 0.0 113.518 169.235 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 16.6 mt -77.24 -35.61 55.26 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 118.975 -0.536 . . . . 0.0 109.766 -174.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.92 -30.79 66.2 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.8 -60.05 2.3 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.362 -0.836 . . . . 0.0 111.112 175.817 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.91 -29.17 70.03 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -176.612 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.63 -32.21 47.3 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 120.78 -1.2 . . . . 0.0 111.433 169.744 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.27 -18.76 79.86 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 126.525 2.012 . . . . 0.0 115.367 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.58 -32.73 64.28 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 120.688 2.244 . . . . 0.0 108.99 165.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 39.7 tp 77.28 127.09 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 130.652 3.581 . . . . 0.0 108.388 -169.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 90' ' ' VAL . . . . . 0.424 HG23 HG12 ' B' ' 92' ' ' VAL . 12.8 m -44.03 -7.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 127.993 2.517 . . . . 0.0 116.734 169.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 73.63 -21.1 0.27 Allowed 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 127.215 2.206 . . . . 0.0 114.054 165.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.424 HG12 HG23 ' B' ' 90' ' ' VAL . 5.9 p -60.48 41.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 129.881 3.272 . . . . 0.0 114.792 171.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER 67.64 -0.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 C-N-CA 128.708 2.803 . . . . 0.0 113.633 177.461 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.0 tt 89.49 105.7 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 130.394 3.478 . . . . 0.0 105.431 -168.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.688 0 C-N-CA 122.794 0.438 . . . . 0.0 111.063 -178.911 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? . . . . . 0 CA--C 1.537 0.468 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.47 -39.76 80.82 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 118.818 0.735 . . . . 0.0 111.734 167.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.2 mtp180 -60.02 -32.13 70.6 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 121.029 -1.044 . . . . 0.0 112.317 174.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.39 -43.6 98.43 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.281 1.032 . . . . 0.0 111.578 177.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -74.53 -33.98 54.98 Favored Glycine 0 N--CA 1.474 1.179 0 CA-C-N 118.59 0.632 . . . . 0.0 112.695 176.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 16.3 mtp180 -55.24 -49.66 71.44 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.304 1.042 . . . . 0.0 109.721 170.075 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.76 -28.39 63.61 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 mp -85.92 -20.28 29.24 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.252 0.933 . . . . 0.0 113.325 -177.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -96.88 16.92 17.97 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.28 165.17 9.27 Favored Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 125.931 1.692 . . . . 0.0 112.05 168.574 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -69.34 -115.57 0.0 OUTLIER 'Trans proline' 0 CA--C 1.554 1.502 1 C-N-CA 126.314 4.676 . . . . 0.0 111.519 172.021 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -37.5 -35.7 0.14 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 128.626 2.771 . . . . 0.0 115.245 169.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.536 HH12 ' CB ' ' A' ' 57' ' ' CYS . 6.4 ttm-85 -64.12 -38.45 91.12 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 120.008 1.277 . . . . 0.0 112.974 178.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.9 t -58.35 -43.61 88.43 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.501 1.046 . . . . 0.0 109.855 174.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -38.05 89.69 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 173.503 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 6.2 mm -57.95 -47.83 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 125.433 1.493 . . . . 0.0 111.337 171.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.3 mt -65.49 -43.61 89.63 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.52 -0.738 . . . . 0.0 112.075 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.4 p -71.81 -24.17 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 CA-C-N 119.076 0.853 . . . . 0.0 112.243 175.197 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.0 -38.03 79.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.439 0.696 . . . . 0.0 111.214 171.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.492 HD23 ' HA ' ' A' ' 30' ' ' LEU . 25.4 mt -71.99 -33.5 68.16 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -178.541 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -39.55 -50.96 2.23 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.322 2.249 . . . . 0.0 112.94 170.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -97.7 -20.36 17.65 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.575 1.15 . . . . 0.0 113.107 173.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.95 15.93 54.84 Favored Glycine 0 N--CA 1.469 0.897 0 C-N-CA 126.661 2.077 . . . . 0.0 116.552 -165.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 1.8 m -50.47 74.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 127.251 2.22 . . . . 0.0 115.575 171.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 9.0 t -144.44 -54.22 0.33 Allowed 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.474 1.657 . . . . 0.0 115.474 -174.368 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 12.3 p90 -158.24 157.08 28.83 Favored Pre-proline 0 N--CA 1.481 1.1 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 177.498 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -53.94 127.89 27.46 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.943 2.429 . . . . 0.0 108.737 168.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.93 -3.08 62.26 Favored Glycine 0 CA--C 1.53 1.021 0 CA-C-O 117.484 -1.731 . . . . 0.0 115.006 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.87 -34.38 62.92 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 120.595 2.198 . . . . 0.0 110.902 169.824 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.695 HD12 ' H ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -62.16 -17.79 59.0 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 127.147 2.179 . . . . 0.0 112.204 -178.441 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.07 -43.99 97.06 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.028 0.531 . . . . 0.0 111.002 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.05 -38.69 75.88 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.806 -0.559 . . . . 0.0 111.957 173.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 9.6 t-160 -73.49 -15.6 61.31 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 -177.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 30.0 mt -110.53 -24.84 10.33 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.435 1.494 . . . . 0.0 113.842 174.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.56 6.89 88.85 Favored Glycine 0 CA--C 1.533 1.197 0 CA-C-N 119.554 1.07 . . . . 0.0 112.514 -168.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.8 mt -110.93 148.94 31.4 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.355 1.062 . . . . 0.0 111.693 -170.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.48 HG23 ' H ' ' A' ' 50' ' ' ASN . 3.4 t -58.31 149.71 23.8 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.795 0.838 . . . . 0.0 112.839 -172.057 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.7 mtm-85 -48.43 -37.14 16.37 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.977 1.711 . . . . 0.0 111.632 172.51 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.6 m -60.79 -60.01 4.48 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.281 1.032 . . . . 0.0 111.376 175.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.48 ' H ' HG23 ' A' ' 47' ' ' THR . 7.9 m-20 -67.97 -34.37 76.43 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.603 -0.685 . . . . 0.0 111.011 -175.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.9 t -57.21 -52.78 52.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 123.448 0.699 . . . . 0.0 111.191 169.464 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 13.1 p -72.67 -26.79 61.76 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -177.511 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -49.63 -48.38 49.2 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.355 1.074 . . . . 0.0 111.438 174.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -78.8 -18.21 54.46 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 177.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 56.9 mt -70.72 -21.46 62.54 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 120.995 1.725 . . . . 0.0 112.042 172.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.0 t -63.21 -53.29 55.43 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.534 1.061 . . . . 0.0 110.908 176.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.536 ' CB ' HH12 ' A' ' 23' ' ' ARG . 48.9 t -78.94 12.81 1.99 Allowed 'General case' 0 CA--C 1.561 1.367 0 C-N-CA 125.557 1.543 . . . . 0.0 112.611 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -106.96 -52.22 2.8 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 126.821 2.048 . . . . 0.0 111.216 175.669 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 44.7 mtm105 -81.78 -25.76 34.99 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.692 0.797 . . . . 0.0 112.422 -170.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.64 -31.11 9.01 Favored Glycine 0 N--CA 1.474 1.233 0 C-N-CA 124.034 0.826 . . . . 0.0 113.715 178.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 41.5 m -82.39 -5.92 58.94 Favored 'General case' 0 CA--C 1.567 1.618 0 C-N-CA 126.065 1.746 . . . . 0.0 113.596 173.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.75 -3.68 83.25 Favored Glycine 0 N--CA 1.478 1.456 0 C-N-CA 126.831 2.158 . . . . 0.0 116.891 170.246 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.7 mt -56.62 -22.31 33.19 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.997 1.719 . . . . 0.0 114.195 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.9 m -143.97 149.68 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 C-N-CA 126.689 1.996 . . . . 0.0 111.842 177.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 97.7 t -115.61 143.13 26.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 126.464 1.905 . . . . 0.0 109.276 176.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -99.2 123.25 43.34 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.975 0.91 . . . . 0.0 111.953 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -124.36 162.54 23.62 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.645 1.178 . . . . 0.0 109.348 -178.185 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -91.86 126.55 36.99 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 164.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.258 0.0 OUTLIER -90.85 4.03 52.87 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -179.544 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 109.25 -15.79 32.77 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 125.124 1.345 . . . . 0.0 113.32 175.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.58 -45.08 2.2 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 128.197 2.599 . . . . 0.0 111.602 172.162 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -139.69 169.11 18.33 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.312 2.245 . . . . 0.0 110.917 -168.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 7.1 p -83.24 145.16 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 O-C-N 121.328 -0.857 . . . . 0.0 109.877 167.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.1 ptt180 -134.54 172.91 12.26 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.457 1.103 . . . . 0.0 111.829 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -122.77 124.62 43.75 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.483 1.113 . . . . 0.0 110.651 173.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -123.63 143.18 50.39 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.122 1.369 . . . . 0.0 110.768 -177.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.2 tp -52.14 143.73 13.71 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.589 1.156 . . . . 0.0 111.492 177.664 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -45.79 -38.87 7.62 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 115.907 1.817 . . . . 0.0 115.907 -173.102 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -176.41 168.32 2.75 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.515 1.926 . . . . 0.0 109.803 -175.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.3 p -41.94 -31.54 0.35 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.852 2.061 . . . . 0.0 112.174 164.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -46.81 -67.04 0.32 Allowed 'General case' 0 C--N 1.345 0.37 0 C-N-CA 127.249 2.22 . . . . 0.0 113.566 169.141 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 13.8 mt -68.09 -34.71 76.91 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 119.527 1.058 . . . . 0.0 109.813 178.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.29 -32.29 73.87 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.819 0.736 . . . . 0.0 112.357 -172.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.2 -58.84 3.03 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.911 0.884 . . . . 0.0 112.31 170.327 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.75 -28.41 69.86 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.958 1.254 . . . . 0.0 113.59 -174.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.99 -33.13 21.17 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.906 0.882 . . . . 0.0 112.611 172.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.05 -31.86 75.83 Favored Glycine 0 CA--C 1.539 1.583 0 C-N-CA 125.064 1.316 . . . . 0.0 113.155 175.005 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -62.67 -23.36 67.07 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.467 1.907 . . . . 0.0 111.299 166.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 46.2 tp 81.67 128.26 0.05 OUTLIER 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 130.305 3.442 . . . . 0.0 107.047 -174.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 76.3 t -65.06 5.81 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 125.433 1.493 . . . . 0.0 114.544 -169.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.42 ' C ' ' H ' ' A' ' 93' ' ' VAL . 2.5 tp-100 88.07 -26.86 0.07 Allowed 'General case' 0 C--O 1.217 -0.619 0 O-C-N 120.12 -1.612 . . . . 0.0 111.191 132.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.3 p -63.97 35.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 130.327 3.451 . . . . 0.0 112.666 167.244 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.42 ' H ' ' C ' ' A' ' 91' ' ' GLN . 0.2 OUTLIER 59.18 8.36 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 C-N-CA 128.007 2.523 . . . . 0.0 114.047 176.653 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 96.63 111.24 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 131.141 3.776 . . . . 0.0 106.791 -166.597 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.51 96.57 0.17 Allowed 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.925 -0.485 . . . . 0.0 110.895 175.663 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.0 t -52.98 147.44 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 167.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.17 34.58 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 129.526 3.13 . . . . 0.0 113.665 -175.131 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.2 p -100.34 129.03 46.28 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 126.153 1.781 . . . . 0.0 111.421 -176.245 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -127.35 153.83 45.72 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.379 166.266 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -170.63 163.03 5.84 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 126.569 1.948 . . . . 0.0 108.904 -167.032 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -64.76 155.11 69.17 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.187 1.925 . . . . 0.0 110.15 169.387 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.542 0.644 0 CA-C-O 122.179 0.99 . . . . 0.0 113.43 -172.429 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mm? . . . . . 0 CA--C 1.534 0.36 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.24 -31.74 72.34 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 120.27 1.396 . . . . 0.0 112.511 168.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -61.43 -32.75 72.73 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.374 -0.829 . . . . 0.0 111.835 173.443 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -50.78 -57.84 7.4 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.85 1.26 . . . . 0.0 109.498 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.3 -34.03 88.84 Favored Glycine 0 CA--C 1.53 1.03 0 O-C-N 121.803 -0.561 . . . . 0.0 112.827 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 17.5 mtp180 -69.6 -11.52 60.9 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.035 1.334 . . . . 0.0 114.16 173.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.53 -8.11 14.67 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.756 1.622 . . . . 0.0 113.763 170.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -96.79 -29.98 13.44 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 119.909 1.231 . . . . 0.0 113.197 175.127 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -88.53 36.42 0.79 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.47 1.108 . . . . 0.0 112.604 173.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 20' ' ' ASP . . . . . 0.554 ' CG ' ' HE ' ' B' ' 23' ' ' ARG . 0.1 OUTLIER -78.6 167.04 38.44 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 128.217 2.607 . . . . 0.0 112.46 172.882 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -69.12 -115.63 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.358 1 C-N-CA 126.686 4.924 . . . . 0.0 111.767 169.36 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -42.17 -33.67 0.64 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 128.314 2.645 . . . . 0.0 114.412 176.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.581 HH12 ' CB ' ' B' ' 57' ' ' CYS . 6.9 ttm-85 -59.92 -32.14 70.49 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 117.957 -1.021 . . . . 0.0 112.91 178.237 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 1.6 m -53.37 -56.64 15.08 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.403 1.002 . . . . 0.0 109.716 169.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -35.57 80.78 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 117.799 -1.096 . . . . 0.0 112.189 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 5.2 mm -53.74 -50.96 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 CA-C-N 120.778 1.626 . . . . 0.0 112.279 170.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 42.6 mt -69.21 -40.84 77.74 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.555 -0.736 . . . . 0.0 112.062 -174.129 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 12.5 p -74.38 -25.25 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-N 118.995 0.816 . . . . 0.0 112.276 175.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.3 -27.92 68.95 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.1 -1.0 . . . . 0.0 111.996 170.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.506 ' O ' HG13 ' B' ' 34' ' ' VAL . 4.9 mp -67.82 -51.08 52.75 Favored 'General case' 0 C--O 1.226 -0.16 0 CA-C-O 117.176 -1.392 . . . . 0.0 111.598 168.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 4.7 mt -44.48 -46.03 9.5 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.767 1.227 . . . . 0.0 112.022 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -81.07 3.52 23.0 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 126.932 2.093 . . . . 0.0 113.998 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -153.12 -63.31 0.01 OUTLIER Glycine 0 N--CA 1.478 1.452 0 N-CA-C 118.049 1.98 . . . . 0.0 118.049 -167.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 34' ' ' VAL . . . . . 0.506 HG13 ' O ' ' B' ' 30' ' ' LEU . 16.0 m 33.42 40.37 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 127.854 2.462 . . . . 0.0 115.915 -169.818 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 3.6 t -96.74 -60.84 1.51 Allowed 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 -169.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -158.97 159.22 29.43 Favored Pre-proline 0 N--CA 1.479 1.008 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 -174.352 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -60.09 124.54 15.46 Favored 'Trans proline' 0 C--N 1.356 0.93 0 C-N-CA 123.112 2.542 . . . . 0.0 110.368 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.28 -4.62 85.3 Favored Glycine 0 CA--C 1.527 0.832 0 CA-C-O 117.423 -1.765 . . . . 0.0 114.331 -175.467 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -36.05 67.33 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 120.002 1.901 . . . . 0.0 109.776 169.322 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.668 ' H ' HD12 ' B' ' 40' ' ' LEU . 0.3 OUTLIER -60.94 -18.92 59.7 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 125.916 1.686 . . . . 0.0 112.574 179.799 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.99 -58.29 5.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 118.397 0.544 . . . . 0.0 110.222 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.34 -33.08 74.74 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 122.669 0.387 . . . . 0.0 111.286 176.038 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -71.94 -13.28 61.59 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 33.5 mt -117.85 -23.66 7.44 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.969 1.707 . . . . 0.0 113.721 177.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.7 12.04 84.03 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 124.633 1.111 . . . . 0.0 111.808 -167.231 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 94.8 mt -124.82 132.48 53.33 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 118.599 1.199 . . . . 0.0 112.209 -169.616 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 8.7 t -48.87 145.96 3.55 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.134 1.774 . . . . 0.0 115.448 -169.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 38.8 mtm-85 -49.68 -34.96 20.01 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.726 2.01 . . . . 0.0 112.508 177.332 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 5.9 m -61.72 -59.33 5.33 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.588 0.755 . . . . 0.0 110.989 174.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -64.59 -37.24 86.87 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.029 0.932 . . . . 0.0 111.534 -178.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.1 t -55.76 -49.93 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 C-N-CA 123.611 0.764 . . . . 0.0 111.177 169.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 15.4 p -76.38 -25.42 54.56 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 -176.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -51.3 -49.14 61.86 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.461 1.104 . . . . 0.0 110.969 170.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 60.3 m-70 -75.79 -22.4 56.42 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 173.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 91.6 mt -67.71 -23.07 65.24 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 121.008 1.731 . . . . 0.0 112.221 171.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.8 t -62.41 -53.55 53.2 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.718 1.144 . . . . 0.0 111.336 178.274 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 57' ' ' CYS . . . . . 0.581 ' CB ' HH12 ' B' ' 23' ' ' ARG 0.265 42.2 t -82.79 15.47 2.65 Favored 'General case' 0 CA--C 1.559 1.32 0 CA-C-O 122.417 1.104 . . . . 0.0 111.705 -178.991 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 58' ' ' LEU . . . . . 0.486 ' CD1' ' HD3' ' B' ' 23' ' ' ARG . 1.3 tp -105.28 -51.18 3.07 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 127.638 2.375 . . . . 0.0 111.708 173.019 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 29.9 mtm105 -89.63 -8.33 52.76 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.597 1.159 . . . . 0.0 112.656 -170.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -106.35 -29.84 4.64 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.356 1.455 . . . . 0.0 113.291 172.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 97.8 m -87.11 8.99 21.31 Favored 'General case' 0 CA--C 1.563 1.475 0 C-N-CA 126.067 1.747 . . . . 0.0 113.293 171.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.37 -13.84 14.45 Favored Glycine 0 N--CA 1.476 1.334 0 C-N-CA 126.825 2.155 . . . . 0.0 117.017 170.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 91.5 mt -48.79 -26.14 2.22 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.479 1.912 . . . . 0.0 114.88 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 4.0 m -136.99 150.64 26.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 126.186 1.794 . . . . 0.0 111.688 173.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 90.2 t -118.76 148.59 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 126.659 1.984 . . . . 0.0 108.661 170.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.92 135.12 51.92 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.784 1.234 . . . . 0.0 112.406 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.4 p -120.35 -178.49 3.7 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.811 1.244 . . . . 0.0 110.836 176.236 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -97.63 135.01 40.05 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 104.866 -2.272 . . . . 0.0 104.866 160.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.57 -11.94 23.11 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 115.146 1.535 . . . . 0.0 115.146 177.292 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 117.55 -34.15 4.65 Favored Glycine 0 N--CA 1.474 1.176 0 C-N-CA 124.85 1.214 . . . . 0.0 112.874 176.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -96.75 -35.39 11.0 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 125.85 1.66 . . . . 0.0 111.454 169.008 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -155.05 -141.74 0.1 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 128.046 2.538 . . . . 0.0 110.382 -177.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 15.2 m -133.65 152.9 35.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 127.152 2.181 . . . . 0.0 108.583 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 7.2 ptt85 -135.04 173.83 11.28 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.077 0.853 . . . . 0.0 111.751 -173.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -121.71 141.96 50.64 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.531 1.132 . . . . 0.0 109.063 168.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 76' ' ' ALA . . . . . 0.502 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -142.42 145.06 33.4 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.851 1.261 . . . . 0.0 109.003 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 tp -51.91 147.26 7.24 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.41 1.084 . . . . 0.0 111.05 175.489 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -49.57 -43.01 45.86 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 115.0 1.481 . . . . 0.0 115.0 -175.592 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -168.36 163.44 12.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.934 1.694 . . . . 0.0 110.61 -174.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 97.3 p -40.81 -33.92 0.34 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.624 2.37 . . . . 0.0 113.468 167.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -58.98 -54.95 41.38 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.344 1.058 . . . . 0.0 113.817 175.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 20.2 mt -66.37 -31.35 72.07 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.465 1.029 . . . . 0.0 109.746 177.068 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.22 -32.22 73.72 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 118.512 0.596 . . . . 0.0 109.512 178.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 2.8 mmt85 -71.57 -57.09 4.71 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.709 1.204 . . . . 0.0 111.123 168.191 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.45 -32.56 62.87 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.942 1.246 . . . . 0.0 114.036 -177.198 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -87.97 -37.47 16.36 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 172.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -81.42 -42.93 8.87 Favored Glycine 0 CA--C 1.539 1.533 0 C-N-CA 124.767 1.175 . . . . 0.0 113.984 -171.633 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -71.06 -35.88 72.09 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.8 1.24 . . . . 0.0 108.29 166.298 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 21.6 tp 93.76 144.34 0.02 OUTLIER 'General case' 0 C--N 1.342 0.268 0 C-N-CA 130.736 3.614 . . . . 0.0 111.434 168.112 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 1.5 m -53.2 -14.91 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 126.162 1.785 . . . . 0.0 113.897 171.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 65.42 -13.18 0.13 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 127.026 2.131 . . . . 0.0 114.011 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 1.3 p -58.02 24.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 130.635 3.574 . . . . 0.0 117.423 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.3 t 65.63 13.96 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 126.949 2.1 . . . . 0.0 111.358 171.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 78.75 116.15 0.06 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.604 2.362 . . . . 0.0 108.123 -167.483 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.552 1.051 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 169.737 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 mm? . . . . . 0 CA--C 1.539 0.552 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.46 -36.78 52.55 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.799 1.181 . . . . 0.0 111.722 174.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -62.89 -28.19 69.88 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.136 1.374 . . . . 0.0 112.562 177.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -47.85 -57.54 5.52 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.877 1.671 . . . . 0.0 109.337 168.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -76.85 -14.72 82.29 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-O 119.065 -0.853 . . . . 0.0 113.722 -178.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 76.6 mmt-85 -66.97 -62.59 1.36 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 166.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.13 -38.2 85.55 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.603 1.961 . . . . 0.0 114.905 -173.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.2 mp -79.66 -14.16 58.98 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 119.571 1.078 . . . . 0.0 112.538 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -118.88 24.26 10.95 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.452 1.101 . . . . 0.0 112.064 170.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -90.17 148.66 39.81 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 104.91 -2.255 . . . . 0.0 104.91 165.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -54.56 -99.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 0.979 1 C-N-CA 126.788 4.992 . . . . 0.0 113.777 -166.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.4 p -46.76 -36.88 7.74 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 126.155 1.782 . . . . 0.0 112.157 169.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -65.45 -36.87 85.21 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.179 0.899 . . . . 0.0 111.466 -174.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 52.4 t -67.38 -45.14 77.13 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.157 -0.964 . . . . 0.0 110.65 166.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.91 -43.08 69.41 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 121.743 -0.598 . . . . 0.0 112.535 178.127 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.6 mm -55.58 -50.42 66.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.617 1.567 . . . . 0.0 111.59 171.265 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 85.4 mt -61.47 -40.71 95.52 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.157 0.889 . . . . 0.0 112.015 -177.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 7.3 p -80.72 -32.6 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.1 -28.19 61.24 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.743 0.817 . . . . 0.0 112.522 173.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.44 ' O ' HG13 ' A' ' 34' ' ' VAL . 17.7 tp -66.33 -39.49 89.27 Favored 'General case' 0 N--CA 1.437 -1.088 0 CA-C-O 116.644 -1.646 . . . . 0.0 111.601 169.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -47.33 -62.43 1.43 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.703 2.001 . . . . 0.0 110.1 175.196 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -83.3 26.24 0.66 Allowed 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.595 1.958 . . . . 0.0 113.04 174.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.25 -87.25 0.31 Allowed Glycine 0 C--N 1.337 0.63 0 C-N-CA 125.783 1.659 . . . . 0.0 112.738 -177.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.521 HG12 ' HA ' ' A' ' 76' ' ' ALA . 30.7 m 39.66 41.3 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 127.455 2.302 . . . . 0.0 114.575 -170.866 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -90.68 -68.16 0.8 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -177.534 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 24.1 p90 -159.25 157.76 27.74 Favored Pre-proline 0 N--CA 1.475 0.781 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -170.352 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -56.74 128.85 31.65 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.451 2.1 . . . . 0.0 109.276 171.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.74 -0.61 81.47 Favored Glycine 0 CA--C 1.534 1.226 0 CA-C-O 117.738 -1.59 . . . . 0.0 114.818 -175.187 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.451 HE21 ' HG ' ' A' ' 40' ' ' LEU . 4.3 pp0? -59.1 -37.89 78.23 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 120.631 2.215 . . . . 0.0 110.898 170.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.451 ' HG ' HE21 ' A' ' 39' ' ' GLN . 1.5 mt -60.84 -17.8 52.0 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.564 1.145 . . . . 0.0 112.126 -179.237 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.33 -31.84 73.1 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 118.698 0.681 . . . . 0.0 111.316 174.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.14 -50.43 19.45 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.429 0.692 . . . . 0.0 111.042 173.214 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 37.1 m170 -57.78 -37.39 73.61 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.7 mt -98.29 -23.22 15.74 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.772 0.829 . . . . 0.0 113.196 -174.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.14 6.49 74.46 Favored Glycine 0 CA--C 1.534 1.273 0 CA-C-N 119.568 1.077 . . . . 0.0 113.919 -170.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.9 mp -96.93 155.44 16.78 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 118.143 0.971 . . . . 0.0 111.442 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.601 HG23 ' H ' ' A' ' 50' ' ' ASN . 1.4 t -58.21 144.7 39.86 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.971 0.508 . . . . 0.0 111.698 -179.287 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 29.9 mtt85 -55.24 -24.24 26.76 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.084 1.354 . . . . 0.0 111.947 171.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.9 m -65.33 -62.92 1.25 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.096 1.358 . . . . 0.0 111.275 170.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.601 ' H ' HG23 ' A' ' 47' ' ' THR . 3.7 m120 -66.12 -36.9 84.36 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.386 -0.821 . . . . 0.0 111.234 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.41 -31.8 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 O-C-N 120.327 -1.483 . . . . 0.0 113.045 169.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.3 m -75.47 -37.33 60.34 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.327 1.421 . . . . 0.0 113.209 171.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -54.58 -49.22 70.91 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.521 0.728 . . . . 0.0 110.154 172.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 16.7 m80 -64.27 -20.91 66.38 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 65.2 mt -88.98 -18.83 26.61 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 117.033 -1.461 . . . . 0.0 114.443 174.281 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 55.3 m -53.47 -58.0 8.68 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 121.988 2.176 . . . . 0.0 112.114 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 40.5 t -66.01 -45.13 82.64 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 122.853 1.311 . . . . 0.0 110.344 -176.168 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.84 -41.33 57.69 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 127.916 2.487 . . . . 0.0 113.356 -178.32 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.7 mtm180 -84.33 -21.04 31.11 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -177.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -95.7 -45.08 3.0 Favored Glycine 0 N--CA 1.473 1.145 0 CA-C-N 119.275 0.943 . . . . 0.0 113.879 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 51.7 m -66.04 -13.91 60.77 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 124.987 1.315 . . . . 0.0 111.831 174.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 97.45 14.36 41.53 Favored Glycine 0 C--N 1.346 1.1 0 C-N-CA 127.427 2.442 . . . . 0.0 115.848 167.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.9 mt -71.11 -28.62 64.44 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.772 1.286 . . . . 0.0 113.562 179.255 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 3.5 m -140.81 159.11 23.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 126.007 1.723 . . . . 0.0 111.901 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 2.9 t -140.85 160.59 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 125.487 1.515 . . . . 0.0 110.137 -172.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -86.08 146.45 26.61 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.842 1.257 . . . . 0.0 112.344 169.437 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -140.73 174.63 10.33 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.715 1.606 . . . . 0.0 107.396 169.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -111.32 127.47 55.65 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.153 0.981 . . . . 0.0 111.948 169.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -80.66 14.75 1.97 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.858 0.863 . . . . 0.0 110.984 165.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 80.52 -56.34 4.7 Favored Glycine 0 C--N 1.343 0.937 0 C-N-CA 126.415 1.959 . . . . 0.0 112.067 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -76.05 -18.73 59.1 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.173 1.789 . . . . 0.0 112.568 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -164.08 167.3 20.45 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.8 2.04 . . . . 0.0 109.763 -173.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 34.3 m -87.04 154.98 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 O-C-N 121.725 -0.609 . . . . 0.0 110.078 167.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.4 ' HD2' ' HB ' ' A' ' 34' ' ' VAL . 20.4 ptt180 -132.67 169.43 16.67 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 125.321 1.448 . . . . 0.0 109.169 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -108.15 162.03 14.44 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 164.147 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.521 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -152.47 151.14 30.4 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.81 1.644 . . . . 0.0 110.214 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.2 tp -64.03 148.08 50.6 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.059 0.944 . . . . 0.0 109.249 169.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -76.75 -8.0 56.45 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 117.641 2.46 . . . . 0.0 117.641 -169.25 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -179.54 164.38 1.28 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 127.644 2.377 . . . . 0.0 111.883 172.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 26.4 t -47.65 -28.87 2.59 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.235 2.214 . . . . 0.0 112.448 166.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -49.14 -65.07 0.63 Allowed 'General case' 0 C--N 1.341 0.223 0 C-N-CA 125.51 1.524 . . . . 0.0 112.082 169.6 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.9 mt -68.29 -34.22 75.76 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 118.976 0.807 . . . . 0.0 110.138 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.98 -43.81 91.38 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 119.21 0.914 . . . . 0.0 111.207 -174.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.93 -31.69 40.07 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-O 117.906 -1.045 . . . . 0.0 112.574 179.33 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.94 -42.86 59.94 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 120.457 1.48 . . . . 0.0 112.518 176.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.18 -43.06 74.96 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.364 -0.835 . . . . 0.0 110.102 174.373 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.91 -30.47 65.72 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 125.855 1.693 . . . . 0.0 113.394 -174.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -62.79 -25.61 68.31 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 125.029 1.332 . . . . 0.0 111.499 166.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.499 ' C ' ' H ' ' A' ' 91' ' ' GLN . 27.8 tp 77.55 148.39 0.1 Allowed 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 129.139 2.975 . . . . 0.0 107.877 -167.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 4.3 m -57.1 5.09 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 120.396 -1.44 . . . . 0.0 113.969 165.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.499 ' H ' ' C ' ' A' ' 89' ' ' LEU . 28.7 mm-40 71.9 -43.28 0.56 Allowed 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 130.66 3.584 . . . . 0.0 111.026 -175.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -55.47 103.21 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 125.939 1.696 . . . . 0.0 112.937 -171.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.4 t 61.82 -31.03 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 C-N-CA 130.606 3.562 . . . . 0.0 117.651 168.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 tm? 109.38 93.03 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.509 1 C-N-CA 132.278 4.231 . . . . 0.0 101.858 -163.547 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.492 ' H ' HD11 ' A' ' 89' ' ' LEU . . . -62.61 82.57 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 -169.161 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.7 t -63.11 149.58 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 126.835 2.054 . . . . 0.0 111.889 169.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -59.45 -6.82 1.15 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 128.88 2.872 . . . . 0.0 115.403 175.043 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 17.7 p -75.97 113.38 13.41 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.426 1.091 . . . . 0.0 112.294 -175.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -75.44 69.5 2.22 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.864 1.266 . . . . 0.0 110.353 168.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.94 145.34 72.37 Favored Pre-proline 0 CA--C 1.55 0.949 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.478 173.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -63.83 136.1 51.58 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 123.111 2.54 . . . . 0.0 113.47 -168.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.0 t . . . . . 0 CA--C 1.555 1.138 0 C-N-CA 127.347 2.259 . . . . 0.0 111.106 -178.965 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mm? . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 116.011 1.856 . . . . 0.0 116.011 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.13 -52.38 14.42 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.48 1.036 . . . . 0.0 111.568 173.375 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -53.85 -35.17 61.2 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.405 1.482 . . . . 0.0 113.188 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.499 ' CD2' HD22 ' B' ' 63' ' ' LEU . 2.5 tm? -50.28 -56.36 11.54 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 127.597 2.359 . . . . 0.0 110.347 169.454 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.62 -19.61 78.0 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-O 118.858 -0.968 . . . . 0.0 113.781 177.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 57.8 mmt-85 -66.75 -49.4 66.07 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.447 1.623 . . . . 0.0 108.624 168.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.96 -37.22 72.78 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.955 1.702 . . . . 0.0 113.971 -178.146 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 7.0 mp -72.52 -14.84 61.74 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.382 0.992 . . . . 0.0 113.156 176.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -121.84 29.45 7.11 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.107 0.963 . . . . 0.0 112.681 170.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -90.87 153.2 45.17 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 165.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -54.8 -94.36 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.781 1 C-N-CA 126.224 4.616 . . . . 0.0 113.38 -168.16 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 16.5 p -51.7 -31.01 24.35 Favored 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 126.492 1.917 . . . . 0.0 112.625 170.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.87 -42.18 77.37 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.553 1.069 . . . . 0.0 111.726 -176.169 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 39.0 t -61.93 -42.72 99.43 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 119.003 0.819 . . . . 0.0 109.988 167.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -46.52 81.82 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 118.21 -0.9 . . . . 0.0 113.116 175.563 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.4 mm -55.81 -51.77 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 CA-C-N 120.487 1.494 . . . . 0.0 110.091 173.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 79.6 mt -59.68 -42.67 93.44 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 118.635 -0.698 . . . . 0.0 112.408 -177.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 7.1 p -80.45 -30.23 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 118.874 0.761 . . . . 0.0 112.731 -178.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.39 -35.95 68.57 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.586 -0.696 . . . . 0.0 112.215 173.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 20.0 tp -61.76 -37.97 86.27 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 117.068 -1.444 . . . . 0.0 112.5 177.037 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -44.24 -53.77 6.32 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 128.365 2.666 . . . . 0.0 112.28 -177.446 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -88.26 -15.47 35.73 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.732 1.613 . . . . 0.0 112.447 179.171 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.39 -77.54 1.26 Allowed Glycine 0 C--N 1.338 0.682 0 C-N-CA 124.901 1.239 . . . . 0.0 112.281 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 34' ' ' VAL . . . . . 0.425 HG12 ' HA ' ' B' ' 76' ' ' ALA . 29.4 m 37.45 41.21 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 126.582 1.953 . . . . 0.0 114.509 -169.241 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -87.67 -72.78 0.51 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 121.727 -0.608 . . . . 0.0 112.046 -173.749 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 49.4 p90 -155.82 157.49 31.43 Favored Pre-proline 0 CA--C 1.538 0.506 0 CA-C-O 118.761 -0.638 . . . . 0.0 112.571 -170.265 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -60.49 125.04 16.34 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.576 2.184 . . . . 0.0 109.703 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.95 -1.54 88.81 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-O 117.564 -1.687 . . . . 0.0 114.763 -174.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' GLN . . . . . 0.572 HE21 ' HG ' ' B' ' 40' ' ' LEU . 4.3 pp0? -56.81 -36.27 69.73 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.336 2.068 . . . . 0.0 111.015 169.751 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.572 ' HG ' HE21 ' B' ' 39' ' ' GLN . 2.2 mt -61.51 -18.49 59.34 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.218 1.007 . . . . 0.0 112.133 -177.765 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.35 -34.36 75.15 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 118.596 0.635 . . . . 0.0 111.026 175.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.77 -38.66 32.69 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.133 0.973 . . . . 0.0 112.741 175.672 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -62.18 -34.7 76.93 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 172.265 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 26.2 mt -103.55 -23.08 13.53 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -173.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.54 8.29 85.9 Favored Glycine 0 CA--C 1.533 1.216 0 CA-C-N 119.194 0.907 . . . . 0.0 114.015 -170.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 9.3 mp -104.64 155.73 18.6 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 118.404 1.102 . . . . 0.0 112.395 -177.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.536 HG23 ' H ' ' B' ' 50' ' ' ASN . 1.6 t -59.47 145.68 43.03 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.11 0.964 . . . . 0.0 112.282 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 29.5 mtm180 -57.19 -24.08 52.0 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.14 1.376 . . . . 0.0 112.469 169.346 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.9 m -59.76 -59.29 5.66 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.587 1.155 . . . . 0.0 109.856 169.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 50' ' ' ASN . . . . . 0.536 ' H ' HG23 ' B' ' 47' ' ' THR . 2.7 m120 -72.67 -42.51 64.21 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.969 0.908 . . . . 0.0 110.831 -177.482 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.5 t -53.79 -40.53 44.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 120.565 1.53 . . . . 0.0 111.924 171.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 50.5 m -68.66 -39.52 80.6 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 120.078 1.308 . . . . 0.0 113.441 175.124 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -57.99 -48.55 79.68 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.932 0.893 . . . . 0.0 111.259 172.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 19.4 m170 -60.63 -38.49 84.95 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 118.034 -0.984 . . . . 0.0 112.097 173.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 42.7 mt -70.89 -21.22 62.42 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.11 1.364 . . . . 0.0 114.115 174.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 56' ' ' SER . . . . . 0.487 ' HA ' HH21 ' B' ' 59' ' ' ARG . 0.2 OUTLIER -61.14 -59.35 5.48 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 121.476 1.944 . . . . 0.0 112.711 -172.282 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -73.21 -26.35 61.11 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 122.121 0.962 . . . . 0.0 111.487 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.22 -48.17 71.36 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.62 1.568 . . . . 0.0 111.216 169.4 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.487 HH21 ' HA ' ' B' ' 56' ' ' SER . 76.5 mtm180 -82.81 -21.54 34.47 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.537 1.135 . . . . 0.0 112.48 178.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -78.29 -60.45 2.68 Favored Glycine 0 N--CA 1.469 0.891 0 CA-C-N 119.381 0.991 . . . . 0.0 113.234 177.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 20.8 m -67.89 -7.94 32.41 Favored 'General case' 0 CA--C 1.564 1.495 0 C-N-CA 125.236 1.414 . . . . 0.0 114.106 -178.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.87 7.99 54.72 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 127.008 2.242 . . . . 0.0 115.87 171.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.499 HD22 ' CD2' ' B' ' 14' ' ' LEU . 1.7 mt -66.5 -26.38 67.14 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.77 1.628 . . . . 0.0 112.98 -176.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 3.0 m -142.38 159.75 19.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 127.417 2.287 . . . . 0.0 110.723 174.206 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 4.8 t -133.91 167.04 27.22 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 C-N-CA 126.185 1.794 . . . . 0.0 109.449 176.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.33 130.43 50.6 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.652 1.581 . . . . 0.0 111.84 171.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.478 HG22 ' H ' ' B' ' 68' ' ' TYR . 1.3 m -120.64 -178.23 3.66 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.637 1.575 . . . . 0.0 108.223 178.177 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.478 ' H ' HG22 ' B' ' 67' ' ' THR . 29.7 m-85 -116.21 131.46 56.94 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.332 1.053 . . . . 0.0 112.005 169.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.52 10.29 18.23 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.579 0.752 . . . . 0.0 110.484 165.022 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.9 -56.45 4.94 Favored Glycine 0 C--N 1.344 0.984 0 C-N-CA 125.956 1.741 . . . . 0.0 112.182 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -70.49 -19.98 62.89 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.645 1.578 . . . . 0.0 112.553 174.049 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -165.2 168.47 17.05 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.121 2.168 . . . . 0.0 109.621 -174.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 32.9 m -88.3 156.73 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 O-C-N 121.489 -0.757 . . . . 0.0 110.226 167.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 74' ' ' ARG . . . . . 0.439 ' HG2' ' HB ' ' B' ' 67' ' ' THR . 24.2 ptt180 -132.92 173.13 11.72 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.503 1.121 . . . . 0.0 109.034 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -111.59 160.53 17.12 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 164.331 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 76' ' ' ALA . . . . . 0.425 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -156.16 152.87 28.42 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.649 1.58 . . . . 0.0 110.295 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 tp -63.25 158.39 20.28 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.417 1.487 . . . . 0.0 112.594 176.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.67 -29.88 60.09 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 116.958 2.207 . . . . 0.0 116.958 -175.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 10.0 t70 168.63 166.37 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 129.425 3.09 . . . . 0.0 109.4 -169.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 45.2 t -46.11 -33.21 3.36 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.435 1.894 . . . . 0.0 112.121 166.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -45.76 -64.66 0.68 Allowed 'General case' 0 C--N 1.343 0.287 0 C-N-CA 125.208 1.403 . . . . 0.0 112.878 171.661 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 14.5 mt -68.07 -31.91 71.87 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.416 1.007 . . . . 0.0 110.848 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.27 -45.23 94.2 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.416 1.007 . . . . 0.0 110.286 -176.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.95 -40.24 28.49 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.569 0.748 . . . . 0.0 112.765 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.2 -33.58 71.88 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.797 1.18 . . . . 0.0 113.733 179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.13 -42.34 47.17 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.47 -0.769 . . . . 0.0 110.193 170.583 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.05 -39.06 54.8 Favored Glycine 0 CA--C 1.538 1.519 0 C-N-CA 125.6 1.571 . . . . 0.0 114.222 -169.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.84 -31.67 59.45 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 119.116 1.458 . . . . 0.0 109.662 166.217 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 19.3 tp 82.14 160.8 0.14 Allowed 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 128.98 2.912 . . . . 0.0 111.296 169.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 90' ' ' VAL . . . . . 0.511 HG23 HG12 ' B' ' 92' ' ' VAL . 15.9 m -57.07 8.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 127.21 2.204 . . . . 0.0 114.648 169.832 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 71.56 -20.39 0.24 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.461 1.905 . . . . 0.0 114.895 171.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.511 HG12 HG23 ' B' ' 90' ' ' VAL . 2.5 p -54.56 29.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 C-N-CA 131.393 3.877 . . . . 0.0 118.301 -176.363 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.2 t 69.26 15.72 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 125.533 1.533 . . . . 0.0 111.379 171.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 2.1 tm? 101.63 107.3 0.01 OUTLIER 'General case' 0 C--N 1.35 0.601 0 C-N-CA 130.583 3.553 . . . . 0.0 109.055 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.873 0 O-C-N 120.94 -1.1 . . . . 0.0 110.998 168.352 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.5 mm? . . . . . 0 N--CA 1.467 0.401 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.59 -32.04 49.34 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 120.293 1.406 . . . . 0.0 112.91 172.145 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.0 mmt85 -66.94 -18.36 65.34 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 120.312 -1.492 . . . . 0.0 113.017 177.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.554 HD21 HD21 ' A' ' 63' ' ' LEU . 3.1 tm? -70.28 -39.22 75.02 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.6 1.16 . . . . 0.0 110.807 172.644 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.08 -40.83 99.7 Favored Glycine 0 C--N 1.341 0.86 0 N-CA-C 111.099 -0.8 . . . . 0.0 111.099 171.156 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -57.25 -46.03 83.4 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.212 1.006 . . . . 0.0 109.674 171.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.73 -19.63 65.1 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 116.916 -1.516 . . . . 0.0 113.578 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 mp -98.4 -16.35 19.31 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 171.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.86 -34.17 51.81 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.633 1.973 . . . . 0.0 114.3 169.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -50.85 136.37 26.74 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 125.098 1.359 . . . . 0.0 111.203 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -60.01 -77.34 0.02 OUTLIER 'Trans proline' 0 CA--C 1.537 0.647 1 C-N-CA 125.47 4.113 . . . . 0.0 113.23 -169.03 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.443 ' HB ' ' CD2' ' A' ' 54' ' ' HIS . 24.6 m -53.98 -36.7 63.18 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 117.59 -1.195 . . . . 0.0 110.408 174.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.32 -43.0 82.7 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.915 1.234 . . . . 0.0 113.336 -175.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 11.8 t -54.43 -44.63 72.62 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.601 1.16 . . . . 0.0 110.276 168.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -43.68 93.98 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-O 117.857 -1.068 . . . . 0.0 112.444 175.13 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -54.44 -50.45 57.68 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 C-N-CA 125.948 1.699 . . . . 0.0 111.061 174.528 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 14.9 mt -52.57 -39.39 61.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 118.671 -0.68 . . . . 0.0 112.573 -176.081 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.08 -20.26 26.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 118.807 0.731 . . . . 0.0 112.559 -177.725 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.39 -6.93 59.43 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 174.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -105.91 -13.26 15.55 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 169.287 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.47 -48.35 64.72 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 127.394 2.277 . . . . 0.0 108.773 165.08 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -135.86 96.06 3.35 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.514 2.726 . . . . 0.0 107.932 175.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 159.59 -95.8 0.14 Allowed Glycine 0 N--CA 1.468 0.78 0 C-N-CA 124.824 1.202 . . . . 0.0 111.105 176.564 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.0 m 51.4 33.13 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 178.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 2.4 m -80.55 -65.58 0.99 Allowed 'General case' 0 C--O 1.222 -0.364 0 O-C-N 121.199 -0.938 . . . . 0.0 111.284 178.676 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -150.96 157.5 35.41 Favored Pre-proline 0 N--CA 1.47 0.533 0 CA-C-O 117.731 -1.128 . . . . 0.0 111.069 -172.56 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -59.07 -18.1 41.76 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 122.892 2.395 . . . . 0.0 114.166 169.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -86.91 -12.27 68.83 Favored Glycine 0 CA--C 1.536 1.403 0 CA-C-O 118.494 -1.17 . . . . 0.0 115.252 170.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.87 -36.67 56.6 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.884 1.842 . . . . 0.0 112.051 -170.018 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.686 HD12 ' H ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -66.71 -19.4 65.75 Favored 'General case' 0 C--O 1.217 -0.616 0 C-N-CA 123.14 0.576 . . . . 0.0 110.919 -174.546 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.8 -36.75 79.82 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.387 -0.82 . . . . 0.0 112.734 -177.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -75.0 -47.76 27.53 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 122.794 0.437 . . . . 0.0 110.926 170.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -57.68 -35.72 70.97 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.766 1.226 . . . . 0.0 113.919 -176.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.434 HD12 HG22 ' A' ' 51' ' ' VAL . 65.7 mt -94.53 -15.27 24.29 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 127.598 2.359 . . . . 0.0 112.324 -178.605 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.33 10.96 54.88 Favored Glycine 0 CA--C 1.53 1.023 0 C-N-CA 124.291 0.948 . . . . 0.0 112.976 -170.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.4 mt -117.22 149.99 39.49 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 124.107 0.963 . . . . 0.0 111.427 -169.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 12.7 p -61.75 147.31 46.61 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.833 -0.542 . . . . 0.0 110.115 -172.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -59.15 -20.33 52.77 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 177.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.0 m -73.94 -46.53 43.64 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.138 0.975 . . . . 0.0 112.085 169.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -65.09 -44.2 89.62 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.364 1.065 . . . . 0.0 111.889 175.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.434 HG22 HD12 ' A' ' 44' ' ' LEU . 23.2 t -61.53 -40.87 87.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.725 1.21 . . . . 0.0 111.391 173.11 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 70.7 m -64.04 -41.35 97.44 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.921 1.237 . . . . 0.0 112.717 172.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -55.11 -48.93 72.93 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 123.491 0.716 . . . . 0.0 111.48 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' HIS . . . . . 0.443 ' CD2' ' HB ' ' A' ' 22' ' ' THR 0.272 11.2 m-70 -80.4 -22.98 40.71 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.811 1.412 . . . . 0.0 114.811 176.45 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 31.4 mt -65.16 -30.5 71.42 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.773 1.624 . . . . 0.0 110.619 166.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.6 t -50.76 -59.81 3.71 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.568 1.076 . . . . 0.0 112.857 -173.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 9.0 t -78.29 -11.02 59.91 Favored 'General case' 0 CA--C 1.554 1.112 0 O-C-N 121.476 -0.765 . . . . 0.0 112.227 174.33 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.9 tp -68.15 -36.28 79.42 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 122.065 2.211 . . . . 0.0 109.882 168.09 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.0 mtp180 -81.34 -12.77 58.92 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.37 1.868 . . . . 0.0 111.131 173.09 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -88.48 -60.84 1.5 Allowed Glycine 0 C--N 1.34 0.8 0 C-N-CA 125.044 1.307 . . . . 0.0 111.006 176.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 96.1 m -59.2 8.13 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 128.361 2.664 . . . . 0.0 115.022 171.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.23 -3.55 14.67 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 126.202 1.858 . . . . 0.0 115.743 177.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.554 HD21 HD21 ' A' ' 14' ' ' LEU . 75.4 mt -59.65 -29.53 68.1 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 126.398 1.879 . . . . 0.0 114.555 -174.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.38 137.25 58.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 125.16 1.384 . . . . 0.0 111.95 173.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.6 t -118.06 139.86 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 C-N-CA 125.849 1.66 . . . . 0.0 109.298 174.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -89.01 149.58 23.19 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.556 1.142 . . . . 0.0 113.461 177.046 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 m -171.16 157.79 5.25 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 126.442 1.897 . . . . 0.0 108.05 -176.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -73.1 143.79 47.24 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 118.903 0.774 . . . . 0.0 112.529 171.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.438 ' CD ' ' H ' ' A' ' 70' ' ' GLY 0.289 2.2 pp20? -84.75 -124.42 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 117.034 -1.46 . . . . 0.0 107.654 165.264 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.438 ' H ' ' CD ' ' A' ' 69' ' ' GLU . . . -77.29 -28.82 57.35 Favored Glycine 0 CA--C 1.537 1.416 0 CA-C-N 121.919 2.145 . . . . 0.0 114.286 171.288 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.49 -29.02 0.07 Allowed 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 119.15 1.475 . . . . 0.0 114.818 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -81.99 168.86 17.41 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 125.711 1.605 . . . . 0.0 111.011 169.437 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 26.7 m -98.84 146.78 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 123.272 0.629 . . . . 0.0 110.181 169.112 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -129.83 168.64 16.28 Favored 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 125.432 1.493 . . . . 0.0 111.626 -171.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -121.6 129.0 52.54 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 124.97 1.308 . . . . 0.0 109.215 170.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -143.05 153.44 42.95 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 125.333 1.453 . . . . 0.0 111.398 -173.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 68.7 mt -64.42 147.24 53.09 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -177.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.35 -28.71 61.26 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -172.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -163.8 159.54 21.36 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 123.148 1.451 . . . . 0.0 112.931 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 96.0 p -43.42 -36.34 1.91 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 128.646 2.778 . . . . 0.0 113.815 167.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -50.78 -52.68 38.5 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 125.201 1.4 . . . . 0.0 112.59 172.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.9 mt -71.43 -53.4 14.12 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.31 -36.52 61.33 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.661 1.185 . . . . 0.0 113.0 -177.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -74.92 -57.42 3.92 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 117.726 -1.131 . . . . 0.0 111.974 -177.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.7 -27.33 68.84 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.466 1.03 . . . . 0.0 112.869 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 60.1 tp -69.35 -41.15 76.98 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.565 1.146 . . . . 0.0 111.469 169.026 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -78.47 -38.36 25.05 Favored Glycine 0 N--CA 1.469 0.88 0 C-N-CA 126.692 2.091 . . . . 0.0 115.129 -172.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -82.94 -16.6 46.74 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 118.637 1.219 . . . . 0.0 113.014 171.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 43.5 tp 67.95 140.94 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 128.841 2.856 . . . . 0.0 112.241 178.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 34.7 m -63.64 22.19 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.434 1.893 . . . . 0.0 114.656 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 81.08 -26.91 0.14 Allowed 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 125.98 1.712 . . . . 0.0 112.949 158.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.406 ' CG2' HD12 ' B' ' 11' ' ' LEU . 4.1 p -54.44 23.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 C-N-CA 131.57 3.948 . . . . 0.0 118.135 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 68.56 11.69 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 O-C-N 120.379 -1.45 . . . . 0.0 112.459 167.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.1 tt 84.94 100.93 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 129.389 3.076 . . . . 0.0 109.369 -172.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.93 108.13 0.98 Allowed 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 -175.054 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -66.89 150.42 11.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 125.125 1.37 . . . . 0.0 113.843 169.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -87.41 146.22 25.96 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.423 1.889 . . . . 0.0 108.621 165.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -173.01 136.29 0.65 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.557 1.943 . . . . 0.0 109.164 -177.498 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.0 p30 -67.48 -31.12 71.05 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 129.783 3.233 . . . . 0.0 112.115 169.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.09 168.26 2.3 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 128.501 2.721 . . . . 0.0 113.378 172.609 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -68.49 158.73 56.42 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 123.017 2.478 . . . . 0.0 112.848 -172.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 31.4 p . . . . . 0 CA--C 1.542 0.661 0 CA-C-O 123.418 1.58 . . . . 0.0 106.793 165.827 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.406 HD12 ' CG2' ' A' ' 92' ' ' VAL . 4.0 mm? . . . . . 0 CA--C 1.539 0.535 0 N-CA-C 114.487 1.291 . . . . 0.0 114.487 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.91 -39.46 62.78 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 120.975 1.716 . . . . 0.0 110.027 167.05 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 67.8 mtt180 -72.25 -13.35 61.5 Favored 'General case' 0 CA--C 1.55 0.976 0 O-C-N 120.334 -1.479 . . . . 0.0 113.58 178.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -69.59 -41.85 75.21 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 120.14 1.336 . . . . 0.0 109.751 169.196 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -60.37 -38.54 94.87 Favored Glycine 0 N--CA 1.47 0.958 0 O-C-N 120.911 -1.118 . . . . 0.0 111.91 172.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -58.09 -38.86 77.23 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.711 -0.876 . . . . 0.0 110.659 172.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.12 -12.93 61.07 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 117.86 -1.067 . . . . 0.0 113.77 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 12.4 mt -93.7 -25.71 17.33 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.205 0.911 . . . . 0.0 112.258 169.177 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.67 -20.54 49.98 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.641 1.976 . . . . 0.0 114.638 168.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' ASP . . . . . 0.474 ' CG ' ' HE ' ' B' ' 23' ' ' ARG . 9.7 t70 -56.92 130.09 78.71 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 127.287 2.235 . . . . 0.0 109.371 178.758 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -49.03 -83.0 0.02 OUTLIER 'Trans proline' 0 C--O 1.237 0.452 1 C-N-CA 126.925 5.083 . . . . 0.0 114.003 -165.28 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.435 ' HB ' ' CG ' ' B' ' 54' ' ' HIS . 59.8 m -59.6 -32.63 70.57 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 116.652 -1.642 . . . . 0.0 110.89 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.474 ' HE ' ' CG ' ' B' ' 20' ' ' ASP . 23.7 mtm180 -62.27 -42.41 99.31 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 121.136 1.789 . . . . 0.0 114.441 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 6.7 t -52.47 -47.84 66.25 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.689 0.757 . . . . 0.0 110.413 173.378 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.57 -42.47 82.51 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.488 1.115 . . . . 0.0 112.849 175.016 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -53.21 -52.12 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 C-N-CA 126.585 1.954 . . . . 0.0 110.263 176.089 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 25.4 mt -54.73 -37.34 65.77 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 123.556 0.742 . . . . 0.0 112.167 -172.287 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -64.03 -22.15 30.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 118.928 0.785 . . . . 0.0 112.821 178.006 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.14 -5.11 59.19 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.031 1.332 . . . . 0.0 114.286 173.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -106.8 -19.57 13.6 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 124.867 1.267 . . . . 0.0 113.562 170.5 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.24 -48.06 77.25 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 127.191 2.197 . . . . 0.0 108.953 164.215 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -135.12 93.56 3.01 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 128.324 2.649 . . . . 0.0 108.462 175.096 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . 161.86 -92.73 0.11 Allowed Glycine 0 N--CA 1.468 0.773 0 C-N-CA 124.552 1.073 . . . . 0.0 112.145 173.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 4.0 m 51.4 35.86 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 2.7 m -81.8 -66.88 0.83 Allowed 'General case' 0 C--O 1.223 -0.336 0 O-C-N 121.185 -0.947 . . . . 0.0 111.694 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -147.98 157.17 43.71 Favored Pre-proline 0 CA--C 1.537 0.465 0 CA-C-O 117.738 -1.125 . . . . 0.0 110.685 -174.658 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -59.1 -14.25 22.77 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 123.299 2.666 . . . . 0.0 114.599 171.244 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -93.89 -14.3 52.61 Favored Glycine 0 CA--C 1.535 1.336 0 CA-C-O 118.242 -1.31 . . . . 0.0 115.465 170.159 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.65 -34.13 73.57 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.262 2.031 . . . . 0.0 112.108 -170.454 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.653 ' H ' HD12 ' B' ' 40' ' ' LEU . 0.2 OUTLIER -66.81 -19.01 65.66 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 123.75 0.82 . . . . 0.0 110.511 -172.984 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.52 -37.32 80.78 Favored 'General case' 0 CA--C 1.547 0.833 0 O-C-N 120.891 -1.131 . . . . 0.0 112.174 -177.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.04 -46.83 27.3 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.168 0.587 . . . . 0.0 111.361 171.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -58.72 -32.31 69.08 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -176.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.406 HD12 HG22 ' B' ' 51' ' ' VAL . 69.2 mt -98.93 -20.24 16.9 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 127.128 2.171 . . . . 0.0 112.674 -177.21 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.4 13.52 77.22 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 124.807 1.194 . . . . 0.0 112.964 -170.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 76.3 mt -118.69 151.36 38.12 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 118.229 1.014 . . . . 0.0 111.96 -169.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.8 p -62.89 145.53 54.94 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.497 -0.752 . . . . 0.0 109.783 -173.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -61.39 -17.39 53.9 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 176.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 6.0 m -73.42 -47.94 37.8 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.212 1.005 . . . . 0.0 111.68 169.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -66.17 -45.42 80.94 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.756 0.822 . . . . 0.0 111.134 175.433 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 51' ' ' VAL . . . . . 0.406 HG22 HD12 ' B' ' 44' ' ' LEU . 5.3 t -58.3 -40.02 76.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 117.929 -1.034 . . . . 0.0 112.218 171.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 67.8 m -67.34 -41.04 85.85 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 121.005 1.729 . . . . 0.0 112.676 174.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -57.99 -47.65 82.35 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.488 0.715 . . . . 0.0 111.218 177.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 54' ' ' HIS . . . . . 0.435 ' CG ' ' HB ' ' B' ' 22' ' ' THR . 79.0 m-70 -75.75 -26.11 57.13 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 121.262 -0.899 . . . . 0.0 113.329 175.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 38.3 mt -66.07 -29.43 69.77 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 121.077 1.762 . . . . 0.0 111.193 167.211 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.2 t -51.33 -57.93 7.56 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.593 1.088 . . . . 0.0 113.375 -172.086 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 34.2 t -79.69 -9.79 59.69 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 123.542 0.737 . . . . 0.0 112.672 172.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.2 tp -67.03 -37.57 84.36 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 121.965 2.166 . . . . 0.0 109.063 167.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 22.6 mtp-105 -82.2 -7.28 59.62 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.08 2.152 . . . . 0.0 111.429 174.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -91.14 -64.35 1.18 Allowed Glycine 0 C--N 1.342 0.863 0 C-N-CA 125.936 1.732 . . . . 0.0 111.358 173.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 67.8 m -61.1 13.79 0.01 OUTLIER 'General case' 0 CA--C 1.563 1.472 0 C-N-CA 128.227 2.611 . . . . 0.0 115.238 172.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.06 -2.36 6.97 Favored Glycine 0 N--CA 1.474 1.216 0 C-N-CA 126.439 1.971 . . . . 0.0 115.836 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.45 HD23 HD13 ' B' ' 82' ' ' LEU . 52.7 mt -59.27 -28.26 66.57 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.845 1.658 . . . . 0.0 113.8 -175.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -129.46 137.32 57.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 125.243 1.417 . . . . 0.0 112.636 172.869 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 75.1 t -116.0 136.75 51.91 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 C-N-CA 126.289 1.836 . . . . 0.0 109.566 171.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.68 145.56 28.71 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 122.192 0.996 . . . . 0.0 112.457 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 41.1 m -158.68 159.44 35.32 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 126.048 1.739 . . . . 0.0 107.206 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -83.63 144.2 29.59 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 119.481 1.037 . . . . 0.0 111.771 170.578 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.269 2.6 pp20? -88.39 -141.48 0.13 Allowed 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 165.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -69.82 -23.09 77.06 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 121.636 2.016 . . . . 0.0 114.572 177.289 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.72 -30.12 0.07 Allowed 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 -89.36 171.92 9.4 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 126.826 2.05 . . . . 0.0 112.068 174.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 19.7 m -96.13 150.21 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.315 0.646 . . . . 0.0 109.742 167.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -137.57 163.54 30.94 Favored 'General case' 0 CA--C 1.521 -0.139 0 C-N-CA 125.73 1.612 . . . . 0.0 110.935 -171.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -119.54 127.83 53.37 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 125.238 1.415 . . . . 0.0 109.187 174.149 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -141.15 156.06 46.0 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.348 1.459 . . . . 0.0 110.971 -175.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 61.8 mt -63.85 148.38 49.5 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.155 0.502 . . . . 0.0 111.751 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.0 -28.07 62.16 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 -173.093 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -167.16 160.12 13.52 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.06 1.344 . . . . 0.0 111.715 -178.078 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 94.6 p -41.7 -35.91 0.87 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 128.134 2.574 . . . . 0.0 113.448 167.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -48.38 -54.76 12.79 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 126.08 1.752 . . . . 0.0 112.784 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 82' ' ' LEU . . . . . 0.45 HD13 HD23 ' B' ' 63' ' ' LEU . 7.5 mt -75.32 -47.07 29.49 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.629 -0.7 . . . . 0.0 109.474 -177.256 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.42 -36.08 53.45 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.103 0.961 . . . . 0.0 113.026 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -76.03 -56.13 4.95 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.888 1.275 . . . . 0.0 111.865 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.81 -28.96 66.49 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 176.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 61.1 tp -77.64 -37.5 49.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.426 1.89 . . . . 0.0 112.524 171.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -80.95 -42.37 9.69 Favored Glycine 0 N--CA 1.469 0.837 0 C-N-CA 126.035 1.779 . . . . 0.0 113.915 -169.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -80.69 -23.74 39.35 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 117.967 0.884 . . . . 0.0 111.372 168.126 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 19.8 tp 68.76 160.71 0.19 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 129.464 3.106 . . . . 0.0 111.398 178.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 90' ' ' VAL . . . . . 0.407 HG23 HG12 ' B' ' 92' ' ' VAL . 17.8 m -58.92 12.22 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 125.857 1.663 . . . . 0.0 114.087 167.351 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 73.82 -17.75 0.43 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 126.146 1.778 . . . . 0.0 114.229 168.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.407 HG12 HG23 ' B' ' 90' ' ' VAL . 1.6 p -59.49 20.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 C-N-CA 128.187 2.595 . . . . 0.0 116.863 177.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.4 t 65.87 23.45 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 C-N-CA 125.373 1.469 . . . . 0.0 113.656 165.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 tt 79.34 92.56 0.06 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 127.47 2.308 . . . . 0.0 110.203 -176.044 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.694 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 178.279 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 N--CA 1.473 0.724 0 N-CA-C 113.199 0.815 . . . . 0.0 113.199 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.21 -34.38 76.35 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.173 -0.955 . . . . 0.0 112.356 178.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -58.27 -31.48 67.48 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 120.983 -1.073 . . . . 0.0 112.893 -176.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -49.57 -58.08 5.9 Favored 'General case' 0 C--O 1.225 -0.228 0 C-N-CA 126.119 1.768 . . . . 0.0 110.576 173.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -61.3 -35.01 90.29 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-N 118.77 0.714 . . . . 0.0 112.186 -173.11 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.8 -50.42 62.69 Favored 'General case' 0 C--O 1.221 -0.434 0 C-N-CA 124.043 0.937 . . . . 0.0 110.538 173.072 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.99 -22.93 64.98 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -177.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -88.19 -24.76 23.21 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 119.107 0.867 . . . . 0.0 112.133 170.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.45 31.74 1.48 Allowed 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.652 1.581 . . . . 0.0 112.574 167.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.56 167.29 21.28 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 125.528 1.531 . . . . 0.0 107.407 167.492 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.76 -105.9 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 123.975 3.117 . . . . 0.0 109.997 174.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.7 m -63.85 -14.76 55.87 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.626 1.57 . . . . 0.0 113.078 -178.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.75 -37.86 87.53 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 120.285 1.402 . . . . 0.0 111.765 169.366 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 19.8 t -64.93 -40.18 94.64 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 118.901 0.773 . . . . 0.0 110.593 172.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 13.5 mmp_? -59.69 -51.4 69.96 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.941 0.896 . . . . 0.0 112.77 172.764 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.3 mm -47.7 -57.16 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 124.279 1.032 . . . . 0.0 110.835 170.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 86.9 mt -60.8 -50.4 73.62 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.022 0.828 . . . . 0.0 112.092 -176.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.4 p -72.12 -27.07 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -174.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.3 -26.23 28.7 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.358 0.663 . . . . 0.0 112.685 173.426 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.499 ' O ' HG13 ' A' ' 34' ' ' VAL . 7.8 mt -63.2 -41.76 99.21 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 117.879 -1.057 . . . . 0.0 112.154 170.007 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -40.13 -51.89 2.6 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.93 2.492 . . . . 0.0 114.492 -177.122 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -97.8 -16.08 19.99 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.613 1.565 . . . . 0.0 112.459 173.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.09 -46.9 9.75 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 125.388 1.471 . . . . 0.0 115.069 -174.406 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.546 HG12 ' HA ' ' A' ' 76' ' ' ALA . 15.9 m 3.48 58.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 131.245 3.818 . . . . 0.0 118.603 -178.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 55.6 m -118.65 -57.86 2.01 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.517 1.927 . . . . 0.0 111.669 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -149.02 148.77 28.16 Favored Pre-proline 0 N--CA 1.474 0.728 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -171.058 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -55.53 -45.34 40.4 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 122.7 2.266 . . . . 0.0 112.406 172.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -74.89 -6.55 78.86 Favored Glycine 0 CA--C 1.532 1.14 0 CA-C-O 118.836 -0.98 . . . . 0.0 114.541 178.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -65.42 -33.74 76.66 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.159 1.48 . . . . 0.0 111.875 -175.184 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.49 HD21 ' HG ' ' A' ' 30' ' ' LEU . 2.2 mt -64.39 -6.97 8.18 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 123.443 0.697 . . . . 0.0 112.043 -175.607 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.84 -39.96 95.47 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 122.638 0.375 . . . . 0.0 110.462 172.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.77 -38.85 62.07 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.608 0.763 . . . . 0.0 111.59 171.327 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.412 ' HD2' HD23 ' A' ' 40' ' ' LEU . 2.4 m-70 -61.63 -23.73 66.24 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 177.735 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 69.0 mt -119.81 -16.3 8.75 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.076 1.35 . . . . 0.0 113.941 -173.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.78 10.31 67.4 Favored Glycine 0 CA--C 1.537 1.423 0 CA-C-N 118.99 0.814 . . . . 0.0 112.925 -168.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 79.4 mt -104.86 158.26 16.65 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.574 1.187 . . . . 0.0 112.98 -171.27 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.2 t -66.4 153.37 42.96 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 122.103 0.954 . . . . 0.0 111.374 176.238 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -54.59 -22.47 13.45 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.348 1.459 . . . . 0.0 113.424 173.114 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.6 t -67.39 -56.71 8.57 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.336 0.971 . . . . 0.0 111.293 169.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -62.69 -37.58 87.02 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.47 1.108 . . . . 0.0 112.151 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.8 t -58.16 -50.0 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 123.557 0.743 . . . . 0.0 111.024 169.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.4 m -63.34 -34.09 76.95 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 177.009 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -57.43 -52.63 64.59 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.722 1.609 . . . . 0.0 110.651 -178.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 49.1 m-70 -76.98 -19.0 57.85 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.343 1.238 . . . . 0.0 114.343 175.551 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 41.7 mt -76.05 -22.14 56.01 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 120.402 1.456 . . . . 0.0 112.845 169.02 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 88.9 p -52.2 -64.13 0.92 Allowed 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 120.648 1.567 . . . . 0.0 113.48 -175.216 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 51.0 t -64.69 -39.62 93.97 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.404 1.082 . . . . 0.0 110.785 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.5 tp -48.02 -40.65 23.41 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.673 1.589 . . . . 0.0 113.761 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 -88.1 -17.0 31.99 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.928 1.291 . . . . 0.0 113.3 -175.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -93.3 -45.55 3.49 Favored Glycine 0 N--CA 1.477 1.4 0 C-N-CA 125.248 1.404 . . . . 0.0 111.959 175.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 55.5 m -75.23 7.58 3.32 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 127.151 2.181 . . . . 0.0 112.866 170.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 66.1 6.28 31.42 Favored Glycine 0 N--CA 1.468 0.827 0 C-N-CA 126.019 1.771 . . . . 0.0 117.083 169.489 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 47.2 mt -61.37 -19.95 62.45 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.4 1.6 . . . . 0.0 113.384 178.221 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.1 m -132.47 147.26 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 127.333 2.253 . . . . 0.0 111.862 169.032 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 82.8 t -128.82 137.37 57.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 126.791 2.036 . . . . 0.0 109.616 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.19 172.82 11.08 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 123.126 1.441 . . . . 0.0 114.346 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.7 m -160.72 149.16 16.37 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.92 1.288 . . . . 0.0 108.514 177.582 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -98.63 114.25 26.64 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.692 1.133 . . . . 0.0 110.869 168.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.46 ' CD ' ' HD3' ' A' ' 74' ' ' ARG . 12.1 mm-40 -93.52 34.36 1.18 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.144 1.778 . . . . 0.0 113.428 -173.27 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.33 -17.35 1.08 Allowed Glycine 0 CA--C 1.536 1.363 0 O-C-N 120.209 -1.557 . . . . 0.0 115.254 174.044 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -145.26 -17.09 0.49 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.28 1.432 . . . . 0.0 113.773 -178.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -152.61 -178.98 7.2 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 127.944 2.498 . . . . 0.0 107.105 175.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 16.3 m -108.85 155.48 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 123.785 0.834 . . . . 0.0 109.212 168.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.46 ' HD3' ' CD ' ' A' ' 69' ' ' GLU . 2.2 ptt180 -122.95 175.21 6.7 Favored 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 124.76 1.224 . . . . 0.0 111.092 176.456 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.402 ' O ' HD22 ' A' ' 30' ' ' LEU . 39.1 m-85 -130.76 118.66 21.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.094 -1.412 . . . . 0.0 107.914 168.423 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.546 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -108.92 156.97 19.08 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 125.07 1.348 . . . . 0.0 109.396 174.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.2 tp -54.99 152.27 7.76 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.048 1.339 . . . . 0.0 111.377 172.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -45.54 -48.35 14.27 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.514 1.302 . . . . 0.0 114.514 -171.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -171.87 -179.96 2.57 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.122 0.963 . . . . 0.0 111.308 -176.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.6 p -42.78 -39.23 2.39 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.441 1.896 . . . . 0.0 112.309 167.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -54.19 -57.08 12.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.469 1.507 . . . . 0.0 113.262 177.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 18.4 mt -74.61 -34.87 62.92 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.9 1.227 . . . . 0.0 110.626 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.39 -21.92 66.73 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.457 0.571 . . . . 0.0 112.329 -178.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -81.58 -74.28 0.34 Allowed 'General case' 0 C--O 1.219 -0.515 0 CA-C-O 116.753 -1.594 . . . . 0.0 111.278 166.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.04 -21.91 66.71 Favored 'General case' 0 CA--C 1.555 1.168 0 CA-C-N 123.06 2.663 . . . . 0.0 115.974 -169.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.69 -42.62 50.57 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 120.553 1.524 . . . . 0.0 109.702 167.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -66.26 -32.32 81.74 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 127.912 2.672 . . . . 0.0 115.6 179.102 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.32 -27.25 62.04 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 126.85 2.06 . . . . 0.0 112.416 169.582 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 28.6 tp 71.29 97.95 0.07 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 128.408 2.683 . . . . 0.0 108.909 -170.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.464 HG23 HG12 ' A' ' 92' ' ' VAL . 33.6 m -51.62 11.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 129.414 3.086 . . . . 0.0 118.418 -176.73 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.5 mm-40 80.64 -28.58 0.13 Allowed 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 119.749 -1.844 . . . . 0.0 113.464 157.659 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.464 HG12 HG23 ' A' ' 90' ' ' VAL . 4.9 p -62.12 43.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 C-N-CA 128.755 2.822 . . . . 0.0 115.691 176.453 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 67.32 6.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 C-N-CA 127.609 2.364 . . . . 0.0 113.058 177.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.8 tt 71.97 93.71 0.08 Allowed 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 127.731 2.412 . . . . 0.0 107.414 -168.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.49 123.23 14.04 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.108 0.563 . . . . 0.0 112.326 -173.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 29.0 t -63.55 164.78 1.38 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 126.19 1.796 . . . . 0.0 110.149 169.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.88 19.27 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 126.098 1.759 . . . . 0.0 113.905 172.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 16.3 p -109.39 131.58 54.93 Favored 'General case' 0 CA--C 1.516 -0.352 0 O-C-N 120.124 -1.61 . . . . 0.0 114.268 -173.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -87.89 131.31 34.62 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 105.81 -1.922 . . . . 0.0 105.81 162.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -132.84 137.88 30.66 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 105.675 -1.972 . . . . 0.0 105.675 -174.665 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -73.6 179.37 5.65 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 124.682 3.588 . . . . 0.0 113.367 -168.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.55 0.967 0 CA-C-O 121.595 0.712 . . . . 0.0 111.178 178.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 29.3 mt . . . . . 0 N--CA 1.469 0.52 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.31 -37.69 68.89 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 122.833 0.453 . . . . 0.0 112.166 173.221 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.33 -30.19 62.27 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -176.449 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -46.4 -60.93 2.04 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 127.199 2.2 . . . . 0.0 110.015 169.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.13 -21.96 70.36 Favored Glycine 0 C--N 1.338 0.684 0 CA-C-O 118.806 -0.997 . . . . 0.0 112.842 -172.2 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -53.81 8.79 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.388 1.094 . . . . 0.0 110.171 169.089 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.98 -22.77 65.9 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -174.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -87.97 -19.38 27.3 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.369 0.986 . . . . 0.0 112.093 169.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -82.31 63.65 6.59 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.009 1.324 . . . . 0.0 110.097 171.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.5 166.88 20.13 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 125.033 1.333 . . . . 0.0 112.73 -168.761 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -71.64 -116.82 0.01 OUTLIER 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 124.671 3.581 . . . . 0.0 107.781 165.193 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 42.4 p -60.19 -22.18 62.64 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 -173.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.423 ' CG ' HD13 ' B' ' 58' ' ' LEU . 4.5 ttp180 -61.57 -36.24 80.08 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 121.635 2.016 . . . . 0.0 112.23 174.541 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 48.7 t -69.25 -41.74 76.54 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.027 0.83 . . . . 0.0 111.577 168.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 17.1 mmp_? -58.97 -52.44 65.73 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.372 0.669 . . . . 0.0 112.075 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 18.3 mm -42.78 -56.16 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 125.837 1.655 . . . . 0.0 109.832 172.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 94.6 mt -62.71 -45.53 92.33 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 118.983 -0.532 . . . . 0.0 112.422 -175.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 8.4 p -74.24 -28.05 22.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -178.621 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.8 -25.75 27.96 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 175.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.506 HD23 ' HA ' ' B' ' 30' ' ' LEU . 9.0 mt -62.23 -43.05 99.72 Favored 'General case' 0 CA--C 1.52 -0.178 0 O-C-N 121.28 -0.888 . . . . 0.0 111.977 172.28 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -41.65 -45.18 3.34 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 129.137 2.975 . . . . 0.0 115.092 -174.653 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -117.35 13.17 14.48 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 126.059 1.744 . . . . 0.0 112.658 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.69 -69.34 0.77 Allowed Glycine 0 N--CA 1.472 1.093 0 C-N-CA 127.321 2.391 . . . . 0.0 112.806 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 29.43 41.13 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 128.599 2.76 . . . . 0.0 117.201 -177.623 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 94.2 m -84.07 -79.31 0.21 Allowed 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 125.443 1.497 . . . . 0.0 110.208 173.524 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.36 158.35 51.17 Favored Pre-proline 0 N--CA 1.482 1.143 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 -168.436 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.08 -34.69 93.39 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 123.162 2.574 . . . . 0.0 113.519 176.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -76.92 -12.43 84.61 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-O 118.419 -1.212 . . . . 0.0 113.916 175.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.12 -31.15 72.2 Favored 'General case' 0 C--N 1.348 0.502 0 CA-C-N 120.076 1.938 . . . . 0.0 112.424 -170.023 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.447 HD21 ' HG ' ' B' ' 30' ' ' LEU . 1.1 mt -69.06 -7.34 34.88 Favored 'General case' 0 C--N 1.342 0.258 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -175.699 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.0 -39.06 80.7 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 118.422 0.555 . . . . 0.0 110.651 169.006 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.79 -43.93 57.41 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.62 0.768 . . . . 0.0 111.867 172.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 55.5 m170 -59.13 -27.1 65.3 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 67.9 mt -111.83 -16.59 13.13 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.983 1.713 . . . . 0.0 113.533 -177.379 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.09 15.26 69.45 Favored Glycine 0 CA--C 1.536 1.367 0 CA-C-N 118.757 0.708 . . . . 0.0 112.708 -168.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 86.4 mt -108.76 171.04 7.66 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.753 1.276 . . . . 0.0 113.453 -173.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.9 t -69.98 151.09 45.99 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 122.026 0.917 . . . . 0.0 111.149 169.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -54.45 -18.92 4.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.686 1.594 . . . . 0.0 113.553 168.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 11.7 t -68.05 -58.62 4.2 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.066 0.848 . . . . 0.0 111.493 169.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -59.32 -36.73 76.16 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.452 -0.78 . . . . 0.0 112.531 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 42.1 t -57.83 -50.29 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 123.419 0.688 . . . . 0.0 111.027 170.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 41.2 m -68.7 -31.82 71.18 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -178.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 32.4 t-20 -57.43 -62.0 2.09 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.212 1.405 . . . . 0.0 109.806 178.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 -68.13 -24.53 65.02 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 121.034 -1.041 . . . . 0.0 112.876 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 73.7 mt -69.97 -19.19 63.37 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 119.711 1.141 . . . . 0.0 113.76 170.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 89.3 p -58.16 -48.17 81.11 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 121.075 1.761 . . . . 0.0 111.892 174.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 51.7 t -68.89 -46.23 68.91 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.566 0.621 . . . . 0.0 111.034 175.169 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 58' ' ' LEU . . . . . 0.423 HD13 ' CG ' ' B' ' 23' ' ' ARG . 2.9 tp -57.52 -36.83 72.08 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.307 1.043 . . . . 0.0 113.357 -171.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -90.13 -16.38 29.7 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.242 1.417 . . . . 0.0 112.867 178.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -79.97 -51.71 4.95 Favored Glycine 0 N--CA 1.472 1.06 0 CA-C-N 119.38 0.991 . . . . 0.0 111.135 170.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 83.4 m -74.44 3.19 7.91 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 126.913 2.085 . . . . 0.0 113.903 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.53 3.95 50.24 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.006 1.288 . . . . 0.0 115.446 169.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 84.5 mt -57.85 -23.81 54.59 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.496 1.648 . . . . 0.0 112.619 176.291 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.8 m -126.73 147.6 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 126.742 2.017 . . . . 0.0 111.662 168.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 65.8 t -136.05 132.99 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 126.838 2.055 . . . . 0.0 109.589 -176.091 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.75 157.82 27.04 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.832 1.653 . . . . 0.0 113.488 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 15.7 m -165.29 140.73 5.22 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.547 1.539 . . . . 0.0 108.072 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -63.83 122.29 16.08 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.814 0.734 . . . . 0.0 111.479 172.499 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 69' ' ' GLU . . . . . 0.469 ' CD ' ' H ' ' B' ' 72' ' ' GLN . 5.1 pt-20 -71.99 -21.66 61.54 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -178.014 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 116.25 4.67 17.92 Favored Glycine 0 CA--C 1.539 1.589 0 C-N-CA 125.52 1.534 . . . . 0.0 113.834 -168.209 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 71' ' ' ARG . . . . . 0.421 ' H ' ' HG2' ' B' ' 69' ' ' GLU . 29.2 ttm180 -155.5 -53.46 0.09 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.187 1.395 . . . . 0.0 111.493 175.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 72' ' ' GLN . . . . . 0.469 ' H ' ' CD ' ' B' ' 69' ' ' GLU . 9.4 mm-40 -116.37 -125.04 0.28 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.57 1.548 . . . . 0.0 108.181 167.013 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 11.5 p -149.13 137.07 14.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 126.095 1.758 . . . . 0.0 107.182 -167.378 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.2 ptt85 -105.04 170.84 7.64 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.967 1.307 . . . . 0.0 109.034 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.454 ' O ' HD22 ' B' ' 30' ' ' LEU . 45.6 m-85 -129.27 116.14 18.68 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 168.392 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -108.43 169.18 8.81 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.773 1.229 . . . . 0.0 109.579 175.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 tp -59.88 162.07 5.85 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.987 0.915 . . . . 0.0 111.421 169.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -48.96 -54.42 15.62 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.981 0.912 . . . . 0.0 112.603 176.173 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -165.97 165.63 17.91 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.708 1.203 . . . . 0.0 110.945 -169.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 92.2 p -40.26 -37.5 0.65 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.615 2.366 . . . . 0.0 112.582 166.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -52.33 -58.45 6.63 Favored 'General case' 0 C--N 1.341 0.231 0 C-N-CA 125.165 1.386 . . . . 0.0 113.762 173.038 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 13.9 mt -70.36 -32.47 70.17 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.505 1.048 . . . . 0.0 110.011 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.5 -28.33 67.74 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.682 0.793 . . . . 0.0 111.769 -176.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.42 -71.11 0.46 Allowed 'General case' 0 C--O 1.22 -0.461 0 CA-C-O 116.63 -1.652 . . . . 0.0 111.407 168.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.9 -22.91 65.97 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 122.998 2.635 . . . . 0.0 115.253 -170.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.57 -46.55 25.81 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.049 -1.032 . . . . 0.0 110.356 167.532 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.24 -28.83 74.02 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 126.158 1.837 . . . . 0.0 115.304 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.11 -26.9 67.99 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.673 1.989 . . . . 0.0 112.257 168.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 34.7 tp 70.32 100.11 0.06 Allowed 'General case' 0 C--O 1.232 0.172 0 C-N-CA 128.481 2.712 . . . . 0.0 109.281 -172.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 90' ' ' VAL . . . . . 0.54 HG23 HG12 ' B' ' 92' ' ' VAL . 34.0 m -51.5 11.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 C-N-CA 129.431 3.092 . . . . 0.0 118.247 -178.156 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 91' ' ' GLN . . . . . 0.45 ' C ' ' H ' ' B' ' 93' ' ' VAL . 31.0 mm-40 77.84 -18.0 0.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 O-C-N 119.854 -1.779 . . . . 0.0 114.53 159.284 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.54 HG12 HG23 ' B' ' 90' ' ' VAL . 4.5 p -66.42 34.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 127.049 2.14 . . . . 0.0 113.452 168.566 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 93' ' ' VAL . . . . . 0.45 ' H ' ' C ' ' B' ' 91' ' ' GLN . 2.7 t 69.98 1.07 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.028 0 C-N-CA 127.381 2.273 . . . . 0.0 113.367 169.786 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 87.53 99.41 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 130.101 3.36 . . . . 0.0 107.135 -174.086 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.611 0 C-N-CA 124.159 0.984 . . . . 0.0 113.137 -173.765 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 pp . . . . . 0 CA--C 1.535 0.374 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.94 -56.83 9.69 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 169.071 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 -53.76 -36.37 62.29 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.369 1.068 . . . . 0.0 113.647 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.25 -64.92 0.75 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.492 1.517 . . . . 0.0 110.404 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.64 -19.18 76.32 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 118.927 -0.929 . . . . 0.0 113.531 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -65.55 -4.09 5.5 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.63 1.715 . . . . 0.0 113.328 174.547 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.4 -6.73 1.54 Allowed 'General case' 0 CA--C 1.547 0.865 0 CA-C-O 117.116 -1.421 . . . . 0.0 114.3 169.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.88 -31.61 17.25 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 121.394 1.906 . . . . 0.0 110.171 165.682 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.436 ' HB2' ' HA3' ' B' ' 15' ' ' GLY . . . -94.73 76.04 3.69 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.435 1.094 . . . . 0.0 111.913 -177.22 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.519 ' CG ' ' HE ' ' A' ' 23' ' ' ARG . 1.4 t70 -164.27 140.34 5.0 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 126.62 1.968 . . . . 0.0 111.239 -173.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -51.84 -60.59 0.72 Allowed 'Trans proline' 0 C--N 1.353 0.81 1 C-N-CA 125.463 4.109 . . . . 0.0 112.97 -171.087 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.9 m -79.15 -31.36 44.02 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 119.425 -0.321 . . . . 0.0 110.566 -173.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.519 ' HE ' ' CG ' ' A' ' 20' ' ' ASP . 67.1 mtm180 -69.23 -33.56 73.48 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 116.241 -1.838 . . . . 0.0 113.633 -173.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 44.5 t -57.67 -55.21 37.79 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 121.185 1.812 . . . . 0.0 110.29 168.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 44.3 mtt180 -45.2 -45.33 11.63 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.221 1.408 . . . . 0.0 112.998 169.561 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.5 mt -62.4 -58.41 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 CA-C-N 120.181 1.355 . . . . 0.0 111.156 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.13 -44.86 79.57 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.967 0.907 . . . . 0.0 110.883 -175.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.4 p -79.2 -29.39 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 124.496 1.118 . . . . 0.0 112.374 -174.664 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.73 -35.11 30.08 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 122.893 0.477 . . . . 0.0 112.022 175.482 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.506 ' O ' HG13 ' A' ' 34' ' ' VAL . 13.2 tp -67.29 -32.14 72.93 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 116.733 -1.603 . . . . 0.0 112.37 172.648 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -41.67 -45.31 3.39 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.431 1.892 . . . . 0.0 112.579 -178.406 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -99.9 -26.22 14.08 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.524 1.93 . . . . 0.0 112.724 169.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -83.01 -3.7 90.33 Favored Glycine 0 C--N 1.339 0.74 0 CA-C-O 116.591 -2.227 . . . . 0.0 117.101 -168.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.506 HG13 ' O ' ' A' ' 30' ' ' LEU . 16.7 m -29.91 45.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.663 1 C-N-CA 132.087 4.155 . . . . 0.0 120.564 171.445 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 2.4 t -107.78 -51.88 2.84 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 119.369 -2.082 . . . . 0.0 113.203 -175.059 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.3 p90 -158.24 157.78 29.34 Favored Pre-proline 0 N--CA 1.477 0.882 0 N-CA-C 115.347 1.61 . . . . 0.0 115.347 -178.375 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -55.83 128.77 31.67 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.223 1.949 . . . . 0.0 108.214 169.05 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.69 -3.61 68.36 Favored Glycine 0 CA--C 1.531 1.086 0 CA-C-O 116.639 -2.201 . . . . 0.0 115.413 -176.097 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.94 -37.3 63.72 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 121.475 2.638 . . . . 0.0 110.841 170.702 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 20.5 mt -53.14 -28.99 28.71 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 127.144 2.178 . . . . 0.0 112.488 176.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.79 -32.62 70.78 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 118.427 0.558 . . . . 0.0 110.89 -179.155 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.82 -45.62 27.96 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.687 0.795 . . . . 0.0 112.092 174.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 30.3 m170 -58.8 -32.66 69.54 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 175.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 16.0 mt -102.37 -26.86 13.13 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -173.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.41 1.79 66.1 Favored Glycine 0 CA--C 1.533 1.215 0 CA-C-N 119.503 1.047 . . . . 0.0 113.975 -170.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.9 mp -99.52 147.44 25.31 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.104 0.952 . . . . 0.0 109.663 177.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 70.4 p -59.23 151.95 21.87 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.305 1.442 . . . . 0.0 111.184 -169.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.14 -20.34 57.94 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.308 171.337 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.3 m -73.62 -55.29 6.48 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.232 -0.918 . . . . 0.0 110.805 169.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -53.08 -56.45 16.11 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.402 1.081 . . . . 0.0 110.898 178.084 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 69.3 t -65.96 -24.5 34.11 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 O-C-N 120.904 -1.122 . . . . 0.0 112.428 -177.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.7 m -71.05 -36.69 72.42 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 120.54 1.518 . . . . 0.0 113.657 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -52.99 -50.48 64.1 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.675 0.79 . . . . 0.0 110.4 169.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -63.84 -36.06 82.68 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.381 1.073 . . . . 0.0 113.688 178.129 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 21.3 mt -72.51 -31.56 65.44 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 117.841 -1.076 . . . . 0.0 113.533 174.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.89 -46.7 43.08 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.821 1.191 . . . . 0.0 112.876 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 4.0 t -78.9 -35.63 43.28 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-O 121.601 0.715 . . . . 0.0 112.093 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.6 tp -59.61 -38.44 81.29 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.738 1.215 . . . . 0.0 112.332 178.017 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 45.2 mtm105 -77.47 -30.0 52.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.372 1.069 . . . . 0.0 112.467 177.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.33 -40.39 5.76 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 124.59 1.091 . . . . 0.0 114.769 -173.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 69.9 m -71.6 -9.75 58.71 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 124.116 0.966 . . . . 0.0 111.828 171.077 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 91.17 20.76 37.67 Favored Glycine 0 C--N 1.344 0.976 0 C-N-CA 125.472 1.511 . . . . 0.0 115.851 168.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.3 mt -86.6 -23.09 25.87 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.622 1.711 . . . . 0.0 114.799 178.203 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.5 m -127.97 148.49 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 124.728 1.211 . . . . 0.0 111.214 169.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 25.6 t -137.45 148.96 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.383 1.473 . . . . 0.0 109.8 -178.077 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.97 160.88 30.06 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.262 1.425 . . . . 0.0 113.814 173.314 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.2 m -163.24 167.8 21.48 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.392 1.877 . . . . 0.0 108.426 173.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -101.68 121.19 41.58 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 165.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.27 -13.25 59.36 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -178.473 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 133.37 -26.01 3.57 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 125.762 1.648 . . . . 0.0 113.958 173.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 48.5 ttt-85 -132.62 -10.75 3.14 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.395 1.878 . . . . 0.0 112.737 172.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -148.79 160.05 43.57 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.892 2.077 . . . . 0.0 111.304 -177.469 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 23.4 m -82.91 145.0 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 O-C-N 121.44 -0.787 . . . . 0.0 109.757 168.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.1 ptt180 -131.2 165.62 22.93 Favored 'General case' 0 CA--C 1.518 -0.275 0 C-N-CA 124.769 1.228 . . . . 0.0 110.408 -172.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -107.65 148.64 29.1 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 163.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.436 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -147.67 156.97 43.32 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 123.397 0.679 . . . . 0.0 110.146 174.567 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tp -53.96 144.79 18.06 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 123.542 0.526 . . . . 0.0 110.172 170.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.97 -20.12 64.17 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 116.083 1.883 . . . . 0.0 116.083 -170.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -168.97 164.03 11.47 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.711 1.604 . . . . 0.0 112.367 173.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 50.7 m -51.49 -30.14 18.99 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.845 2.058 . . . . 0.0 112.574 168.587 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -52.82 -58.24 7.57 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 126.643 1.977 . . . . 0.0 112.334 171.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 19.1 mt -64.21 -44.19 92.7 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 177.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -56.94 -34.3 67.87 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 125.068 1.347 . . . . 0.0 111.444 -175.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.1 ttm-85 -74.22 -57.7 3.78 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 116.685 -1.626 . . . . 0.0 112.092 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.26 -22.91 64.73 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 122.103 2.229 . . . . 0.0 113.33 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 54.5 tp -71.64 -45.52 61.81 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.425 1.89 . . . . 0.0 110.69 168.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.53 -36.24 12.52 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 126.147 1.832 . . . . 0.0 115.088 -171.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -77.91 -5.51 51.32 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.34 1.456 . . . . 0.0 112.777 176.201 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 25.9 tp 60.79 89.46 0.07 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.657 2.383 . . . . 0.0 113.484 168.303 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.3 m -41.37 150.42 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 125.194 1.398 . . . . 0.0 112.4 176.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -72.0 2.9 4.94 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 -159.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.7 p -66.45 35.39 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 126.289 1.836 . . . . 0.0 114.221 174.593 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 61.08 20.01 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 126.396 1.879 . . . . 0.0 113.544 169.493 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 tt 94.93 106.96 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 129.337 3.055 . . . . 0.0 106.513 -167.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.79 89.5 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.97 0.908 . . . . 0.0 111.667 170.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.0 t -63.43 135.57 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 125.201 1.4 . . . . 0.0 110.266 171.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -62.57 6.26 0.1 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 127.547 2.339 . . . . 0.0 115.065 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.6 138.09 58.09 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 122.307 1.051 . . . . 0.0 110.612 176.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -92.92 153.6 18.69 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 113.438 -1.71 . . . . 0.0 107.595 164.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -161.16 136.17 5.55 Favored Pre-proline 0 N--CA 1.447 -0.575 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 174.127 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -60.59 165.34 11.64 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 121.331 1.354 . . . . 0.0 109.886 169.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 46.3 t . . . . . 0 CA--C 1.555 1.143 0 CA-C-O 122.647 1.213 . . . . 0.0 110.189 170.699 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 pp . . . . . 0 N--CA 1.468 0.466 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.93 -55.27 27.4 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.95 0.9 . . . . 0.0 109.982 169.034 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 24.5 ttm180 -60.07 -40.13 88.44 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 177.053 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -53.54 -59.27 4.81 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.451 1.1 . . . . 0.0 110.416 176.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 15' ' ' GLY . . . . . 0.436 ' HA3' ' HB2' ' A' ' 19' ' ' ALA . . . -73.26 -21.1 79.99 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-O 118.739 -1.034 . . . . 0.0 113.689 -177.3 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.83 -18.11 53.73 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 126.465 1.906 . . . . 0.0 114.179 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -123.83 -7.58 7.87 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 177.411 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 3.1 mt -87.56 -37.08 17.17 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 119.429 1.013 . . . . 0.0 110.911 167.113 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.6 77.45 5.67 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.647 1.179 . . . . 0.0 111.676 -177.756 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -163.78 139.16 4.97 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 125.219 1.408 . . . . 0.0 111.598 -171.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -51.46 -50.26 14.5 Favored 'Trans proline' 0 C--N 1.353 0.8 1 C-N-CA 125.677 4.251 . . . . 0.0 114.117 -172.787 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 45.7 m -91.83 -32.96 15.14 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 119.394 -0.336 . . . . 0.0 110.52 -172.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 74.1 mtm180 -68.74 -34.21 75.22 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 116.571 -1.68 . . . . 0.0 112.691 -177.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 45.9 t -55.13 -55.51 30.32 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 120.755 1.616 . . . . 0.0 110.637 168.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -48.07 -52.27 20.96 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.126 1.37 . . . . 0.0 112.47 172.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.5 mt -51.12 -58.83 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 CA-C-N 119.424 1.011 . . . . 0.0 111.234 174.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 93.4 mt -63.37 -41.84 98.82 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.222 1.009 . . . . 0.0 111.176 -169.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.7 p -75.98 -26.72 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.226 0.611 . . . . 0.0 112.399 178.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.61 -39.09 67.56 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 118.793 -0.622 . . . . 0.0 111.039 169.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.494 ' O ' HG13 ' B' ' 34' ' ' VAL . 2.1 tp -65.32 -26.62 68.13 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 -176.336 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 7.8 mt -45.95 -26.51 0.72 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 125.959 1.704 . . . . 0.0 112.205 168.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -113.64 -31.65 6.42 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 127.658 2.383 . . . . 0.0 111.522 167.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -82.51 15.57 29.26 Favored Glycine 0 C--N 1.335 0.477 0 C-N-CA 129.775 3.559 . . . . 0.0 115.204 -166.049 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 34' ' ' VAL . . . . . 0.494 HG13 ' O ' ' B' ' 30' ' ' LEU . 26.1 m -60.15 28.75 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.038 0 C-N-CA 126.111 1.765 . . . . 0.0 115.565 167.063 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.6 -73.11 0.46 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.434 1.494 . . . . 0.0 111.528 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -159.07 157.35 27.86 Favored Pre-proline 0 N--CA 1.474 0.726 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -169.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -57.29 121.27 9.76 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.628 2.218 . . . . 0.0 109.046 173.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.91 -5.66 83.2 Favored Glycine 0 CA--C 1.531 1.071 0 CA-C-O 117.572 -1.682 . . . . 0.0 115.024 -175.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 39' ' ' GLN . . . . . 0.536 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -57.67 -35.11 70.13 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 120.942 2.371 . . . . 0.0 111.402 172.114 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 23.0 mt -56.96 -25.33 57.69 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 125.216 1.406 . . . . 0.0 111.928 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.85 -32.75 73.12 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 121.883 -0.51 . . . . 0.0 111.461 -174.305 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.11 -49.12 18.26 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.486 0.714 . . . . 0.0 111.543 172.145 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 43' ' ' HIS . . . . . 0.536 ' CD2' HE22 ' B' ' 39' ' ' GLN . 2.8 m-70 -56.18 -32.92 64.78 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.217 1.191 . . . . 0.0 114.217 178.187 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 14.1 mt -104.02 -23.87 13.28 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.624 1.17 . . . . 0.0 113.118 -173.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.18 -6.67 49.24 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.533 1.063 . . . . 0.0 114.1 -171.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 10.6 mp -93.19 156.39 16.87 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.44 1.096 . . . . 0.0 109.539 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 71.2 p -71.91 154.7 41.05 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 122.448 1.118 . . . . 0.0 111.745 -170.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 -56.68 -25.34 53.68 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.099 169.179 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 15.3 m -71.82 -58.28 3.6 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.657 1.183 . . . . 0.0 110.633 169.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -53.27 -58.12 8.17 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.831 1.252 . . . . 0.0 111.676 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 88.7 t -63.33 -22.09 29.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 121.363 -0.836 . . . . 0.0 111.575 -175.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 50.1 m -68.69 -36.32 78.33 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 119.87 1.213 . . . . 0.0 113.93 178.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -56.72 -47.14 80.63 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.98 0.809 . . . . 0.0 111.61 169.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -63.69 -32.24 73.66 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.092 0.957 . . . . 0.0 112.621 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 43.4 mt -75.87 -32.92 59.93 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.084 1.354 . . . . 0.0 113.628 172.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 19.4 m -54.61 -39.02 67.47 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 120.292 1.405 . . . . 0.0 113.323 177.369 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 42.1 t -69.18 -47.86 63.76 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.524 1.056 . . . . 0.0 112.132 171.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.3 tp -58.25 -37.82 75.67 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.359 1.464 . . . . 0.0 112.0 -171.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 34.3 mtm105 -83.12 -7.03 59.69 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.842 1.657 . . . . 0.0 113.774 178.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -106.6 -37.95 2.32 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 125.558 1.551 . . . . 0.0 114.414 177.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 22.5 m -73.75 -13.54 60.97 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 124.928 1.291 . . . . 0.0 112.288 172.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.33 20.14 42.89 Favored Glycine 0 C--N 1.341 0.837 0 CA-C-O 118.355 -1.247 . . . . 0.0 114.572 172.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.05 -24.09 30.6 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 119.626 1.713 . . . . 0.0 113.825 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 3.5 m -127.72 147.28 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 124.336 1.054 . . . . 0.0 113.003 171.244 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 24.2 t -130.0 143.05 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.373 1.869 . . . . 0.0 110.808 -176.104 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.02 152.34 27.98 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.787 1.635 . . . . 0.0 112.936 174.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.9 m -161.02 172.26 17.2 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.393 1.477 . . . . 0.0 109.075 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -100.99 126.05 47.63 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 165.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.34 -14.38 59.02 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 177.189 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 136.12 -26.77 3.08 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 126.201 1.858 . . . . 0.0 114.0 175.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 51.5 ttt-85 -136.42 -6.9 1.99 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.809 2.044 . . . . 0.0 112.977 174.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -150.36 160.23 43.88 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.17 2.188 . . . . 0.0 110.749 -178.344 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 33.6 m -82.4 148.02 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 O-C-N 121.509 -0.745 . . . . 0.0 110.565 169.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 3.0 ptt180 -132.52 167.99 19.02 Favored 'General case' 0 C--O 1.231 0.116 0 C-N-CA 125.43 1.492 . . . . 0.0 110.745 -171.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -112.16 160.58 17.44 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 164.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -160.28 150.61 18.37 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 120.742 -1.224 . . . . 0.0 111.257 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -49.94 129.65 20.71 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 169.018 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.23 0.41 2.8 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 -168.563 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -179.61 161.74 1.05 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 128.123 2.569 . . . . 0.0 110.644 169.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 43.4 m -48.35 -29.99 4.49 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.573 1.549 . . . . 0.0 111.797 168.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -49.08 -53.78 18.96 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 126.226 1.811 . . . . 0.0 113.526 171.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 13.3 mt -79.45 -41.41 27.62 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.919 -0.562 . . . . 0.0 109.818 -175.776 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.9 -36.11 59.03 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.033 0.533 . . . . 0.0 111.952 170.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 34.5 ttm-85 -75.93 -61.04 2.06 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-O 116.719 -1.61 . . . . 0.0 112.836 174.663 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.04 -20.74 66.28 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 122.5 2.409 . . . . 0.0 113.384 -176.161 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.15 -53.54 8.14 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.672 -0.643 . . . . 0.0 109.28 166.657 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.98 -28.36 70.65 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.374 1.464 . . . . 0.0 115.574 -171.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -78.38 -6.76 56.12 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.681 1.24 . . . . 0.0 112.051 169.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 30.6 tp 60.67 86.36 0.1 Allowed 'General case' 0 C--N 1.345 0.394 0 C-N-CA 127.623 2.369 . . . . 0.0 113.565 167.088 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.2 m -43.36 147.59 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 CA-C-O 122.667 1.222 . . . . 0.0 112.986 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 91' ' ' GLN . . . . . 0.481 ' C ' ' H ' ' B' ' 93' ' ' VAL . 20.1 mm-40 -68.54 6.62 0.78 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 117.021 2.23 . . . . 0.0 117.021 -163.054 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 6.1 p -66.28 32.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 126.476 1.911 . . . . 0.0 113.243 169.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 93' ' ' VAL . . . . . 0.481 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.4 OUTLIER 63.16 11.63 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 128.6 2.76 . . . . 0.0 114.359 171.499 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.6 tt 102.05 107.62 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 130.519 3.528 . . . . 0.0 105.35 -167.055 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.573 0 C-N-CA 124.617 1.167 . . . . 0.0 111.812 174.465 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.557 HD23 ' H ' ' A' ' 12' ' ' ALA . 1.1 pt? . . . . . 0 N--CA 1.475 0.797 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.557 ' H ' HD23 ' A' ' 11' ' ' LEU . . . -67.25 -18.72 65.34 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.661 1.584 . . . . 0.0 113.468 177.821 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.473 HH11 ' HG2' ' A' ' 13' ' ' ARG . 0.2 OUTLIER -86.11 -42.81 13.58 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.052 0.842 . . . . 0.0 109.421 167.738 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.55 -46.41 82.94 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.623 1.569 . . . . 0.0 112.25 -171.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.96 -18.39 68.7 Favored Glycine 0 CA--C 1.535 1.333 0 O-C-N 121.182 -0.949 . . . . 0.0 113.073 172.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 81.6 mtp180 -99.16 29.84 3.72 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 127.546 2.339 . . . . 0.0 111.314 170.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.93 -35.47 0.57 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.463 1.905 . . . . 0.0 111.898 169.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mt -95.78 -39.38 9.88 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 178.083 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -96.26 54.35 1.41 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.656 1.116 . . . . 0.0 109.54 170.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -132.42 138.28 31.82 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 126.933 2.093 . . . . 0.0 108.202 -168.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -52.61 -98.35 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.809 1 C-N-CA 126.66 4.907 . . . . 0.0 115.789 -164.629 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.95 -27.82 63.76 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 125.571 1.548 . . . . 0.0 111.799 175.751 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.39 -36.04 63.5 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -174.169 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 14.1 t -65.85 -38.0 87.7 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.519 -1.363 . . . . 0.0 109.921 167.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -57.52 -38.55 74.84 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.056 0.942 . . . . 0.0 112.964 169.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.9 mm -62.11 -49.52 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 O-C-N 120.717 -1.24 . . . . 0.0 110.997 170.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.4 mt -58.61 -48.46 80.9 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.246 0.475 . . . . 0.0 112.157 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.2 p -68.51 -20.39 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 118.986 0.812 . . . . 0.0 112.782 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.51 -16.84 60.24 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.351 1.061 . . . . 0.0 113.069 171.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.432 HD23 ' CG1' ' A' ' 64' ' ' VAL . 0.0 OUTLIER -93.39 -13.55 27.91 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 170.977 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.92 -20.92 64.3 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.211 163.448 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -116.99 -60.39 1.85 Allowed 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 127.456 2.302 . . . . 0.0 115.205 -177.136 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.37 -83.05 0.43 Allowed Glycine 0 C--N 1.343 0.948 0 C-N-CA 124.989 1.281 . . . . 0.0 114.313 -165.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.8 m 49.58 30.96 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 125.288 1.435 . . . . 0.0 113.768 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.6 m -77.81 -66.52 0.83 Allowed 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 178.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -140.88 156.63 68.57 Favored Pre-proline 0 C--O 1.238 0.465 0 CA-C-O 118.665 -0.683 . . . . 0.0 112.124 -169.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -59.13 115.37 2.52 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 122.509 2.139 . . . . 0.0 109.128 169.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 95.93 -0.88 62.84 Favored Glycine 0 CA--C 1.531 1.084 0 CA-C-O 117.552 -1.693 . . . . 0.0 115.93 -178.339 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.23 -30.47 71.53 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.949 2.374 . . . . 0.0 112.317 172.139 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.74 HD12 ' H ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -56.5 -22.65 34.11 Favored 'General case' 0 C--O 1.222 -0.346 0 C-N-CA 124.431 1.093 . . . . 0.0 111.61 177.833 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.25 -36.99 79.03 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.482 0.713 . . . . 0.0 112.322 176.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.45 -38.06 74.43 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.372 0.533 . . . . 0.0 111.436 175.437 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -64.57 -38.12 89.92 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 175.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 32.9 mt -99.69 -14.67 18.82 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -172.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 64.8 25.36 70.49 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-O 118.717 -1.046 . . . . 0.0 112.281 -169.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 67.4 mt -126.95 134.53 50.38 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.266 1.027 . . . . 0.0 112.223 -176.212 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.3 p -50.18 156.81 0.75 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.101 1.36 . . . . 0.0 114.311 -168.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.6 ttm180 -53.24 -26.16 16.96 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.07 -1.423 . . . . 0.0 112.049 169.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.6 m -80.04 -47.23 15.2 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.063 -1.023 . . . . 0.0 111.778 175.108 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -60.07 -52.61 64.62 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.481 1.112 . . . . 0.0 110.266 176.012 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.4 t -58.84 -38.92 75.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 121.018 -1.051 . . . . 0.0 111.955 176.029 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 74.9 m -64.69 -39.72 94.15 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.916 1.234 . . . . 0.0 113.31 174.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -56.51 -52.55 64.32 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.676 0.79 . . . . 0.0 110.771 174.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 20.0 m80 -61.22 -39.77 91.53 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 48.7 mt -68.09 -25.85 65.53 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.171 -0.919 . . . . 0.0 112.968 175.113 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.4 t -59.42 -56.82 17.23 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 120.705 1.593 . . . . 0.0 113.637 -168.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 30.8 t -67.95 -28.78 67.76 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 122.209 -0.307 . . . . 0.0 111.764 172.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.4 tp -60.78 -35.42 76.4 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.915 0.886 . . . . 0.0 111.647 177.176 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 87.0 mtm-85 -74.83 -28.98 60.91 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.188 0.995 . . . . 0.0 112.026 172.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.39 -50.31 6.76 Favored Glycine 0 N--CA 1.472 1.072 0 CA-C-N 119.357 0.981 . . . . 0.0 113.129 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 18.2 m -67.53 -2.01 5.89 Favored 'General case' 0 CA--C 1.562 1.423 0 C-N-CA 126.826 2.05 . . . . 0.0 111.444 168.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.32 -0.62 16.23 Favored Glycine 0 C--N 1.343 0.959 0 C-N-CA 126.884 2.183 . . . . 0.0 115.191 173.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 77.5 mt -53.27 -25.67 15.39 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.13 1.772 . . . . 0.0 112.667 179.33 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.432 ' CG1' HD23 ' A' ' 30' ' ' LEU . 3.3 m -123.91 153.31 29.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 126.718 2.007 . . . . 0.0 109.641 164.045 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -142.32 155.28 18.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 C-N-CA 126.77 2.028 . . . . 0.0 109.891 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.6 151.93 28.8 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 122.706 1.241 . . . . 0.0 111.009 171.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.624 HG22 ' H ' ' A' ' 68' ' ' TYR . 8.0 m -158.11 -170.85 3.28 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 127.008 2.123 . . . . 0.0 105.959 173.617 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.624 ' H ' HG22 ' A' ' 67' ' ' THR . 47.6 m-85 -120.91 157.99 28.66 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 119.773 1.17 . . . . 0.0 113.418 174.699 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -110.49 -151.45 0.48 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 126.641 1.976 . . . . 0.0 109.414 167.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.48 -12.49 56.22 Favored Glycine 0 CA--C 1.539 1.562 0 O-C-N 120.027 -1.671 . . . . 0.0 116.332 -172.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -164.54 -28.71 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.644 1.577 . . . . 0.0 113.307 173.513 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -99.48 170.64 8.47 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.801 1.64 . . . . 0.0 110.405 -177.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 26.0 m -80.81 160.87 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 O-C-N 121.92 -0.488 . . . . 0.0 111.54 168.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -126.61 171.78 10.83 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.394 1.877 . . . . 0.0 110.455 175.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -123.87 121.96 36.72 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.214 1.406 . . . . 0.0 107.963 167.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.13 167.53 17.44 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.866 1.266 . . . . 0.0 111.552 177.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 69.7 mt -60.61 156.7 15.98 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.573 0.749 . . . . 0.0 111.765 172.132 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.22 -51.36 68.35 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 125.948 1.699 . . . . 0.0 113.846 179.288 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -164.27 173.55 12.18 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 123.683 1.706 . . . . 0.0 114.258 -167.121 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 43.2 t -47.18 -42.42 19.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 113.168 -1.833 . . . . 0.0 113.308 170.092 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 55.9 m-70 -63.97 -42.47 97.25 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 116.938 -1.506 . . . . 0.0 113.478 -178.542 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 10.2 mt -71.9 -45.14 62.3 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 121.188 1.813 . . . . 0.0 109.846 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.99 -35.65 59.44 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.814 0.846 . . . . 0.0 111.782 175.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.401 ' HE ' ' CD ' ' A' ' 88' ' ' GLU . 0.4 OUTLIER -70.86 -67.27 0.52 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 128.398 2.679 . . . . 0.0 112.661 175.532 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.74 -30.25 70.43 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -173.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.04 -39.57 60.92 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.723 -0.611 . . . . 0.0 109.642 169.394 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -57.61 -45.06 93.64 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 125.897 1.713 . . . . 0.0 114.347 -178.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.401 ' CD ' ' HE ' ' A' ' 84' ' ' ARG . 2.0 pt-20 -87.84 3.76 47.09 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 174.259 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 39.0 tp 73.5 143.2 0.07 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 129.3 3.04 . . . . 0.0 111.64 177.251 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 31.2 m -38.25 -20.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 128.992 2.917 . . . . 0.0 116.367 176.019 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 86.82 -35.83 0.03 OUTLIER 'General case' 0 C--O 1.218 -0.594 0 C-N-CA 126.232 1.813 . . . . 0.0 108.963 161.118 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.521 HG21 ' CD2' ' B' ' 14' ' ' LEU . 8.7 p -62.62 36.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 128.915 2.886 . . . . 0.0 114.677 168.105 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.5 t 79.07 -25.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 128.7 2.8 . . . . 0.0 113.027 170.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 tt 110.59 99.05 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.636 1 C-N-CA 132.57 4.348 . . . . 0.0 104.582 -169.028 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.99 133.84 56.48 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 119.309 -0.377 . . . . 0.0 110.968 -178.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.1 t -74.76 137.14 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -166.285 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -60.68 -23.04 64.53 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.26 1.424 . . . . 0.0 114.72 173.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 59.0 p -64.82 117.08 7.01 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.382 1.073 . . . . 0.0 109.098 176.471 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -69.46 12.77 0.16 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.083 2.153 . . . . 0.0 114.447 -175.254 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 -74.16 159.29 84.21 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 125.674 1.59 . . . . 0.0 113.424 -167.371 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.85 135.92 43.23 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.376 2.718 . . . . 0.0 110.965 169.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 20.5 p . . . . . 0 CA--C 1.544 0.74 0 C-N-CA 123.833 0.853 . . . . 0.0 110.816 168.424 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.551 HD23 ' H ' ' B' ' 12' ' ' ALA . 1.2 pt? . . . . . 0 N--CA 1.468 0.468 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.551 ' H ' HD23 ' B' ' 11' ' ' LEU . . . -63.29 -21.9 66.54 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.541 1.536 . . . . 0.0 114.202 176.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 13' ' ' ARG . . . . . 0.534 HH11 ' HG2' ' B' ' 13' ' ' ARG . 1.3 mmt-85 -84.03 -41.11 17.58 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 119.607 1.094 . . . . 0.0 111.723 170.898 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.521 ' CD2' HG21 ' A' ' 92' ' ' VAL . 3.1 tm? -57.98 -52.73 64.31 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.709 1.604 . . . . 0.0 111.114 177.532 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.39 -22.48 69.45 Favored Glycine 0 CA--C 1.533 1.177 0 O-C-N 121.884 -0.51 . . . . 0.0 112.715 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 72.3 mtp180 -87.47 14.05 8.89 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 126.212 1.805 . . . . 0.0 112.508 173.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -125.19 -37.58 2.39 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.845 1.258 . . . . 0.0 112.354 168.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 24.5 mt -88.88 -25.75 21.97 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.541 -1.218 . . . . 0.0 113.078 178.057 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -115.9 55.16 0.8 Allowed 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 120.977 1.717 . . . . 0.0 110.705 168.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -133.43 143.9 49.99 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 127.587 2.355 . . . . 0.0 106.678 -174.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -57.54 -98.98 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.945 1 C-N-CA 125.698 4.266 . . . . 0.0 115.7 -163.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 1.3 p -53.08 -32.92 49.69 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.515 1.926 . . . . 0.0 112.42 172.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.84 -43.85 62.12 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.687 0.795 . . . . 0.0 112.906 -170.42 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 46.8 t -63.38 -39.26 94.04 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.193 0.906 . . . . 0.0 109.455 168.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -55.92 -33.24 64.5 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 120.582 -1.324 . . . . 0.0 113.973 171.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 26' ' ' ILE . . . . . 0.411 HG23 HD13 ' B' ' 40' ' ' LEU . 1.6 mm -62.06 -48.76 86.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 CA-C-N 120.23 1.377 . . . . 0.0 110.061 169.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 89.6 mt -58.56 -45.01 89.86 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.957 0.799 . . . . 0.0 112.066 176.222 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 28' ' ' VAL . . . . . 0.678 HG22 HD21 ' B' ' 86' ' ' LEU . 51.8 t -61.38 -47.25 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 126.424 1.889 . . . . 0.0 110.847 179.111 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.52 -36.21 63.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.89 0.876 . . . . 0.0 112.298 -177.437 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 16.6 tp -66.17 -35.35 80.24 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 117.486 -1.245 . . . . 0.0 112.103 -178.023 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -37.14 -45.71 0.64 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 129.492 3.117 . . . . 0.0 113.91 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -105.34 -16.96 14.6 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.065 1.746 . . . . 0.0 113.165 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.28 -71.42 1.23 Allowed Glycine 0 C--N 1.341 0.85 0 C-N-CA 124.658 1.123 . . . . 0.0 112.329 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 34' ' ' VAL . . . . . 0.454 HG12 ' HA ' ' B' ' 76' ' ' ALA . 34.6 m 33.45 36.43 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 -170.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.93 -76.27 0.3 Allowed 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.357 -0.84 . . . . 0.0 111.553 -177.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -145.74 158.15 50.11 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-O 118.648 -0.692 . . . . 0.0 112.82 -168.175 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -58.62 123.14 12.91 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.919 2.413 . . . . 0.0 110.162 172.475 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 88.19 -3.83 85.52 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 117.575 -1.68 . . . . 0.0 115.449 -174.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -32.82 71.08 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 120.493 2.146 . . . . 0.0 111.87 174.091 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.411 HD13 HG23 ' B' ' 26' ' ' ILE . 2.1 mt -59.52 -15.74 20.05 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 123.716 0.806 . . . . 0.0 112.246 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.9 -41.76 87.98 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.57 0.623 . . . . 0.0 111.159 175.097 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -75.57 -30.35 59.63 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.512 0.725 . . . . 0.0 112.418 176.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -69.01 -33.97 74.5 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 171.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 23.9 mt -106.59 -14.57 15.01 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -170.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.33 16.95 69.85 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-N 119.136 0.88 . . . . 0.0 113.008 -169.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 36.7 mt -117.65 139.63 50.74 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 118.506 1.153 . . . . 0.0 111.6 -175.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.2 p -59.67 161.68 5.92 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.388 0.675 . . . . 0.0 111.933 -172.128 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 20.7 ttm180 -58.61 -29.08 66.2 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 122.056 -0.403 . . . . 0.0 111.938 175.251 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 20.3 m -69.81 -46.07 66.5 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.386 0.994 . . . . 0.0 111.622 175.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -61.94 -55.19 32.02 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 122.821 0.449 . . . . 0.0 110.128 173.064 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.8 t -56.26 -40.73 67.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 121.002 -1.061 . . . . 0.0 112.976 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 49.7 m -66.17 -37.93 86.83 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.663 1.12 . . . . 0.0 112.865 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -55.54 -49.97 71.25 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.93 0.786 . . . . 0.0 110.89 172.193 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 20.6 m80 -64.17 -37.44 87.45 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 26.1 mt -73.27 -27.33 61.5 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 117.599 -1.191 . . . . 0.0 113.441 175.382 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.1 t -50.65 -63.71 1.04 Allowed 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.293 0.951 . . . . 0.0 112.608 -169.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.7 t -66.76 -33.79 76.41 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.541 0.736 . . . . 0.0 111.66 174.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 3.6 tp -53.34 -33.92 55.46 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.29 1.036 . . . . 0.0 112.47 178.35 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 79.9 mtm-85 -83.16 -21.54 33.51 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 173.278 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -80.73 -47.43 6.71 Favored Glycine 0 N--CA 1.475 1.273 0 CA-C-N 120.228 1.376 . . . . 0.0 111.825 176.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 3.3 m -62.93 -11.29 17.6 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.961 2.104 . . . . 0.0 112.388 168.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 59.65 28.09 64.83 Favored Glycine 0 C--N 1.345 1.083 0 C-N-CA 125.818 1.675 . . . . 0.0 113.477 -178.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 93.0 mt -73.15 -24.73 60.62 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 117.918 0.859 . . . . 0.0 111.167 168.057 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 4.5 m -130.28 159.68 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 C-N-CA 126.108 1.763 . . . . 0.0 110.284 168.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -145.5 155.44 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 126.016 1.726 . . . . 0.0 110.266 -172.544 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.28 150.77 24.55 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.073 1.349 . . . . 0.0 111.53 172.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 10.6 m -158.99 168.83 25.74 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 176.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -102.67 142.62 33.51 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.349 0.977 . . . . 0.0 111.197 168.243 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.261 1.6 pp20? -99.52 -155.74 0.52 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.35 1.06 . . . . 0.0 109.435 166.684 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -67.09 -14.95 64.49 Favored Glycine 0 CA--C 1.535 1.341 0 O-C-N 120.176 -1.577 . . . . 0.0 115.46 -171.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -159.19 -20.85 0.07 Allowed 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.95 1.375 . . . . 0.0 114.433 174.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -111.93 162.36 15.41 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.975 2.11 . . . . 0.0 110.994 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 17.6 m -82.1 152.4 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 O-C-N 121.468 -0.77 . . . . 0.0 109.377 167.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -129.15 168.67 15.8 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 122.594 1.188 . . . . 0.0 109.643 -178.014 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -113.16 148.2 35.86 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 164.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 76' ' ' ALA . . . . . 0.454 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -149.55 157.8 43.6 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.307 1.043 . . . . 0.0 110.285 176.099 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -53.14 151.83 4.73 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.988 0.915 . . . . 0.0 110.651 168.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -49.66 -52.35 31.47 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.535 1.134 . . . . 0.0 113.775 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.35 179.81 3.76 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 122.818 1.294 . . . . 0.0 113.896 -167.115 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 24.5 t -49.3 -43.96 43.76 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.054 -1.43 . . . . 0.0 113.25 170.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -62.06 -48.42 80.31 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 117.664 -1.16 . . . . 0.0 112.926 -178.525 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 15.8 mt -68.72 -38.89 80.54 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 120.615 1.552 . . . . 0.0 109.954 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.35 -32.24 73.61 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.535 0.607 . . . . 0.0 110.994 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -69.56 -70.13 0.3 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 128.462 2.705 . . . . 0.0 110.936 171.312 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.72 -33.44 61.08 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 120.803 1.638 . . . . 0.0 114.555 -178.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.678 HD21 HG22 ' B' ' 28' ' ' VAL . 1.4 tt -77.65 -39.93 43.41 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 121.322 -0.861 . . . . 0.0 111.123 173.077 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.12 -46.77 90.23 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.634 1.588 . . . . 0.0 114.41 -173.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 12.8 pm0 -84.08 -0.49 52.05 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 119.255 1.528 . . . . 0.0 113.499 168.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 33.8 tp 72.85 135.35 0.05 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 129.563 3.145 . . . . 0.0 111.504 177.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 97.5 t -62.79 8.62 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 129.225 3.01 . . . . 0.0 113.716 -176.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 93.4 -35.85 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.611 -1.306 . . . . 0.0 110.82 129.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 7.7 p -56.48 35.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.043 1 C-N-CA 132.628 4.371 . . . . 0.0 115.626 171.625 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER 67.15 6.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.876 0 C-N-CA 126.698 1.999 . . . . 0.0 112.836 176.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 tt 78.54 105.4 0.07 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.762 2.425 . . . . 0.0 107.631 -168.014 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.007 0 O-C-N 121.563 -0.711 . . . . 0.0 110.336 174.779 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.9 mt . . . . . 0 N--CA 1.472 0.65 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.45 -41.62 98.63 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -177.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -53.91 -51.05 64.98 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.668 1.187 . . . . 0.0 110.633 172.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.73 -47.18 73.11 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.759 1.223 . . . . 0.0 113.001 -178.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.61 -40.95 94.23 Favored Glycine 0 N--CA 1.473 1.133 0 CA-C-N 120.301 1.41 . . . . 0.0 111.303 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -40.4 92.18 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.15 1.38 . . . . 0.0 110.763 172.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.6 -3.18 4.21 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.725 1.379 . . . . 0.0 114.725 175.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.9 mp -115.29 -35.63 4.59 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.836 1.254 . . . . 0.0 111.836 166.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.91 98.93 11.89 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 128.113 2.565 . . . . 0.0 111.929 -176.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.66 172.13 5.99 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 127.421 2.288 . . . . 0.0 108.971 -169.262 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -74.27 -119.71 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 124.927 3.751 . . . . 0.0 110.482 172.521 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 68.4 m -50.15 -28.96 8.19 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.732 2.013 . . . . 0.0 113.227 176.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.94 -24.93 64.33 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 120.093 1.315 . . . . 0.0 113.479 174.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 30.0 t -74.23 -45.0 50.87 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.185 -0.947 . . . . 0.0 109.251 166.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.44 -44.75 76.61 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.498 -0.751 . . . . 0.0 112.726 173.318 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.2 mm -50.06 -51.24 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 119.984 1.265 . . . . 0.0 110.714 169.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 25.5 mt -59.67 -45.34 92.36 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 117.249 -1.358 . . . . 0.0 112.87 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.5 m -66.55 -28.05 42.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 CA-C-N 121.267 1.849 . . . . 0.0 111.862 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.23 -20.0 45.62 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.057 1.343 . . . . 0.0 112.932 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 77.2 mt -63.02 -49.45 74.6 Favored 'General case' 0 N--CA 1.469 0.489 0 O-C-N 121.075 -1.015 . . . . 0.0 111.017 170.245 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -46.41 -53.48 10.97 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 129.304 3.042 . . . . 0.0 112.56 -169.476 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -105.72 22.79 14.95 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 127.444 2.298 . . . . 0.0 111.272 177.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.68 -84.7 0.96 Allowed Glycine 0 C--N 1.34 0.758 0 C-N-CA 126.456 1.979 . . . . 0.0 112.633 -178.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.474 HG12 ' HA ' ' A' ' 76' ' ' ALA . 23.7 m 30.71 39.2 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 127.245 2.218 . . . . 0.0 116.557 -171.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 34.6 m -89.52 -76.72 0.41 Allowed 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.236 -0.915 . . . . 0.0 112.718 -177.377 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -137.51 164.24 42.94 Favored Pre-proline 0 CA--C 1.546 0.813 0 CA-C-O 118.454 -0.784 . . . . 0.0 111.515 -174.28 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -66.3 -20.23 55.54 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.583 2.188 . . . . 0.0 114.379 -167.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.55 8.24 43.57 Favored Glycine 0 CA--C 1.535 1.302 0 CA-C-O 118.388 -1.229 . . . . 0.0 115.028 171.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -28.97 67.25 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 120.189 1.995 . . . . 0.0 113.899 -170.317 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.74 -18.38 59.52 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.359 0.664 . . . . 0.0 111.723 -177.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.52 -32.96 71.96 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.133 0.973 . . . . 0.0 112.249 174.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.5 -41.49 46.8 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.209 0.604 . . . . 0.0 111.478 176.705 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -63.63 -40.13 96.1 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 175.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 28.6 mt -92.62 -22.83 19.25 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -174.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.81 8.72 82.54 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 123.961 0.791 . . . . 0.0 112.644 -169.159 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 86.3 mt -103.73 152.01 22.34 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.305 1.442 . . . . 0.0 110.919 -171.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.5 p -63.94 154.53 33.66 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.543 0.737 . . . . 0.0 111.442 -171.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -56.88 -31.36 64.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 176.099 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.9 m -69.42 -49.69 52.8 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 123.883 0.873 . . . . 0.0 111.473 172.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -63.32 -37.11 86.0 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 119.133 0.879 . . . . 0.0 113.099 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.3 t -63.64 -50.78 76.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 C-N-CA 123.907 0.883 . . . . 0.0 111.381 169.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.3 m -63.48 -35.65 81.14 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 119.225 0.921 . . . . 0.0 113.212 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 43.8 m-20 -49.21 -37.15 21.93 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 125.726 1.611 . . . . 0.0 111.998 170.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 53.1 m-70 -100.58 2.99 42.32 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 115.505 1.668 . . . . 0.0 115.505 176.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 87.4 mt -92.07 -31.65 15.46 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.807 1.185 . . . . 0.0 111.754 165.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.8 t -45.98 -59.27 2.94 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -170.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 10.6 t -76.45 -21.08 56.37 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.6 tp -61.18 -36.36 79.65 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.613 1.165 . . . . 0.0 110.931 177.114 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 55.6 mtm180 -79.94 -20.29 46.0 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.147 1.379 . . . . 0.0 112.41 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.8 -41.39 4.7 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.984 1.278 . . . . 0.0 114.227 -177.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 58.5 m -74.8 -3.48 31.99 Favored 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 124.615 1.166 . . . . 0.0 112.305 170.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 92.04 -4.03 77.6 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 126.008 1.766 . . . . 0.0 116.312 169.065 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 78.4 mt -64.25 -28.99 70.11 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 120.582 2.191 . . . . 0.0 114.77 -173.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -122.12 132.45 70.97 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.406 0 C-N-CA 124.629 1.172 . . . . 0.0 110.455 175.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.8 t -120.66 133.23 68.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 C-N-CA 125.828 1.651 . . . . 0.0 107.971 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.98 144.5 50.47 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 122.953 1.359 . . . . 0.0 112.16 172.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 m -156.98 157.7 35.23 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 126.47 1.908 . . . . 0.0 106.405 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -91.83 135.33 34.0 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.929 1.241 . . . . 0.0 112.458 176.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.69 -11.95 59.83 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.156 0.582 . . . . 0.0 110.773 164.257 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 126.68 -44.45 1.24 Allowed Glycine 0 C--N 1.346 1.09 0 C-N-CA 126.831 2.158 . . . . 0.0 112.859 169.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.0 mtp-105 -92.6 -22.11 19.67 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.85 2.86 . . . . 0.0 111.502 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -156.66 168.48 27.29 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 127.525 2.33 . . . . 0.0 109.087 -169.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 33.3 m -85.15 158.08 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 123.436 0.694 . . . . 0.0 110.828 168.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -129.57 162.39 28.33 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 128.518 2.727 . . . . 0.0 109.0 172.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -108.06 110.95 22.77 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 168.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.474 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -109.88 145.98 35.9 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.901 0.88 . . . . 0.0 110.399 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.6 mt -56.11 145.34 26.21 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 123.17 0.294 . . . . 0.0 110.208 169.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.2 -32.77 73.22 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -167.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -155.82 159.81 39.71 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.639 1.976 . . . . 0.0 111.033 168.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.2 p -45.27 -30.47 1.25 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 128.534 2.733 . . . . 0.0 114.176 168.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -54.41 -45.97 73.07 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 125.01 1.324 . . . . 0.0 112.652 172.362 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 11.2 mt -74.08 -45.36 49.81 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 118.527 -0.749 . . . . 0.0 109.645 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.97 -31.53 60.81 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.157 0.983 . . . . 0.0 112.459 175.162 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.5 mtt-85 -72.44 -64.03 1.03 Allowed 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 125.194 1.398 . . . . 0.0 113.379 174.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.56 -12.23 59.9 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 120.429 1.468 . . . . 0.0 112.592 -176.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 60.2 tp -75.78 -53.27 8.76 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.245 1.818 . . . . 0.0 110.155 164.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.22 -41.15 8.13 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 128.183 2.802 . . . . 0.0 117.947 -168.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.47 -22.39 66.86 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.105 1.453 . . . . 0.0 111.274 169.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 35.6 tp 68.94 128.48 0.03 OUTLIER 'General case' 0 C--N 1.344 0.363 0 C-N-CA 129.657 3.183 . . . . 0.0 114.223 165.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.492 HG23 HG12 ' A' ' 92' ' ' VAL . 3.6 m -53.19 140.86 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-O 122.566 1.174 . . . . 0.0 109.849 174.212 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -74.78 -4.95 40.69 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -162.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.492 HG12 HG23 ' A' ' 90' ' ' VAL . 2.4 p -62.31 23.89 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 C-N-CA 127.585 2.354 . . . . 0.0 115.722 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.7 t 73.85 8.51 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 C-N-CA 126.7 2.0 . . . . 0.0 112.23 167.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 tt 82.56 93.52 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 128.676 2.79 . . . . 0.0 108.609 -170.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.77 160.29 32.87 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.595 0.758 . . . . 0.0 112.616 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 58.4 t -65.29 144.94 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 124.648 1.179 . . . . 0.0 111.914 173.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -66.28 49.53 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 127.22 2.208 . . . . 0.0 114.773 169.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.8 p -122.49 165.39 16.45 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.853 1.661 . . . . 0.0 112.422 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -118.59 138.38 52.61 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 112.906 -1.952 . . . . 0.0 106.366 163.188 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 70.0 mm-40 -155.53 150.64 20.89 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 127.581 2.352 . . . . 0.0 107.476 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.47 149.33 84.57 Favored 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 122.481 2.12 . . . . 0.0 116.025 -167.245 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 34.5 t . . . . . 0 CA--C 1.553 1.077 0 C-N-CA 127.29 2.236 . . . . 0.0 108.475 175.015 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 12.1 mt . . . . . 0 N--CA 1.472 0.629 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.02 -48.35 76.66 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.98 0.912 . . . . 0.0 111.901 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 -51.35 -50.06 60.23 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.022 1.329 . . . . 0.0 110.996 177.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -65.34 -52.59 52.82 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.395 1.078 . . . . 0.0 111.955 -175.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.81 -29.73 73.94 Favored Glycine 0 CA--C 1.527 0.823 0 CA-C-O 119.098 -0.834 . . . . 0.0 112.806 -178.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.73 -37.65 73.49 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 118.495 1.148 . . . . 0.0 110.758 174.182 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.31 -29.36 70.7 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 118.174 -0.917 . . . . 0.0 112.749 176.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 mp -93.0 -34.69 13.63 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 175.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -90.77 92.02 8.62 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.723 1.209 . . . . 0.0 110.606 -178.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -169.11 141.12 2.07 Favored Pre-proline 0 N--CA 1.47 0.575 0 C-N-CA 127.487 2.315 . . . . 0.0 107.361 -169.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' PRO . . . . . 0.414 ' HG2' ' H ' ' B' ' 22' ' ' THR . 58.8 Cg_endo -45.74 -82.07 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.848 1 C-N-CA 125.475 4.117 . . . . 0.0 113.272 -167.647 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.43 ' HB ' ' CD2' ' B' ' 54' ' ' HIS . 29.5 m -85.32 -22.39 28.53 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.777 1.231 . . . . 0.0 111.179 -173.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.47 ' HG2' HD13 ' B' ' 58' ' ' LEU . 24.5 ttp-105 -68.38 -37.35 80.32 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 120.779 1.627 . . . . 0.0 112.274 176.447 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 40.2 t -57.52 -46.84 83.34 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 167.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.29 -41.06 96.32 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 117.895 -1.05 . . . . 0.0 113.47 178.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 5.4 mm -57.47 -45.7 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 CA-C-N 120.903 1.683 . . . . 0.0 110.767 171.075 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 85.6 mt -60.78 -49.83 75.91 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 118.008 -0.996 . . . . 0.0 111.378 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 m -65.36 -31.04 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 CA-C-N 119.481 1.037 . . . . 0.0 111.951 -177.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.07 -26.67 48.3 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.412 1.085 . . . . 0.0 111.611 178.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 tp -66.49 -40.67 89.4 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 117.647 -1.168 . . . . 0.0 112.712 168.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.49 -53.42 11.26 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.357 2.263 . . . . 0.0 112.168 -179.284 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -102.76 25.69 8.92 Favored 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 127.903 2.481 . . . . 0.0 111.334 177.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -126.01 -91.43 0.82 Allowed Glycine 0 N--CA 1.465 0.596 0 C-N-CA 127.52 2.486 . . . . 0.0 111.676 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 34' ' ' VAL . . . . . 0.525 HG12 ' HA ' ' B' ' 76' ' ' ALA . 23.6 m 39.25 30.27 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 126.272 1.829 . . . . 0.0 114.12 -165.601 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 80.6 m -82.46 -150.83 0.09 Allowed 'General case' 0 N--CA 1.438 -1.059 0 CA-C-O 123.872 1.796 . . . . 0.0 107.617 168.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.64 162.2 75.4 Favored Pre-proline 0 C--N 1.311 -1.068 0 O-C-N 120.801 -1.187 . . . . 0.0 113.846 -166.203 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -61.1 -15.78 41.67 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.261 2.641 . . . . 0.0 114.9 -177.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.66 0.97 45.59 Favored Glycine 0 CA--C 1.536 1.396 0 CA-C-O 118.663 -1.076 . . . . 0.0 115.356 170.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 3.3 pp0? -63.5 -31.51 72.7 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.353 1.577 . . . . 0.0 113.783 -169.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mt -64.48 -16.98 63.41 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.803 0.841 . . . . 0.0 111.692 -176.241 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.89 -28.17 69.66 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.279 0.49 . . . . 0.0 112.22 173.621 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.04 -52.1 9.92 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.352 0.661 . . . . 0.0 111.069 171.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 28.7 m170 -58.77 -36.33 74.22 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 22.3 mt -98.11 -15.88 19.78 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -175.609 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.34 6.06 31.83 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-N 119.252 0.933 . . . . 0.0 113.345 -170.318 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 79.9 mt -102.2 156.6 17.46 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.81 1.244 . . . . 0.0 111.163 -172.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 31.0 p -65.48 154.69 37.82 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.034 0.534 . . . . 0.0 110.939 -170.065 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -55.34 -27.8 49.53 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.206 0.602 . . . . 0.0 112.181 171.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 4.1 m -70.42 -53.63 15.68 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.056 0.943 . . . . 0.0 111.032 171.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -58.2 -43.65 87.71 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 124.227 1.011 . . . . 0.0 112.232 177.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 7.7 t -60.68 -44.27 96.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 124.847 1.259 . . . . 0.0 111.947 170.196 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 65.0 m -64.19 -38.44 91.05 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 120.49 1.495 . . . . 0.0 112.968 175.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -57.01 -57.99 10.12 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.32 1.448 . . . . 0.0 110.611 176.052 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 54' ' ' HIS . . . . . 0.43 ' CD2' ' HB ' ' B' ' 22' ' ' THR . 63.4 m-70 -74.39 -18.81 60.61 Favored 'General case' 0 CA--C 1.553 1.068 0 CA-C-O 118.219 -0.896 . . . . 0.0 113.099 -179.4 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 28.7 mt -71.53 -37.92 71.12 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 121.059 1.754 . . . . 0.0 113.009 167.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 18.9 m -53.32 -52.66 58.44 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 120.652 1.569 . . . . 0.0 114.708 -171.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 3.3 t -68.56 -24.44 64.62 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 119.635 1.107 . . . . 0.0 112.924 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 58' ' ' LEU . . . . . 0.47 HD13 ' HG2' ' B' ' 23' ' ' ARG . 5.4 tp -70.08 -43.06 71.91 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 127.057 2.143 . . . . 0.0 110.845 177.727 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 70.4 mtm180 -81.83 -9.67 59.54 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.934 1.694 . . . . 0.0 112.255 176.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.61 -52.68 2.42 Favored Glycine 0 C--N 1.34 0.776 0 C-N-CA 124.583 1.087 . . . . 0.0 111.314 174.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 91.0 m -76.53 0.45 19.92 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 125.635 1.574 . . . . 0.0 115.124 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.22 29.6 49.56 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.414 1.007 . . . . 0.0 114.666 174.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 86.9 mt -89.06 -24.52 22.28 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.251 -1.146 . . . . 0.0 113.007 172.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 5.8 m -136.71 150.39 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.221 1.409 . . . . 0.0 111.618 176.196 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 60.0 t -141.43 140.81 31.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.182 1.393 . . . . 0.0 110.381 -169.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -77.75 141.42 39.3 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.136 0.969 . . . . 0.0 112.146 175.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.8 m -162.33 167.3 24.03 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.689 1.996 . . . . 0.0 107.262 -173.407 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -90.91 149.04 22.06 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.885 1.675 . . . . 0.0 113.143 172.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -99.55 11.27 39.61 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 125.687 1.595 . . . . 0.0 110.078 165.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.76 -56.05 4.91 Favored Glycine 0 C--N 1.343 0.926 0 C-N-CA 126.061 1.791 . . . . 0.0 111.196 -176.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 22.5 mtp-105 -69.51 -21.14 63.69 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.845 1.658 . . . . 0.0 113.523 178.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -174.43 173.33 2.98 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.243 2.617 . . . . 0.0 108.788 -167.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 3.4 m -79.13 162.04 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 C-N-CA 123.616 0.766 . . . . 0.0 109.736 166.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 22.1 ptt180 -147.35 164.7 32.45 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.88 1.272 . . . . 0.0 111.694 -178.171 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -106.11 120.89 42.98 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 165.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 76' ' ' ALA . . . . . 0.525 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -114.1 153.17 29.95 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.008 1.323 . . . . 0.0 110.947 177.495 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 77.9 mt -59.06 148.81 29.64 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.477 0.58 . . . . 0.0 110.02 169.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.52 -9.57 58.71 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 115.91 1.819 . . . . 0.0 115.91 -169.403 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -177.32 157.91 1.39 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.897 2.879 . . . . 0.0 110.865 168.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 98.0 p -44.78 -32.51 1.57 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 128.517 2.727 . . . . 0.0 114.065 166.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -54.96 -47.05 75.04 Favored 'General case' 0 C--N 1.343 0.288 0 C-N-CA 124.361 1.064 . . . . 0.0 112.202 171.459 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 16.4 mt -70.83 -44.3 66.78 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 118.402 -0.809 . . . . 0.0 109.135 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.9 -35.24 57.84 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.557 0.743 . . . . 0.0 112.501 177.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 3.5 mtt-85 -71.74 -63.26 1.16 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.25 1.02 . . . . 0.0 113.624 174.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.63 -19.07 65.48 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.474 1.488 . . . . 0.0 112.852 -175.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 56.0 tp -72.86 -49.37 30.5 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.177 1.791 . . . . 0.0 111.005 167.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -82.24 -40.74 9.88 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 128.221 2.82 . . . . 0.0 116.758 -168.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -64.51 -23.48 67.29 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.429 1.614 . . . . 0.0 111.48 169.414 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 37.2 tp 70.56 132.03 0.03 OUTLIER 'General case' 0 C--N 1.344 0.354 0 C-N-CA 129.719 3.208 . . . . 0.0 113.675 167.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 90' ' ' VAL . . . . . 0.458 HG23 HG12 ' B' ' 92' ' ' VAL . 3.2 m -53.38 138.12 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-O 122.61 1.195 . . . . 0.0 110.173 176.839 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -69.72 -10.46 58.39 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 -163.621 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.458 HG12 HG23 ' B' ' 90' ' ' VAL . 2.6 p -62.79 24.35 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 127.244 2.218 . . . . 0.0 115.632 -177.402 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.7 t 71.23 11.47 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 C-N-CA 125.073 1.349 . . . . 0.0 111.622 168.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.8 tt 77.99 99.89 0.07 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 128.859 2.863 . . . . 0.0 109.342 -170.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.804 0 C-N-CA 123.785 0.834 . . . . 0.0 112.732 179.493 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 88.7 mt . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -45.89 -30.38 1.71 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.229 1.812 . . . . 0.0 114.824 174.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.5 mmt85 -68.09 -36.11 79.25 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 116.253 -1.832 . . . . 0.0 113.428 174.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -62.27 -48.29 80.59 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 121.807 2.094 . . . . 0.0 111.043 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.27 -40.03 98.55 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 111.728 -0.549 . . . . 0.0 111.728 176.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.2 ttt180 -62.55 -33.93 75.91 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.737 0.815 . . . . 0.0 111.413 170.691 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.05 -19.31 64.87 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.29 1.405 . . . . 0.0 112.302 175.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 mp -92.21 -28.07 17.27 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.417 1.008 . . . . 0.0 112.964 169.188 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -100.53 -12.57 19.18 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 -172.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -56.77 140.55 75.59 Favored Pre-proline 0 CA--C 1.549 0.93 0 CA-C-N 119.922 1.237 . . . . 0.0 107.989 168.288 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -52.83 -77.2 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.432 1 C-N-CA 126.36 4.707 . . . . 0.0 112.076 -167.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.9 m -58.84 -26.35 64.1 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-O 117.513 -1.232 . . . . 0.0 111.775 177.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.6 mtt85 -65.96 -44.34 85.25 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.693 1.588 . . . . 0.0 112.604 177.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.7 t -54.1 -51.16 65.05 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.173 1.351 . . . . 0.0 110.347 171.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.4 ttt85 -62.67 -40.7 97.9 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.921 -178.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.0 mm -53.14 -56.88 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 125.413 1.485 . . . . 0.0 109.22 168.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.33 -45.38 93.46 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.886 -0.578 . . . . 0.0 111.965 -172.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.1 p -69.85 -24.65 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 CA-C-N 119.333 0.97 . . . . 0.0 113.41 176.349 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.48 -8.56 59.74 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 121.153 -0.967 . . . . 0.0 113.441 170.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.468 HD23 ' HA ' ' A' ' 30' ' ' LEU . 11.4 mt -94.66 -9.53 34.64 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 172.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.37 -13.14 61.4 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 128.724 2.81 . . . . 0.0 111.902 165.545 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -141.08 -46.8 0.39 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.773 2.029 . . . . 0.0 113.963 -169.064 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.98 -66.17 2.31 Favored Glycine 0 C--N 1.339 0.746 0 C-N-CA 125.254 1.407 . . . . 0.0 112.955 -167.381 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 34.9 m 41.15 20.8 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 128.353 2.661 . . . . 0.0 117.418 171.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 67.0 m -85.28 -63.4 1.33 Allowed 'General case' 0 C--O 1.223 -0.31 0 O-C-N 120.486 -1.384 . . . . 0.0 111.899 -178.65 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -151.49 159.88 32.68 Favored Pre-proline 0 N--CA 1.473 0.723 0 N-CA-C 115.031 1.493 . . . . 0.0 115.031 -172.357 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -57.82 119.99 7.6 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.091 1.861 . . . . 0.0 107.56 168.032 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.57 0.17 84.48 Favored Glycine 0 CA--C 1.533 1.167 0 CA-C-O 117.297 -1.835 . . . . 0.0 115.483 -173.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -37.77 85.91 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 121.209 2.505 . . . . 0.0 109.971 168.732 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.9 mt -55.42 -27.29 46.91 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 125.962 1.705 . . . . 0.0 110.648 176.025 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.87 -30.3 68.9 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.301 -0.874 . . . . 0.0 113.071 -174.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.55 -53.68 7.73 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.661 0.784 . . . . 0.0 111.172 170.106 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -50.6 -35.39 30.03 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.2 mt -101.08 -13.87 18.02 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.86 1.264 . . . . 0.0 113.389 -173.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.15 13.05 66.61 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.337 0.97 . . . . 0.0 113.724 -173.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 53.9 mt -123.9 141.28 52.17 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.577 1.151 . . . . 0.0 110.114 -168.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.8 p -59.2 157.57 10.37 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -168.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -52.95 -28.63 24.51 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.909 0.884 . . . . 0.0 112.279 171.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.5 t -79.12 -36.68 40.23 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.06 -1.025 . . . . 0.0 112.832 175.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -68.33 -38.67 81.75 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.335 0.971 . . . . 0.0 111.888 171.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.8 t -57.12 -44.84 83.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.518 174.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.79 -39.17 93.16 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-N 120.483 1.492 . . . . 0.0 114.081 173.307 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -56.18 -32.96 64.84 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.214 1.005 . . . . 0.0 112.612 176.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 19.2 m-70 -94.56 -19.64 20.32 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 115.146 1.535 . . . . 0.0 115.146 172.49 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 47.1 mt -70.47 -28.67 65.18 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 121.159 1.8 . . . . 0.0 113.948 169.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 p -52.0 -59.42 4.37 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 -169.358 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 2.9 t -64.95 -39.39 93.42 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 118.557 0.617 . . . . 0.0 110.901 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.2 tp -51.76 -32.44 30.83 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.499 1.92 . . . . 0.0 112.266 -178.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.2 mtm105 -72.63 -45.67 57.85 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 118.824 0.738 . . . . 0.0 112.915 174.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.34 -28.08 62.51 Favored Glycine 0 N--CA 1.474 1.203 0 C-N-CA 125.348 1.452 . . . . 0.0 112.433 -176.031 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.1 m -66.93 -5.57 13.14 Favored 'General case' 0 CA--C 1.566 1.568 0 C-N-CA 127.414 2.285 . . . . 0.0 111.115 165.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.02 -24.92 1.91 Allowed Glycine 0 C--N 1.343 0.924 0 C-N-CA 128.711 3.053 . . . . 0.0 113.809 -172.78 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 69.9 mt -43.27 -39.55 3.08 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 128.519 2.728 . . . . 0.0 115.549 -170.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -115.4 133.68 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 124.922 1.289 . . . . 0.0 113.231 173.21 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 71.7 t -124.59 136.99 58.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 126.369 1.868 . . . . 0.0 109.549 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.33 141.4 30.94 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.797 1.239 . . . . 0.0 111.095 169.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.0 m -164.0 163.56 23.36 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.947 1.699 . . . . 0.0 107.244 -169.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -84.34 148.43 26.65 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.222 1.374 . . . . 0.0 114.177 174.046 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -91.76 -18.54 23.75 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.453 0.701 . . . . 0.0 110.24 163.609 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 128.8 -37.81 2.16 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 127.188 2.328 . . . . 0.0 113.252 173.18 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 23.1 ttm180 -93.97 -34.49 13.04 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 128.646 2.778 . . . . 0.0 111.841 170.009 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -144.43 164.07 31.93 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.745 2.018 . . . . 0.0 110.166 -170.556 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 32.9 m -84.56 150.3 4.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 CA-C-O 121.585 0.707 . . . . 0.0 111.298 168.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -135.63 162.27 33.18 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 126.872 2.069 . . . . 0.0 109.304 -171.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -97.57 153.74 17.98 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 164.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -158.83 161.52 36.91 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.164 1.386 . . . . 0.0 109.366 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 57.3 mt -72.35 152.76 41.87 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.363 0.665 . . . . 0.0 111.479 175.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.09 -40.21 95.07 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 115.13 1.53 . . . . 0.0 115.13 -173.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -162.57 161.19 26.7 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 125.411 1.484 . . . . 0.0 110.553 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.58 -37.69 0.14 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 129.515 3.126 . . . . 0.0 112.766 165.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -56.23 -52.11 65.63 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 125.563 1.545 . . . . 0.0 113.398 178.505 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.9 mt -70.5 -45.7 65.12 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.182 0.901 . . . . 0.0 109.23 -178.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -51.79 -42.11 62.18 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.453 1.101 . . . . 0.0 111.059 177.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 -65.59 -59.74 3.64 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.689 1.196 . . . . 0.0 113.321 171.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.28 -24.46 55.04 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 119.551 1.069 . . . . 0.0 113.329 -178.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.22 -41.5 16.88 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.077 -1.014 . . . . 0.0 112.937 169.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.01 -55.46 4.83 Favored Glycine 0 N--CA 1.471 1.014 0 C-N-CA 126.485 1.993 . . . . 0.0 114.259 -173.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -72.1 -10.34 59.65 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 119.196 1.498 . . . . 0.0 110.895 167.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.5 tp 74.88 138.9 0.06 Allowed 'General case' 0 C--N 1.345 0.409 0 C-N-CA 129.568 3.147 . . . . 0.0 110.554 169.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 32.6 m -66.74 21.05 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 124.923 1.289 . . . . 0.0 113.584 176.138 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 48.0 mm-40 78.14 -12.3 1.09 Allowed 'General case' 0 N--CA 1.443 -0.782 0 O-C-N 120.238 -1.539 . . . . 0.0 112.058 161.144 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.6 p -65.84 34.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 128.881 2.872 . . . . 0.0 115.24 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . 0.271 34.8 m 51.27 15.49 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 130.028 3.331 . . . . 0.0 115.832 175.119 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 38.7 tp 107.25 101.88 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.659 1 C-N-CA 131.759 4.024 . . . . 0.0 110.501 178.116 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.36 76.49 0.26 Allowed 'General case' 0 CA--C 1.553 1.074 0 O-C-N 121.262 -0.899 . . . . 0.0 111.89 168.435 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.92 162.02 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 C-N-CA 126.818 2.047 . . . . 0.0 113.178 175.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -63.6 -1.37 1.23 Allowed 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 126.914 2.086 . . . . 0.0 115.008 173.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.2 p -62.61 111.44 2.07 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 126.178 1.791 . . . . 0.0 111.323 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -66.21 140.75 58.19 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 171.2 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -157.47 127.06 3.2 Favored Pre-proline 0 N--CA 1.443 -0.811 0 N-CA-C 106.125 -1.805 . . . . 0.0 106.125 174.033 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . 0.27 59.5 Cg_endo -73.42 117.13 4.95 Favored 'Trans proline' 0 C--N 1.352 0.713 0 CA-C-N 121.399 1.535 . . . . 0.0 114.149 -166.349 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 50.5 t . . . . . 0 CA--C 1.538 0.495 0 C-N-CA 130.221 3.408 . . . . 0.0 106.946 -160.567 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 72.2 mt . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -39.22 -33.86 0.16 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.302 2.241 . . . . 0.0 114.485 172.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 1.8 mmm-85 -63.09 -31.21 72.29 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.795 2.038 . . . . 0.0 114.482 178.279 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -60.93 -51.88 67.38 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 120.41 1.459 . . . . 0.0 111.033 173.31 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.61 -35.52 74.61 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.106 -0.798 . . . . 0.0 111.106 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 52.7 ttt180 -64.55 -31.84 73.23 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 123.76 0.824 . . . . 0.0 111.057 171.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.28 -27.51 65.48 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 120.714 1.597 . . . . 0.0 111.99 174.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 mp -87.95 -7.57 56.93 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 172.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -125.2 -14.55 6.49 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 117.235 2.309 . . . . 0.0 117.235 -175.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -54.93 143.8 50.48 Favored Pre-proline 0 CA--C 1.546 0.821 0 CA-C-N 120.671 1.578 . . . . 0.0 108.582 170.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -43.64 -80.69 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 1 C-N-CA 127.453 5.436 . . . . 0.0 113.992 -166.712 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.5 ' HB ' ' CD2' ' B' ' 54' ' ' HIS . 7.3 m -67.74 -14.23 62.78 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.664 -0.647 . . . . 0.0 111.553 176.102 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.68 -47.06 42.56 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.768 1.167 . . . . 0.0 112.712 -171.536 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 54.1 t -51.83 -47.33 64.41 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 167.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 13.9 ttt85 -61.22 -42.56 98.83 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 118.059 -0.972 . . . . 0.0 112.862 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -56.62 -47.78 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 CA-C-N 121.176 1.807 . . . . 0.0 111.176 171.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 40.7 mt -66.94 -50.68 61.59 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 118.919 -0.562 . . . . 0.0 111.397 -178.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 p -70.14 -25.38 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 CA-C-N 119.163 0.892 . . . . 0.0 111.265 -177.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.33 -43.87 63.47 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-O 117.566 -1.207 . . . . 0.0 110.414 167.759 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.432 ' HA ' HD23 ' B' ' 30' ' ' LEU . 9.7 mt -60.08 -27.09 66.71 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.539 1.518 . . . . 0.0 115.042 -178.808 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -44.71 -28.84 0.67 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 126.717 2.007 . . . . 0.0 111.925 168.121 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -120.08 -31.27 4.47 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 129.556 3.142 . . . . 0.0 113.784 169.091 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.79 16.43 4.23 Favored Glycine 0 N--CA 1.468 0.793 0 C-N-CA 130.019 3.676 . . . . 0.0 115.999 -163.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 20.0 m -58.49 30.39 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 127.609 2.364 . . . . 0.0 117.361 170.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 71.1 m -87.64 -69.06 0.71 Allowed 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.793 -1.192 . . . . 0.0 113.442 178.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -159.54 158.3 27.51 Favored Pre-proline 0 N--CA 1.475 0.781 0 CA-C-N 120.266 1.394 . . . . 0.0 114.341 -172.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -57.07 115.31 2.41 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 122.451 2.101 . . . . 0.0 109.28 170.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 93.66 1.45 65.92 Favored Glycine 0 CA--C 1.532 1.143 0 CA-C-O 117.348 -1.807 . . . . 0.0 115.313 -174.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 39' ' ' GLN . . . . . 0.471 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -63.56 -39.5 94.57 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 120.566 2.183 . . . . 0.0 110.007 168.91 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 9.9 mt -56.52 -24.29 45.51 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 124.69 1.196 . . . . 0.0 110.986 -177.605 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.8 -31.62 62.8 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.289 -0.882 . . . . 0.0 112.219 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.45 -55.97 5.05 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.96 0.904 . . . . 0.0 111.198 171.333 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 43' ' ' HIS . . . . . 0.471 ' CD2' HE22 ' B' ' 39' ' ' GLN . 3.2 m-70 -54.51 -29.27 49.95 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.436 HD12 HG22 ' B' ' 51' ' ' VAL . 19.5 mt -105.34 -14.58 15.29 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.197 1.399 . . . . 0.0 112.887 -175.083 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 65.51 14.17 59.68 Favored Glycine 0 CA--C 1.53 0.978 0 C-N-CA 124.323 0.963 . . . . 0.0 113.2 -173.288 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 39.9 mt -120.3 158.66 26.59 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.184 0.992 . . . . 0.0 112.214 -168.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 20.4 p -66.03 154.65 38.93 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.468 0.651 . . . . 0.0 111.151 -169.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -60.99 -19.76 61.62 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.701 -0.624 . . . . 0.0 111.806 173.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 13.6 m -72.27 -53.55 12.15 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.841 1.256 . . . . 0.0 110.931 168.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -59.22 -37.23 77.0 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.616 1.166 . . . . 0.0 112.024 176.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 51' ' ' VAL . . . . . 0.436 HG22 HD12 ' B' ' 44' ' ' LEU . 10.5 t -63.79 -43.3 97.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 124.293 1.037 . . . . 0.0 112.348 169.751 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 18.1 m -61.02 -45.12 96.1 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 120.462 1.483 . . . . 0.0 112.069 173.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 -57.41 -28.11 62.97 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 127.31 2.244 . . . . 0.0 113.089 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 54' ' ' HIS . . . . . 0.5 ' CD2' ' HB ' ' B' ' 22' ' ' THR . 35.3 m-70 -99.29 -20.12 16.72 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 173.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 50.0 mt -77.71 -22.52 50.3 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 117.039 -1.458 . . . . 0.0 114.875 170.297 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -44.97 -69.89 0.12 Allowed 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 121.987 2.176 . . . . 0.0 113.888 175.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.5 t -63.9 -42.97 97.3 Favored 'General case' 0 C--O 1.215 -0.76 0 C-N-CA 124.384 1.074 . . . . 0.0 109.916 -178.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.04 -39.63 28.08 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.994 1.318 . . . . 0.0 113.531 176.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 49.1 mtm180 -87.36 -19.91 27.47 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.57 -31.46 10.32 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 125.323 1.439 . . . . 0.0 114.902 175.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 85.1 m -67.27 -10.77 54.04 Favored 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 128.365 2.666 . . . . 0.0 112.501 169.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.31 19.16 78.6 Favored Glycine 0 CA--C 1.529 0.952 0 C-N-CA 124.685 1.136 . . . . 0.0 113.54 -174.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 83.0 mt -78.3 -30.71 48.49 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.401 1.1 . . . . 0.0 112.704 175.095 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 19.6 t -133.5 137.0 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 125.485 1.514 . . . . 0.0 111.259 -170.523 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 42.4 t -133.97 144.84 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.034 1.334 . . . . 0.0 110.825 -169.039 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -86.81 137.85 32.07 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.124 1.37 . . . . 0.0 111.38 173.65 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 18.2 m -161.45 170.04 20.75 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.891 1.676 . . . . 0.0 107.652 -171.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -91.3 145.49 24.61 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 120.419 1.463 . . . . 0.0 113.434 171.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.262 0.0 OUTLIER -88.16 -16.81 32.38 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.492 0.717 . . . . 0.0 110.928 164.667 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 128.28 -35.55 2.68 Favored Glycine 0 CA--C 1.535 1.308 0 C-N-CA 127.407 2.432 . . . . 0.0 113.201 172.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 13.1 ttm180 -96.36 -35.75 11.09 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 129.07 2.948 . . . . 0.0 111.62 170.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -143.62 163.23 33.81 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 127.171 2.188 . . . . 0.0 109.827 -169.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 33.7 m -82.81 153.2 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-O 121.309 0.576 . . . . 0.0 111.652 169.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -136.35 159.02 43.03 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 127.071 2.148 . . . . 0.0 109.845 -171.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -99.54 147.37 25.4 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 162.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -147.42 156.12 42.58 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 123.679 0.792 . . . . 0.0 109.133 178.08 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 40.5 mt -60.58 154.13 21.87 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 168.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.59 -26.81 68.01 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -171.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -174.79 164.43 3.53 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.108 2.163 . . . . 0.0 110.673 169.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.2 m -35.59 -34.78 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 129.749 3.22 . . . . 0.0 113.213 165.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -61.88 -43.32 99.08 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.03 1.332 . . . . 0.0 111.767 -179.42 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 11.6 mt -74.31 -44.3 53.16 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.985 1.266 . . . . 0.0 110.045 172.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.08 -28.11 16.35 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.661 1.184 . . . . 0.0 112.313 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 39.5 mtt180 -72.23 -63.32 1.17 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.013 1.725 . . . . 0.0 114.682 170.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.33 -13.93 9.89 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 120.129 -1.607 . . . . 0.0 113.303 175.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 5.3 tp -86.09 -44.34 12.34 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 127.5 2.32 . . . . 0.0 112.824 168.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -83.83 -58.26 2.28 Favored Glycine 0 N--CA 1.476 1.305 0 C-N-CA 127.428 2.442 . . . . 0.0 114.428 -174.175 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 9.4 pm0 -67.89 -14.73 63.19 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 119.882 1.841 . . . . 0.0 110.232 165.539 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 89' ' ' LEU . . . . . 0.405 ' C ' ' H ' ' B' ' 91' ' ' GLN . 43.3 tp 76.55 160.0 0.22 Allowed 'General case' 0 C--N 1.346 0.437 0 C-N-CA 129.63 3.172 . . . . 0.0 110.558 169.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 28.9 m -66.79 18.8 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 120.856 -1.152 . . . . 0.0 112.401 168.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 91' ' ' GLN . . . . . 0.405 ' H ' ' C ' ' B' ' 89' ' ' LEU . 33.3 mm-40 72.48 -0.91 3.13 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.815 1.246 . . . . 0.0 113.268 166.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.9 p -60.57 34.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 130.107 3.363 . . . . 0.0 115.455 173.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.263 30.0 m 52.03 14.6 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 130.266 3.426 . . . . 0.0 116.201 175.481 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 41.9 tp 109.93 101.92 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 130.45 3.5 . . . . 0.0 109.697 -174.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.932 0 C-N-CA 124.675 1.19 . . . . 0.0 111.592 168.796 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.0 mp . . . . . 0 CA--C 1.542 0.672 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.74 -50.07 33.47 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.421 -0.799 . . . . 0.0 111.139 169.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.4 mmt85 -60.13 -35.55 75.52 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.236 -1.54 . . . . 0.0 112.566 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -56.27 -56.92 15.03 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 126.55 1.94 . . . . 0.0 110.72 178.502 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -75.02 -30.76 58.7 Favored Glycine 0 CA--C 1.531 1.084 0 CA-C-N 119.28 0.946 . . . . 0.0 112.54 -178.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -61.62 -28.84 69.65 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 118.501 1.151 . . . . 0.0 112.027 169.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.514 ' CB ' HH21 ' A' ' 23' ' ' ARG . . . -85.77 -21.48 28.17 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.285 2.234 . . . . 0.0 114.356 173.182 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.9 tp -78.45 -28.84 46.68 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.101 1.76 . . . . 0.0 110.005 177.511 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -108.04 62.81 0.61 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.599 1.16 . . . . 0.0 112.197 168.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -125.46 141.58 39.34 Favored Pre-proline 0 CA--C 1.557 1.232 0 C-N-CA 127.686 2.394 . . . . 0.0 107.047 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -45.84 -90.46 0.0 OUTLIER 'Trans proline' 0 C--N 1.356 0.944 1 C-N-CA 127.634 5.556 . . . . 0.0 117.073 -163.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.2 m -46.96 -27.43 1.27 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.437 1.895 . . . . 0.0 111.987 169.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.514 HH21 ' CB ' ' A' ' 17' ' ' ALA . 1.8 ttp180 -73.3 -45.89 52.82 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 126.012 1.725 . . . . 0.0 113.644 -168.318 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.9 t -54.35 -48.82 71.01 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 120.229 1.377 . . . . 0.0 110.324 168.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 -52.45 -52.38 54.42 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-O 117.945 -1.026 . . . . 0.0 112.127 173.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.462 ' HA ' HD11 ' A' ' 44' ' ' LEU . 1.3 mt -50.52 -50.17 22.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 CA-C-N 121.03 1.741 . . . . 0.0 111.767 172.354 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 93.6 mt -69.55 -37.58 77.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 118.28 -0.866 . . . . 0.0 112.608 -170.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.3 p -74.74 -21.34 17.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 CA-C-N 119.19 0.904 . . . . 0.0 111.985 174.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.9 -44.29 27.53 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 118.077 -0.963 . . . . 0.0 110.764 168.372 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 30' ' ' LEU . 12.4 mt -62.18 -18.96 62.52 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -176.28 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.6 mt -53.29 -22.11 6.57 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 124.528 1.131 . . . . 0.0 111.665 166.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -129.17 -29.11 2.29 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 128.815 2.846 . . . . 0.0 113.564 169.373 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.25 11.21 2.98 Favored Glycine 0 N--CA 1.473 1.156 0 C-N-CA 128.941 3.162 . . . . 0.0 116.057 -165.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.626 HG12 ' HA ' ' A' ' 76' ' ' ALA . 27.7 m -66.46 39.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 C-N-CA 128.21 2.604 . . . . 0.0 115.721 172.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 5.1 t -100.81 -60.42 1.53 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.416 1.086 . . . . 0.0 113.033 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 53.6 p90 -158.21 154.97 25.09 Favored Pre-proline 0 N--CA 1.478 0.927 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -178.701 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -61.01 116.88 3.65 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.525 2.15 . . . . 0.0 109.538 175.137 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.41 -12.19 59.94 Favored Glycine 0 C--O 1.22 -0.772 0 CA-C-O 115.986 -2.563 . . . . 0.0 114.75 -175.339 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -29.26 68.96 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-N 120.629 2.214 . . . . 0.0 111.838 175.395 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.413 HD13 HG23 ' A' ' 26' ' ' ILE . 17.9 mt -63.13 -18.97 64.02 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.311 0.644 . . . . 0.0 110.775 177.483 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.52 -42.37 96.31 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 119.444 1.02 . . . . 0.0 110.472 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.45 -51.16 66.86 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.517 1.053 . . . . 0.0 112.348 173.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -57.27 -36.69 71.32 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.462 HD11 ' HA ' ' A' ' 26' ' ' ILE . 19.6 mt -101.82 -14.49 17.26 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -170.622 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.08 10.97 36.24 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 114.676 0.63 . . . . 0.0 114.676 -172.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.0 mp -101.16 141.52 33.92 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 173.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.3 t -59.1 147.8 33.63 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 121.909 -0.495 . . . . 0.0 111.277 -176.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -57.09 -27.99 62.23 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.253 1.021 . . . . 0.0 113.439 -171.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.8 p -69.41 -55.44 10.32 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.261 -0.9 . . . . 0.0 112.767 170.274 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -54.57 -49.06 71.26 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.08 0.952 . . . . 0.0 112.12 177.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 84.9 t -59.56 -40.69 82.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 O-C-N 121.803 -0.561 . . . . 0.0 111.065 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 46.5 m -69.99 -27.24 64.54 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 178.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 32.0 t-20 -58.93 -45.36 90.57 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.019 0.827 . . . . 0.0 110.94 170.164 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 40.0 m-70 -71.65 -22.65 61.66 Favored 'General case' 0 CA--C 1.551 1.019 0 O-C-N 120.146 -1.596 . . . . 0.0 114.268 170.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 73.6 mt -70.55 -25.35 63.05 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 120.62 1.555 . . . . 0.0 111.697 168.371 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.14 -42.1 63.07 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.121 0.873 . . . . 0.0 111.736 170.24 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 2.4 t -83.68 -39.45 20.18 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 119.483 1.038 . . . . 0.0 111.886 -178.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.441 ' CD1' ' HG2' ' A' ' 23' ' ' ARG . 1.1 tp -52.31 -42.33 63.71 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.609 1.564 . . . . 0.0 113.408 175.058 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.8 mtm180 -85.19 -1.07 56.49 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.493 1.117 . . . . 0.0 112.025 -179.115 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -109.17 -41.84 1.35 Allowed Glycine 0 N--CA 1.477 1.413 0 C-N-CA 126.159 1.838 . . . . 0.0 113.201 175.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.7 m -59.49 -16.62 25.45 Favored 'General case' 0 CA--C 1.561 1.394 0 C-N-CA 127.515 2.326 . . . . 0.0 112.785 169.073 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.98 20.0 74.02 Favored Glycine 0 C--N 1.343 0.953 0 C-N-CA 125.714 1.626 . . . . 0.0 113.987 -176.312 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.6 mt -71.12 -23.98 62.19 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.303 1.441 . . . . 0.0 113.13 171.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 13.7 t -142.6 144.97 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -166.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 9.6 t -133.42 141.63 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 C-N-CA 125.276 1.43 . . . . 0.0 109.479 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -96.67 148.52 22.78 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.377 1.071 . . . . 0.0 112.526 175.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.9 p -133.91 144.85 49.11 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.634 0.774 . . . . 0.0 109.674 172.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -94.96 107.97 20.02 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 125.376 1.47 . . . . 0.0 108.978 169.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.78 14.24 0.22 Allowed 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -176.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.2 -17.48 26.61 Favored Glycine 0 CA--C 1.529 0.933 0 C-N-CA 126.008 1.766 . . . . 0.0 113.189 -177.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 20.3 ttp-105 -158.17 -48.15 0.06 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.658 1.183 . . . . 0.0 112.103 -169.198 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -93.75 173.76 7.52 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.096 1.758 . . . . 0.0 110.317 171.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 20.6 m -122.77 149.28 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 125.014 1.325 . . . . 0.0 108.664 167.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.5 ptt85 -138.14 177.12 8.12 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.877 1.671 . . . . 0.0 109.372 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -117.03 174.69 5.96 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.035 0.934 . . . . 0.0 110.893 168.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.626 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -168.87 145.97 3.7 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 126.385 1.874 . . . . 0.0 109.859 177.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 91.0 mt -56.23 148.76 17.61 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 123.505 0.503 . . . . 0.0 110.589 169.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.15 -28.5 60.16 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.875 1.806 . . . . 0.0 115.875 -168.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -156.16 160.12 39.6 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 124.195 1.95 . . . . 0.0 112.988 170.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -40.32 -28.85 0.07 Allowed 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 130.49 3.516 . . . . 0.0 113.831 165.502 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -60.15 -62.16 2.07 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 126.484 1.914 . . . . 0.0 110.653 171.317 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.8 mt -62.31 -47.65 83.34 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -176.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.69 -48.06 66.82 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.7 ptp180 -75.55 -37.2 60.17 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -175.009 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -76.7 -39.41 52.07 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.455 1.025 . . . . 0.0 110.69 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.99 -32.32 70.74 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.216 -0.928 . . . . 0.0 110.163 169.177 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.86 -18.56 76.21 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 125.712 1.625 . . . . 0.0 115.401 171.599 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.38 -20.36 63.83 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 120.04 1.92 . . . . 0.0 110.259 166.837 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 13.5 tp 66.91 61.86 0.5 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 128.101 2.56 . . . . 0.0 109.877 -169.599 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 61.9 t -25.88 128.17 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 128.035 2.534 . . . . 0.0 114.557 -172.216 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.417 ' C ' ' H ' ' A' ' 93' ' ' VAL . 0.8 OUTLIER -94.3 6.86 47.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 112.758 -2.019 . . . . 0.0 111.269 -109.688 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.8 p -63.71 34.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 130.239 3.416 . . . . 0.0 113.382 169.398 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.417 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.5 t 69.63 18.18 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.983 0 C-N-CA 125.534 1.534 . . . . 0.0 112.004 168.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 5.4 tt 103.0 102.93 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 131.342 3.857 . . . . 0.0 108.749 -173.377 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.46 76.22 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 115.34 1.608 . . . . 0.0 115.34 176.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 99.2 t -58.73 153.51 3.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 127.419 2.288 . . . . 0.0 111.241 169.125 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -59.48 -0.24 0.15 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 127.752 2.421 . . . . 0.0 116.813 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.437 ' HG1' ' N ' ' B' ' 11' ' ' LEU . 31.3 p -49.01 101.53 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.214 1.406 . . . . 0.0 113.394 178.099 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -99.21 141.08 32.44 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 164.362 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -138.34 141.8 32.86 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 -169.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -54.85 -29.44 63.22 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 123.325 2.684 . . . . 0.0 114.779 -171.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 10.4 t . . . . . 0 CA--C 1.536 0.404 0 C-N-CA 126.829 2.052 . . . . 0.0 112.189 169.173 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.437 ' N ' ' HG1' ' A' ' 98' ' ' THR . 5.0 mp . . . . . 0 CA--C 1.545 0.751 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -81.67 -43.96 17.8 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.945 0.793 . . . . 0.0 110.736 166.123 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 12.0 mmt85 -62.32 -32.06 72.77 Favored 'General case' 0 N--CA 1.473 0.7 0 O-C-N 120.394 -1.441 . . . . 0.0 112.394 178.179 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -46.04 -63.9 0.87 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 127.896 2.478 . . . . 0.0 110.725 170.359 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.76 -31.33 62.6 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 119.758 -1.211 . . . . 0.0 112.491 -174.019 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -66.79 -27.72 67.81 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.448 1.099 . . . . 0.0 112.285 174.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -86.43 -21.58 27.02 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 127.556 2.342 . . . . 0.0 113.727 175.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.0 mp -84.37 -45.19 13.0 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.045 0.838 . . . . 0.0 109.901 173.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.91 49.16 1.32 Allowed 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.204 -0.935 . . . . 0.0 112.162 169.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -117.75 134.57 23.22 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 128.587 2.755 . . . . 0.0 106.567 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -46.3 -90.13 0.0 OUTLIER 'Trans proline' 0 CA--C 1.537 0.672 1 C-N-CA 126.545 4.83 . . . . 0.0 115.682 -164.228 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 91.3 m -54.63 -26.79 35.1 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.764 1.226 . . . . 0.0 111.251 174.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.636 ' HG2' HD13 ' B' ' 58' ' ' LEU . 6.6 mtp180 -74.13 -36.7 64.2 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 117.062 -1.447 . . . . 0.0 114.355 -171.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 41.4 t -58.04 -51.15 70.85 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.521 1.509 . . . . 0.0 109.364 168.013 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 38.8 mtp180 -51.89 -45.37 64.15 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 124.854 1.261 . . . . 0.0 111.825 173.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 7.0 mt -52.8 -67.05 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 CA-C-N 120.167 1.349 . . . . 0.0 110.099 169.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 87.4 mt -53.68 -37.99 63.75 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -168.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 7.2 p -72.29 -24.28 22.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-N 119.484 1.038 . . . . 0.0 113.75 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -95.35 -18.58 20.64 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.017 1.327 . . . . 0.0 113.461 173.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.04 -50.3 71.19 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.901 1.681 . . . . 0.0 109.102 175.046 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -39.11 -53.12 1.86 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 130.514 3.526 . . . . 0.0 113.639 -174.543 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -101.55 -15.48 17.09 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.556 1.942 . . . . 0.0 112.619 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.62 -65.31 2.17 Favored Glycine 0 C--N 1.341 0.808 0 C-N-CA 125.501 1.524 . . . . 0.0 112.005 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 34' ' ' VAL . . . . . 0.441 HG12 ' HA ' ' B' ' 76' ' ' ALA . 29.6 m 27.21 40.14 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 N-CA-C 116.664 2.098 . . . . 0.0 116.664 -173.556 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -92.11 -73.71 0.54 Allowed 'General case' 0 N--CA 1.465 0.302 0 O-C-N 121.394 -0.816 . . . . 0.0 112.365 -167.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 36' ' ' TYR . . . . . 0.495 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 34.7 p90 -151.18 163.53 23.33 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 124.168 0.987 . . . . 0.0 113.441 -178.531 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -51.76 117.2 3.3 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 122.507 2.138 . . . . 0.0 110.953 170.571 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.06 -4.57 84.72 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-O 118.383 -1.232 . . . . 0.0 115.16 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 39' ' ' GLN . . . . . 0.495 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 0.0 OUTLIER -56.29 -18.53 10.91 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 120.371 2.085 . . . . 0.0 114.848 175.966 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.401 ' HB2' HG11 ' B' ' 51' ' ' VAL . 1.8 mt -75.46 -15.97 60.37 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 124.325 1.05 . . . . 0.0 110.894 178.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.76 -39.16 87.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 119.398 0.999 . . . . 0.0 112.698 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.77 -42.06 77.96 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.803 170.238 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -62.19 -36.79 82.98 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 176.308 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 27.0 mt -101.69 -17.37 16.32 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 -169.137 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.1 13.15 47.4 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-O 121.961 0.756 . . . . 0.0 113.844 -169.41 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mp -99.44 131.14 45.65 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 169.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 11.8 t -56.38 148.83 18.01 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -176.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -55.19 -23.87 24.08 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.482 1.513 . . . . 0.0 114.382 -175.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 60.7 p -72.98 -53.17 11.87 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.292 1.405 . . . . 0.0 112.339 169.103 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 63.7 t-20 -57.52 -47.19 82.64 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.357 1.063 . . . . 0.0 111.916 -178.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 51' ' ' VAL . . . . . 0.401 HG11 ' HB2' ' B' ' 40' ' ' LEU . 27.4 t -63.11 -36.59 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 O-C-N 121.203 -0.935 . . . . 0.0 111.54 177.072 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 55.3 m -71.87 -29.72 64.67 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -55.48 -45.85 76.92 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 122.089 0.947 . . . . 0.0 110.54 170.765 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 -71.73 -23.16 61.57 Favored 'General case' 0 CA--C 1.556 1.199 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 171.069 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 65.9 mt -74.85 -18.71 60.4 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-N 121.192 1.814 . . . . 0.0 112.175 168.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.36 -50.17 70.38 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.21 0.914 . . . . 0.0 110.581 172.783 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 6.1 t -76.01 -39.45 55.73 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 118.554 0.615 . . . . 0.0 112.236 -177.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 58' ' ' LEU . . . . . 0.636 HD13 ' HG2' ' B' ' 23' ' ' ARG . 4.8 tp -56.05 -40.87 74.15 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.845 1.658 . . . . 0.0 112.361 -175.385 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 -81.32 -9.75 59.69 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.717 1.207 . . . . 0.0 112.33 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -93.17 -39.42 5.13 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 125.076 1.322 . . . . 0.0 111.827 169.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 43.5 m -58.07 -18.18 22.96 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 127.528 2.331 . . . . 0.0 113.216 169.608 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 81.51 -9.52 54.8 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 125.709 1.624 . . . . 0.0 113.838 -176.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 92.5 mt -51.41 -31.63 23.4 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 128.079 2.551 . . . . 0.0 114.315 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -129.91 138.87 52.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 C-N-CA 126.376 1.87 . . . . 0.0 109.44 177.067 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 51.2 t -122.02 135.9 60.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 C-N-CA 127.153 2.181 . . . . 0.0 108.713 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -87.54 136.05 33.1 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.589 0.756 . . . . 0.0 112.42 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 14.1 p -136.74 148.08 47.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.492 0.717 . . . . 0.0 110.566 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -100.09 107.25 19.1 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.964 1.306 . . . . 0.0 110.198 175.312 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.83 9.46 0.38 Allowed 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 116.2 1.926 . . . . 0.0 116.2 -177.405 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 116.24 -17.93 14.24 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.921 1.724 . . . . 0.0 113.083 -177.56 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 20.0 ttp-105 -157.88 -42.99 0.06 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.447 1.499 . . . . 0.0 111.957 -169.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -102.27 171.64 7.35 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.259 1.824 . . . . 0.0 111.136 175.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 23.8 m -120.01 143.06 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.017 1.327 . . . . 0.0 110.377 168.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.2 ptt180 -131.98 175.1 9.51 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.041 1.336 . . . . 0.0 110.808 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -122.65 125.65 46.03 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.556 1.142 . . . . 0.0 108.588 167.207 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 76' ' ' ALA . . . . . 0.441 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -123.61 150.42 44.15 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.451 1.1 . . . . 0.0 110.365 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 tp -53.02 145.26 13.34 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.585 1.154 . . . . 0.0 110.326 172.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.27 -37.9 84.83 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 -173.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -169.11 161.41 10.37 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 123.698 1.713 . . . . 0.0 112.592 -174.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -34.96 -39.45 0.1 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 130.662 3.585 . . . . 0.0 113.162 165.395 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -50.79 -67.39 0.26 Allowed 'General case' 0 C--N 1.345 0.386 0 C-N-CA 127.033 2.133 . . . . 0.0 111.877 173.111 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 16.8 mt -62.35 -37.46 85.75 Favored 'General case' 0 C--O 1.223 -0.336 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.6 -41.89 98.3 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 118.471 -0.776 . . . . 0.0 112.276 -174.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -71.45 -52.06 20.49 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-O 117.878 -1.058 . . . . 0.0 111.772 174.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.79 -38.01 89.5 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 120.109 1.322 . . . . 0.0 112.311 -173.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' B' ' 86' ' ' LEU . 0.3 OUTLIER -71.85 -29.16 64.09 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.39 -0.819 . . . . 0.0 112.109 173.445 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -87.09 -29.75 21.97 Favored Glycine 0 CA--C 1.543 1.796 0 C-N-CA 124.847 1.213 . . . . 0.0 116.022 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -89.04 -8.68 53.5 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.971 1.709 . . . . 0.0 112.82 171.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 13.7 tp 85.69 84.94 0.02 OUTLIER 'General case' 0 C--O 1.239 0.521 0 C-N-CA 128.801 2.84 . . . . 0.0 114.18 166.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 55.4 t -46.89 131.3 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-O 124.624 2.155 . . . . 0.0 110.172 169.06 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 91' ' ' GLN . . . . . 0.404 ' C ' ' H ' ' B' ' 93' ' ' VAL 0.288 2.0 tp-100 -100.19 10.76 40.76 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 111.902 -2.408 . . . . 0.0 112.501 -120.021 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 6.7 p -67.32 42.39 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.71 1 C-N-CA 132.674 4.389 . . . . 0.0 110.853 166.811 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 93' ' ' VAL . . . . . 0.404 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.2 OUTLIER 56.73 9.24 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 C-N-CA 129.326 3.05 . . . . 0.0 116.247 177.767 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 7.3 tt 97.41 106.06 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 129.902 3.281 . . . . 0.0 104.415 -165.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.736 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 -177.098 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.561 ' HG ' HG11 ' B' ' 92' ' ' VAL . 0.7 OUTLIER . . . . . 0 N--CA 1.467 0.388 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.97 -60.3 3.5 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 118.249 -0.881 . . . . 0.0 112.43 -177.242 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.5 ptp85 -61.33 -35.41 77.31 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.658 1.117 . . . . 0.0 112.69 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -59.55 -63.11 1.42 Allowed 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.805 0.842 . . . . 0.0 110.793 174.835 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.83 -31.34 62.42 Favored Glycine 0 C--N 1.337 0.588 0 CA-C-O 118.222 -1.321 . . . . 0.0 112.388 -169.419 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.77 -8.1 32.86 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.032 1.916 . . . . 0.0 114.269 173.102 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.47 -6.23 14.47 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.153 1.381 . . . . 0.0 112.753 169.227 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.492 HD12 ' HA ' ' A' ' 18' ' ' LEU . 3.7 tp -96.07 -37.71 10.5 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.227 1.411 . . . . 0.0 110.381 176.515 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.61 34.69 0.33 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 128.149 2.58 . . . . 0.0 115.469 -172.498 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -103.0 165.76 13.06 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 129.785 3.234 . . . . 0.0 113.209 -168.79 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -69.57 -104.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.549 1.258 1 C-N-CA 126.206 4.604 . . . . 0.0 110.832 168.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -46.9 -37.99 9.77 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 127.346 2.259 . . . . 0.0 112.877 176.736 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.515 ' CD ' HD13 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -67.18 -32.7 73.95 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 117.964 -1.017 . . . . 0.0 113.505 -176.523 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 40.6 t -60.74 -52.14 66.36 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 119.041 0.837 . . . . 0.0 109.826 169.366 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 78.7 mtt-85 -52.61 -45.43 66.57 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.175 1.39 . . . . 0.0 113.239 175.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.8 mt -45.27 -63.94 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 C-N-CA 124.028 0.931 . . . . 0.0 110.887 169.619 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.9 mt -60.9 -42.23 97.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.774 -1.103 . . . . 0.0 112.462 -170.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -63.02 -25.61 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 CA-C-N 119.016 0.826 . . . . 0.0 112.354 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.448 ' HB1' ' CD2' ' A' ' 43' ' ' HIS . . . -89.2 -26.4 21.26 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.505 0.722 . . . . 0.0 112.867 175.317 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.31 -39.46 94.62 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.278 1.431 . . . . 0.0 112.639 -175.632 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 mt -41.13 -44.36 2.49 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 128.119 2.568 . . . . 0.0 111.809 173.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -112.59 11.63 19.68 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 126.966 2.106 . . . . 0.0 112.251 173.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.29 -4.91 19.94 Favored Glycine 0 N--CA 1.47 0.949 0 C-N-CA 127.61 2.528 . . . . 0.0 114.357 -170.073 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.6 m -40.95 67.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 C-N-CA 127.85 2.46 . . . . 0.0 117.344 166.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 52.0 m -133.25 -61.16 0.83 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.844 1.257 . . . . 0.0 114.168 -178.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -161.69 163.02 20.2 Favored Pre-proline 0 N--CA 1.479 0.993 0 CA-C-N 120.647 1.567 . . . . 0.0 115.143 -177.159 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -57.65 131.33 43.59 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.633 2.222 . . . . 0.0 108.159 168.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.87 1.72 59.69 Favored Glycine 0 CA--C 1.528 0.896 0 CA-C-O 116.993 -2.004 . . . . 0.0 114.928 -176.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -35.96 73.33 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 121.143 2.471 . . . . 0.0 110.766 170.373 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 mt -59.32 -20.9 58.3 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 125.838 1.655 . . . . 0.0 112.071 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.5 -35.09 76.7 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.931 -0.481 . . . . 0.0 111.833 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.71 -45.62 61.26 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.586 0.754 . . . . 0.0 111.18 171.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.448 ' CD2' ' HB1' ' A' ' 29' ' ' ALA . 5.4 m-70 -59.21 -37.39 77.34 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 177.529 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 21.0 mt -99.33 -16.47 18.44 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.441 1.096 . . . . 0.0 113.676 -173.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.68 8.02 71.05 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-N 119.105 0.866 . . . . 0.0 113.803 -170.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.7 mt -110.91 147.75 33.95 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.695 1.198 . . . . 0.0 111.276 -173.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.8 t -58.37 136.77 57.49 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.568 0.699 . . . . 0.0 112.089 -173.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 38.6 ptt180 -57.73 -33.66 68.68 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.428 1.091 . . . . 0.0 112.912 -176.276 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.8 m -61.88 -43.08 99.58 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.606 0.762 . . . . 0.0 111.509 174.231 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -80.08 -39.42 29.7 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 59.9 t -60.33 -38.63 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-N 119.521 1.055 . . . . 0.0 110.773 173.712 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 14.9 m -70.02 -21.11 63.23 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 177.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -57.01 -45.22 83.2 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-O 123.301 1.524 . . . . 0.0 110.806 174.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -69.94 -14.16 62.58 Favored 'General case' 0 CA--C 1.561 1.388 0 C-N-CA 125.857 1.663 . . . . 0.0 114.63 170.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 95.5 mt -81.11 -26.98 35.77 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 120.662 -1.274 . . . . 0.0 112.353 172.176 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.8 t -47.23 -50.89 20.19 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.204 0.911 . . . . 0.0 111.94 -178.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 41.5 t -86.8 -23.29 25.43 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 178.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.515 HD13 ' CD ' ' A' ' 23' ' ' ARG . 5.6 tp -58.49 -39.33 79.7 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 121.031 1.741 . . . . 0.0 111.199 171.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -77.88 -24.93 48.33 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.526 1.53 . . . . 0.0 112.021 176.606 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.55 -52.22 4.27 Favored Glycine 0 CA--C 1.534 1.264 0 C-N-CA 124.951 1.263 . . . . 0.0 113.462 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 17.5 m -64.75 -2.05 2.28 Favored 'General case' 0 CA--C 1.562 1.415 0 C-N-CA 125.903 1.681 . . . . 0.0 113.278 171.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.26 6.67 87.81 Favored Glycine 0 C--N 1.344 1.011 0 C-N-CA 124.987 1.279 . . . . 0.0 114.375 170.026 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.6 mt -66.68 -36.89 83.6 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 118.175 0.988 . . . . 0.0 111.818 -177.505 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.5 m -113.22 135.8 51.59 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.101 0 C-N-CA 125.881 1.672 . . . . 0.0 110.818 170.025 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 46.9 t -116.71 141.84 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 125.614 1.566 . . . . 0.0 108.784 176.041 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.11 142.32 49.16 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.753 0.821 . . . . 0.0 113.063 174.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.0 m -134.21 144.81 48.66 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 169.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -83.54 103.84 13.2 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 118.697 0.68 . . . . 0.0 109.536 168.292 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.269 1.3 pp20? -70.79 -161.11 0.05 OUTLIER 'General case' 0 CA--C 1.558 1.267 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 168.724 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -60.59 -28.32 67.54 Favored Glycine 0 CA--C 1.535 1.31 0 O-C-N 119.695 -1.878 . . . . 0.0 115.801 -169.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.0 tpt85 -158.03 14.5 0.21 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 174.629 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.29 174.0 11.28 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.618 1.567 . . . . 0.0 110.075 -177.801 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 9.1 p -87.49 139.16 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 167.324 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.25 165.41 16.24 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 125.334 1.453 . . . . 0.0 109.002 173.174 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -114.35 152.91 30.71 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 123.116 0.566 . . . . 0.0 109.735 170.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -144.38 143.32 30.88 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 125.777 1.631 . . . . 0.0 109.552 -177.574 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.01 143.28 22.36 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 168.08 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.12 -60.94 2.69 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.589 0.631 . . . . 0.0 112.479 -175.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -146.87 165.66 29.06 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.971 1.367 . . . . 0.0 112.02 -175.606 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -31.91 -36.29 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 130.736 3.614 . . . . 0.0 113.139 166.33 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -48.59 -66.26 0.43 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 127.208 2.203 . . . . 0.0 113.608 172.479 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 10.7 mt -70.24 -31.9 69.52 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 119.434 1.015 . . . . 0.0 110.179 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.49 -40.64 97.62 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.894 0.77 . . . . 0.0 111.123 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -68.99 -55.46 10.81 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 117.664 -1.16 . . . . 0.0 111.585 169.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.93 -31.6 72.72 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 120.64 1.564 . . . . 0.0 113.36 -172.239 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.5 tt -71.8 -54.76 9.17 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.765 0.826 . . . . 0.0 109.307 168.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.39 -24.48 75.01 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 124.708 1.147 . . . . 0.0 115.475 -167.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 -74.33 -25.17 59.38 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 126.713 2.005 . . . . 0.0 111.908 168.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.3 tp 76.73 108.71 0.08 Allowed 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 129.336 3.054 . . . . 0.0 110.553 -178.083 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.721 HG23 HG12 ' A' ' 92' ' ' VAL . 14.8 m -54.17 2.79 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 129.016 2.926 . . . . 0.0 117.099 -176.002 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 74.73 -5.3 2.16 Favored 'General case' 0 C--O 1.218 -0.577 0 O-C-N 120.21 -1.556 . . . . 0.0 113.217 162.307 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.721 HG12 HG23 ' A' ' 90' ' ' VAL . 7.4 p -64.88 43.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 127.951 2.501 . . . . 0.0 113.424 168.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER 59.55 10.34 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.887 0 C-N-CA 128.332 2.653 . . . . 0.0 113.882 174.318 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 18.9 tp 77.47 107.0 0.08 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 127.254 2.222 . . . . 0.0 107.639 -165.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.401 ' CB ' HD12 ' B' ' 11' ' ' LEU . . . -51.4 141.87 14.65 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.834 0.854 . . . . 0.0 112.872 172.534 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.4 m -149.92 165.01 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 127.693 2.397 . . . . 0.0 108.79 -176.403 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -75.2 26.97 0.09 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.707 2.403 . . . . 0.0 114.593 -172.37 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 18.2 p -114.46 44.54 1.7 Allowed 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.581 1.953 . . . . 0.0 109.967 168.129 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 16.4 p30 -68.59 38.93 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 129.232 3.013 . . . . 0.0 113.668 176.515 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.22 135.81 68.57 Favored Pre-proline 0 CA--C 1.556 1.198 0 C-N-CA 125.778 1.631 . . . . 0.0 110.788 172.301 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -75.58 -156.11 0.05 OUTLIER 'Trans proline' 0 CA--C 1.544 0.984 1 C-N-CA 126.155 4.57 . . . . 0.0 115.587 -164.662 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 16.5 t . . . . . 0 CA--C 1.556 1.18 0 C-N-CA 127.825 2.45 . . . . 0.0 114.341 -177.789 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.593 ' HG ' HG11 ' A' ' 92' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.465 0.279 0 CA-C-O 118.148 -0.93 . . . . 0.0 113.496 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.77 -61.08 2.53 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.923 -178.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 7.4 ptp85 -61.31 -33.3 73.35 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.613 1.097 . . . . 0.0 112.889 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.54 -65.87 0.62 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.605 0.762 . . . . 0.0 110.233 174.569 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.57 -28.37 69.53 Favored Glycine 0 C--O 1.22 -0.736 0 CA-C-O 117.288 -1.84 . . . . 0.0 112.395 -169.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.56 -13.03 61.7 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 120.926 2.363 . . . . 0.0 114.343 173.844 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -108.58 -8.29 15.52 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.438 1.495 . . . . 0.0 112.746 170.416 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 18' ' ' LEU . . . . . 0.453 HD12 ' HA ' ' B' ' 18' ' ' LEU . 4.7 tp -93.39 -37.13 12.15 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.848 1.259 . . . . 0.0 110.456 176.139 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.16 37.42 0.44 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 128.335 2.654 . . . . 0.0 115.324 -176.164 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 20' ' ' ASP . . . . . 0.409 ' CG ' ' HE ' ' B' ' 23' ' ' ARG . 0.2 OUTLIER -104.72 165.48 13.2 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 129.141 2.976 . . . . 0.0 112.045 -169.865 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.58 -105.8 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.355 1 C-N-CA 125.975 4.45 . . . . 0.0 111.011 169.377 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -45.89 -36.64 5.52 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 127.194 2.197 . . . . 0.0 113.516 175.529 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.419 ' CD ' HD13 ' B' ' 58' ' ' LEU . 0.0 OUTLIER -66.94 -33.56 75.85 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 -178.377 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 43.8 t -62.2 -49.34 76.17 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.1 0.864 . . . . 0.0 110.109 169.597 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 80.2 mtt-85 -53.26 -46.91 69.41 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.495 1.118 . . . . 0.0 113.119 174.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 3.5 mt -44.57 -63.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 123.975 0.91 . . . . 0.0 110.504 169.512 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.44 -39.46 93.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 117.917 -1.039 . . . . 0.0 113.128 -169.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -64.56 -25.23 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.294 0.952 . . . . 0.0 112.418 176.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 29' ' ' ALA . . . . . 0.431 ' HB1' ' CD2' ' B' ' 43' ' ' HIS . . . -89.59 -27.17 20.4 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 174.852 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.3 -39.6 91.08 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.892 1.277 . . . . 0.0 112.872 -175.231 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -43.79 -45.51 7.32 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 128.709 2.804 . . . . 0.0 112.116 176.873 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -108.76 9.56 26.9 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 127.614 2.365 . . . . 0.0 111.569 175.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.19 -33.53 3.67 Favored Glycine 0 C--O 1.222 -0.626 0 CA-C-O 117.015 -1.992 . . . . 0.0 114.395 -169.18 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 34' ' ' VAL . . . . . 0.515 HG12 ' HA ' ' B' ' 76' ' ' ALA . 34.3 m -10.88 51.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 N-CA-C 121.787 3.995 . . . . 0.0 121.787 170.559 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 35.8 m -119.94 -60.51 1.7 Allowed 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.189 -1.569 . . . . 0.0 112.532 -176.528 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -162.58 165.4 15.37 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 -174.684 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -58.06 128.82 30.26 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 122.564 2.176 . . . . 0.0 107.879 167.303 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.13 2.65 73.21 Favored Glycine 0 CA--C 1.528 0.875 0 CA-C-O 116.912 -2.049 . . . . 0.0 114.895 -176.062 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -39.08 80.58 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 121.44 2.62 . . . . 0.0 110.255 169.662 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 9.7 mt -58.85 -20.86 54.66 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 126.193 1.797 . . . . 0.0 112.561 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.9 -35.56 80.46 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.703 0.401 . . . . 0.0 111.593 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.95 -46.72 64.67 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.243 0.617 . . . . 0.0 111.15 170.457 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 43' ' ' HIS . . . . . 0.431 ' CD2' ' HB1' ' B' ' 29' ' ' ALA . 4.7 m-70 -58.27 -38.59 77.26 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 114.128 1.158 . . . . 0.0 114.128 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 27.8 mt -97.13 -16.55 20.41 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.4 1.08 . . . . 0.0 113.545 -173.574 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.07 5.14 64.81 Favored Glycine 0 CA--C 1.537 1.445 0 CA-C-N 119.249 0.931 . . . . 0.0 113.931 -169.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 96.5 mt -108.33 146.11 33.45 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.926 1.29 . . . . 0.0 111.251 -173.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 10.3 t -57.83 139.16 54.75 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.485 0.66 . . . . 0.0 112.448 -173.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -58.6 -32.19 68.76 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.208 1.003 . . . . 0.0 112.911 -176.258 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 4.1 m -62.26 -44.8 95.72 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.636 0.653 . . . . 0.0 111.862 173.054 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -77.79 -39.99 42.11 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -178.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 61.2 t -60.46 -38.44 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 118.992 0.815 . . . . 0.0 110.695 173.293 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 18.4 m -69.21 -24.2 63.99 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 177.367 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -56.09 -43.95 78.53 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 122.916 1.341 . . . . 0.0 111.232 173.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 -74.11 -17.26 60.96 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 125.11 1.364 . . . . 0.0 114.525 170.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 96.0 mt -76.65 -28.99 56.23 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 120.394 1.452 . . . . 0.0 112.297 169.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 7.6 t -46.67 -56.19 6.53 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.95 0.796 . . . . 0.0 111.901 -179.606 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 52.7 t -78.4 -28.98 47.02 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 118.321 -0.847 . . . . 0.0 113.262 177.457 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 58' ' ' LEU . . . . . 0.419 HD13 ' CD ' ' B' ' 23' ' ' ARG . 6.4 tp -52.2 -41.03 62.34 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 120.84 1.654 . . . . 0.0 111.461 175.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 30.4 mtm180 -81.94 -21.64 37.16 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.283 1.433 . . . . 0.0 112.521 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.71 -39.96 11.4 Favored Glycine 0 N--CA 1.477 1.402 0 C-N-CA 124.969 1.271 . . . . 0.0 113.024 174.174 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 20.9 m -72.12 -11.79 60.91 Favored 'General case' 0 CA--C 1.561 1.371 0 C-N-CA 126.185 1.794 . . . . 0.0 111.883 169.086 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.96 11.8 85.04 Favored Glycine 0 N--CA 1.472 1.085 0 C-N-CA 124.818 1.199 . . . . 0.0 114.593 169.51 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 20.7 mt -67.71 -33.87 75.75 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.991 1.316 . . . . 0.0 111.492 -178.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -112.02 145.43 18.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 C-N-CA 127.865 2.466 . . . . 0.0 110.314 170.19 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.07 143.94 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.902 1.281 . . . . 0.0 110.796 177.514 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.09 136.67 52.62 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.015 0.926 . . . . 0.0 112.293 171.674 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 2.8 m -134.28 144.63 48.45 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 106.02 -1.845 . . . . 0.0 106.02 168.123 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -82.14 103.82 12.03 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.948 0.795 . . . . 0.0 110.13 169.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.27 1.1 pp20? -71.65 -160.49 0.06 Allowed 'General case' 0 CA--C 1.559 1.298 0 CA-C-N 118.249 0.477 . . . . 0.0 111.83 168.642 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -60.48 -27.54 66.03 Favored Glycine 0 CA--C 1.536 1.373 0 O-C-N 119.53 -1.982 . . . . 0.0 115.607 -169.584 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 3.4 tpt85 -157.93 11.44 0.19 Allowed 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 174.514 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.24 176.83 8.68 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.734 1.613 . . . . 0.0 110.724 -177.021 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 7.1 p -90.15 134.45 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 168.014 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.18 161.99 17.67 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.098 1.759 . . . . 0.0 110.184 174.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -117.29 118.71 33.02 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 121.853 -0.529 . . . . 0.0 110.306 175.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 76' ' ' ALA . . . . . 0.515 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -106.3 149.04 27.31 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.674 1.59 . . . . 0.0 110.724 177.17 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 tp -58.23 151.86 18.43 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 166.189 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.14 -66.76 0.47 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.926 0.87 . . . . 0.0 112.923 -174.538 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -142.07 163.4 32.97 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.953 1.359 . . . . 0.0 111.049 -178.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -32.51 -35.2 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 130.681 3.592 . . . . 0.0 113.159 166.587 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -48.54 -69.77 0.11 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.312 2.245 . . . . 0.0 113.56 170.036 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.92 -32.35 74.02 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 120.097 1.317 . . . . 0.0 110.266 179.16 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.08 -41.97 98.73 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.782 0.719 . . . . 0.0 110.896 -177.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 19.0 tpp85 -68.27 -54.17 19.45 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.628 1.171 . . . . 0.0 111.863 171.652 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.02 -33.78 75.0 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 120.325 1.421 . . . . 0.0 113.347 -173.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 4.7 tt -70.12 -54.49 12.76 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.613 0.765 . . . . 0.0 109.522 168.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.68 -25.12 75.88 Favored Glycine 0 CA--C 1.54 1.609 0 C-N-CA 124.982 1.277 . . . . 0.0 115.282 -167.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -70.78 -29.25 65.4 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 126.461 1.904 . . . . 0.0 111.07 167.703 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 20.6 tp 81.46 121.21 0.05 OUTLIER 'General case' 0 C--N 1.341 0.222 0 C-N-CA 130.147 3.379 . . . . 0.0 109.581 -172.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 90' ' ' VAL . . . . . 0.747 HG23 HG12 ' B' ' 92' ' ' VAL . 12.0 m -62.01 3.72 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.242 0 C-N-CA 125.208 1.403 . . . . 0.0 114.739 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 71.75 -9.79 0.92 Allowed 'General case' 0 C--O 1.217 -0.612 0 C-N-CA 125.404 1.482 . . . . 0.0 114.605 165.37 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.747 HG12 HG23 ' B' ' 90' ' ' VAL . 7.9 p -59.39 45.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 C-N-CA 129.35 3.06 . . . . 0.0 115.242 171.184 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.3 t 63.29 5.97 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 128.865 2.866 . . . . 0.0 113.742 173.076 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 18.6 tp 80.66 109.38 0.07 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 127.608 2.363 . . . . 0.0 106.308 -164.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 95' ' ' ALA . . . . . 0.4 ' CB ' HD12 ' A' ' 11' ' ' LEU . . . . . . . . 0 CA--C 1.545 0.76 0 C-N-CA 123.506 0.722 . . . . 0.0 112.863 171.062 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.471 0.596 0 CA-C-O 117.672 -1.156 . . . . 0.0 113.158 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.6 -58.19 7.03 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 120.72 1.6 . . . . 0.0 111.711 176.222 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -54.73 -40.09 68.9 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.076 1.35 . . . . 0.0 112.856 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -75.34 -53.89 7.99 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.823 1.249 . . . . 0.0 111.55 177.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.18 -17.98 70.64 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-O 118.103 -1.387 . . . . 0.0 112.895 -175.392 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.2 mtt-85 -56.92 -19.59 18.68 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 119.844 1.822 . . . . 0.0 113.45 168.003 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.18 -6.53 15.54 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.576 1.151 . . . . 0.0 114.051 169.35 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.6 tp -101.34 -32.11 10.63 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.728 1.149 . . . . 0.0 111.638 -175.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -87.0 65.8 9.13 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 127.503 2.321 . . . . 0.0 111.133 -178.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -138.07 167.73 18.93 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 125.769 1.628 . . . . 0.0 110.541 -174.481 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -66.31 -103.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.553 1.432 1 C-N-CA 125.622 4.215 . . . . 0.0 111.059 169.037 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.0 p -37.56 -45.89 0.79 Allowed 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 128.347 2.659 . . . . 0.0 113.175 169.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.55 ' HG2' HD13 ' A' ' 58' ' ' LEU . 5.1 ttm180 -62.83 -42.45 99.74 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.108 0.867 . . . . 0.0 111.621 -171.579 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 19.5 t -58.27 -53.5 57.6 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 118.324 0.511 . . . . 0.0 110.385 168.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 -53.84 -36.38 62.5 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 178.255 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.457 HG13 ' HA ' ' A' ' 23' ' ' ARG . 1.5 mt -48.75 -58.43 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 CA-C-N 119.593 1.088 . . . . 0.0 109.039 170.616 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 79.0 mt -66.21 -37.45 85.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.435 -171.154 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.442 HG12 HD21 ' A' ' 86' ' ' LEU . 0.9 OUTLIER -69.33 -31.9 51.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 122.719 0.407 . . . . 0.0 111.934 177.513 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.02 -30.47 31.47 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.356 1.062 . . . . 0.0 112.709 177.355 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.42 ' O ' HG13 ' A' ' 34' ' ' VAL . 1.0 OUTLIER -65.47 -35.51 81.13 Favored 'General case' 0 C--O 1.224 -0.243 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 177.911 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.3 mt -46.18 -21.59 0.17 Allowed 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 117.3 -1.333 . . . . 0.0 114.55 169.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -122.38 -35.04 3.18 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 126.392 1.877 . . . . 0.0 113.815 178.18 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.9 -76.54 0.94 Allowed Glycine 0 N--CA 1.475 1.253 0 C-N-CA 127.043 2.259 . . . . 0.0 113.172 -170.181 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.42 HG13 ' O ' ' A' ' 30' ' ' LEU . 1.4 m 45.44 31.29 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 C-N-CA 125.283 1.433 . . . . 0.0 114.82 178.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 32.8 m -88.16 -79.3 0.3 Allowed 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.141 0.976 . . . . 0.0 112.888 -178.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.476 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 2.5 m-85 -140.54 154.86 69.74 Favored Pre-proline 0 N--CA 1.478 0.961 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -168.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -66.41 16.05 0.11 Allowed 'Trans proline' 0 CA--C 1.55 1.322 0 C-N-CA 124.668 3.579 . . . . 0.0 115.068 171.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -124.21 -10.37 5.16 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 125.885 1.707 . . . . 0.0 113.688 168.003 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.476 ' HG2' ' H ' ' A' ' 36' ' ' TYR . 0.0 OUTLIER -71.59 -39.75 70.33 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.695 1.747 . . . . 0.0 111.115 -174.301 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.7 mt -57.18 -19.2 19.21 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 123.925 0.89 . . . . 0.0 112.915 173.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.19 -30.99 71.94 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 120.019 1.281 . . . . 0.0 112.036 -179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.81 -49.96 11.22 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.565 0.746 . . . . 0.0 111.304 173.114 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -53.89 -31.11 48.79 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.409 HD11 HG12 ' A' ' 26' ' ' ILE . 60.0 mt -102.52 -7.6 21.74 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.848 1.659 . . . . 0.0 112.995 -177.432 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.27 0.72 8.17 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.272 1.415 . . . . 0.0 114.069 -173.245 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.5 mp -110.76 144.21 40.08 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 124.334 1.054 . . . . 0.0 111.864 -169.315 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.9 t -59.42 149.22 29.99 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 121.932 0.873 . . . . 0.0 111.205 177.501 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -63.42 -16.24 59.96 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.966 1.098 . . . . 0.0 113.966 -170.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.8 p -71.34 -48.3 51.18 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.065 1.302 . . . . 0.0 112.043 168.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -60.67 -43.1 98.06 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.219 0.918 . . . . 0.0 111.48 172.11 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 69.6 t -62.84 -40.95 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 O-C-N 121.827 -0.546 . . . . 0.0 111.34 176.289 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 73.8 m -62.14 -36.93 83.3 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 178.64 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -56.39 -41.54 76.45 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.138 0.575 . . . . 0.0 111.778 172.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -73.66 -35.23 65.22 Favored 'General case' 0 CA--C 1.558 1.288 0 O-C-N 121.264 -0.897 . . . . 0.0 112.805 174.202 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.1 mt -69.88 -37.02 75.91 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 120.607 1.549 . . . . 0.0 114.127 176.301 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 38.9 m -54.61 -39.72 68.17 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.926 1.239 . . . . 0.0 113.094 -177.383 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 9.0 t -67.63 -43.53 80.16 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 118.578 0.626 . . . . 0.0 112.021 175.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.55 HD13 ' HG2' ' A' ' 23' ' ' ARG . 3.3 tp -61.96 -37.33 84.35 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 127.94 2.496 . . . . 0.0 112.823 -175.706 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.0 mtm105 -82.35 2.45 32.25 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.34 1.856 . . . . 0.0 112.721 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -112.63 -45.16 0.79 Allowed Glycine 0 N--CA 1.475 1.241 0 C-N-CA 126.582 2.039 . . . . 0.0 112.352 173.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 98.6 m -66.01 3.31 0.86 Allowed 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 127.2 2.2 . . . . 0.0 113.751 171.462 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 58.21 35.89 79.99 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 125.625 1.583 . . . . 0.0 113.687 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.6 mt -86.56 -29.07 22.92 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.563 1.145 . . . . 0.0 112.698 173.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.1 m -140.17 143.84 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 125.39 1.476 . . . . 0.0 112.115 -175.597 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.4 t -131.12 142.81 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 125.98 1.712 . . . . 0.0 110.236 -174.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.08 158.35 35.88 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.475 1.91 . . . . 0.0 113.961 176.596 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.3 m -156.67 174.71 15.05 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 168.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -111.07 119.34 38.7 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.481 0.712 . . . . 0.0 110.519 169.428 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -77.42 -157.32 0.09 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.248 0.619 . . . . 0.0 110.767 167.326 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.86 -24.9 68.74 Favored Glycine 0 CA--C 1.537 1.465 0 O-C-N 119.479 -2.013 . . . . 0.0 115.819 -171.578 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -157.18 2.0 0.12 Allowed 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.298 1.549 . . . . 0.0 114.861 172.247 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -125.39 164.23 20.87 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 126.017 1.727 . . . . 0.0 109.584 -179.212 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 30.7 m -79.21 150.75 5.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 166.238 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -125.57 179.86 4.95 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.411 1.485 . . . . 0.0 110.205 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.412 ' O ' HG12 ' A' ' 34' ' ' VAL . 35.4 m-85 -142.87 132.06 23.24 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 124.443 1.097 . . . . 0.0 110.849 174.392 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.78 162.01 29.42 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.793 2.037 . . . . 0.0 110.079 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.0 mp -57.47 149.52 20.77 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 119.026 0.83 . . . . 0.0 110.293 169.476 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.5 -21.03 66.18 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 114.684 1.364 . . . . 0.0 114.684 -172.815 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -170.92 173.44 5.16 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 122.416 1.103 . . . . 0.0 113.223 168.504 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 52.9 p -40.5 -31.3 0.14 Allowed 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 128.958 2.903 . . . . 0.0 112.284 165.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -44.16 -76.27 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 127.379 2.272 . . . . 0.0 112.762 168.047 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.665 ' H ' HD22 ' A' ' 82' ' ' LEU . 0.0 OUTLIER -71.17 -28.69 64.43 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -171.635 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.5 -45.51 93.9 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.125 0.97 . . . . 0.0 111.586 177.025 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . 0.281 3.1 ppt_? -72.66 -46.12 55.51 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.618 177.112 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.09 -42.51 90.64 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 179.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.442 HD21 HG12 ' A' ' 28' ' ' VAL . 3.1 tt -73.54 -43.46 59.87 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.534 -0.729 . . . . 0.0 110.408 175.173 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.88 -35.92 57.94 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.261 0.934 . . . . 0.0 113.753 -172.227 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -78.21 -3.56 43.29 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.858 1.263 . . . . 0.0 112.353 169.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 54.8 tp 67.48 107.73 0.04 OUTLIER 'General case' 0 C--N 1.342 0.275 0 C-N-CA 129.028 2.931 . . . . 0.0 111.579 169.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.7 m -66.59 23.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 125.999 1.72 . . . . 0.0 114.424 178.711 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.406 ' C ' ' H ' ' A' ' 93' ' ' VAL . 28.1 mm-40 83.07 -13.93 0.77 Allowed 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.399 -1.438 . . . . 0.0 112.116 152.338 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 14.4 p -54.77 32.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.525 1 C-N-CA 133.166 4.587 . . . . 0.0 116.475 169.007 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.406 ' H ' ' C ' ' A' ' 91' ' ' GLN . 2.1 t 58.48 31.32 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 128.193 2.597 . . . . 0.0 111.533 168.647 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 79.37 113.87 0.07 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 127.589 2.356 . . . . 0.0 105.715 -165.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.51 64.68 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 127.201 2.2 . . . . 0.0 114.803 -179.023 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -51.57 161.16 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 127.631 2.372 . . . . 0.0 113.008 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.03 16.67 7.93 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 128.542 2.737 . . . . 0.0 114.422 -172.485 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 10.2 p -86.98 150.19 24.24 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.229 1.411 . . . . 0.0 112.402 176.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -140.7 139.99 34.83 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.904 1.682 . . . . 0.0 110.623 176.236 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -163.05 158.61 18.4 Favored Pre-proline 0 CA--C 1.541 0.609 0 O-C-N 120.32 -1.488 . . . . 0.0 111.727 -166.515 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -73.6 174.66 11.86 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 122.478 2.118 . . . . 0.0 108.275 165.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 48.9 t . . . . . 0 CA--C 1.543 0.692 0 CA-C-O 123.182 1.468 . . . . 0.0 114.033 -171.731 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.467 0.39 0 CA-C-O 117.479 -1.248 . . . . 0.0 113.437 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.24 -57.73 9.5 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.858 1.663 . . . . 0.0 111.425 174.326 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 13.9 mtp85 -54.46 -38.96 66.97 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.173 1.389 . . . . 0.0 112.398 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -76.22 -54.01 7.42 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.319 1.448 . . . . 0.0 112.497 177.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -73.42 -14.75 79.24 Favored Glycine 0 CA--C 1.53 1.009 0 CA-C-O 117.907 -1.496 . . . . 0.0 112.704 -174.235 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 62.1 mtt-85 -57.9 -12.79 3.5 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 119.947 1.873 . . . . 0.0 113.658 168.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -122.41 -1.44 9.12 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.026 1.73 . . . . 0.0 113.978 170.179 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 3.9 tp -106.91 -30.3 8.95 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.615 1.098 . . . . 0.0 111.566 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.22 66.61 9.81 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.405 2.282 . . . . 0.0 110.331 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 20' ' ' ASP . . . . . 0.484 ' CB ' ' HB3' ' B' ' 23' ' ' ARG . 0.3 OUTLIER -138.61 162.93 50.34 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 125.724 1.61 . . . . 0.0 111.343 -171.851 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -69.65 -100.54 0.01 OUTLIER 'Trans proline' 0 CA--C 1.551 1.337 0 C-N-CA 125.184 3.922 . . . . 0.0 109.584 169.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 22.7 p -36.74 -46.4 0.6 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 129.028 2.931 . . . . 0.0 113.458 168.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.484 ' HB3' ' CB ' ' B' ' 20' ' ' ASP . 7.4 ttm180 -70.9 -37.06 72.95 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.582 1.083 . . . . 0.0 112.947 -171.109 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 12.1 t -60.03 -52.47 65.24 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.853 0.835 . . . . 0.0 109.254 167.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 3.9 mmt85 -55.65 -36.75 67.39 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 177.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 26' ' ' ILE . . . . . 0.608 HG12 HD11 ' B' ' 44' ' ' LEU . 1.7 mt -49.9 -60.1 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 CA-C-N 119.756 1.162 . . . . 0.0 108.945 171.325 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 87.9 mt -63.78 -38.8 92.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 118.144 -0.932 . . . . 0.0 111.748 -173.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 28' ' ' VAL . . . . . 0.475 HG12 HD21 ' B' ' 86' ' ' LEU . 1.0 OUTLIER -68.93 -33.72 60.54 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-N 119.149 0.886 . . . . 0.0 111.881 177.659 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.44 -23.99 27.64 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.664 0.786 . . . . 0.0 113.028 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.406 ' O ' HG13 ' B' ' 34' ' ' VAL . 0.9 OUTLIER -63.06 -45.05 94.02 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 117.749 -1.12 . . . . 0.0 112.27 171.819 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -42.61 -43.16 3.68 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.719 2.408 . . . . 0.0 113.573 -174.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -100.47 -31.85 11.09 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.104 1.762 . . . . 0.0 112.67 177.389 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.04 -61.03 2.17 Favored Glycine 0 C--N 1.343 0.937 0 C-N-CA 124.542 1.068 . . . . 0.0 113.933 -171.012 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 34' ' ' VAL . . . . . 0.46 HG12 ' O ' ' B' ' 75' ' ' TYR . 0.2 OUTLIER 30.91 46.59 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 C-N-CA 127.598 2.359 . . . . 0.0 115.192 178.974 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 3.3 m -107.73 -67.91 0.93 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.665 1.586 . . . . 0.0 112.777 -176.185 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -143.17 152.77 58.77 Favored Pre-proline 0 N--CA 1.476 0.839 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -167.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -68.27 8.93 0.44 Allowed 'Trans proline' 0 CA--C 1.55 1.289 0 C-N-CA 124.689 3.593 . . . . 0.0 113.764 168.247 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -122.43 -10.18 6.17 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 125.811 1.672 . . . . 0.0 113.754 168.286 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.51 -40.11 80.98 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 119.717 1.758 . . . . 0.0 110.331 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 47.7 mt -63.14 -11.34 19.64 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 124.05 0.94 . . . . 0.0 112.355 -179.135 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -73.2 -33.69 65.53 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 119.743 -0.783 . . . . 0.0 111.003 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.56 -53.46 10.48 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.173 0.989 . . . . 0.0 110.34 169.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -52.62 -30.86 33.69 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 -178.615 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.678 HD12 HG22 ' B' ' 51' ' ' VAL . 65.5 mt -102.4 -18.78 15.22 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.319 1.447 . . . . 0.0 113.349 -178.024 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.51 -1.54 56.92 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.555 1.074 . . . . 0.0 113.854 -170.314 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 8.5 mp -110.95 146.94 35.71 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 119.222 1.511 . . . . 0.0 112.313 -174.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 8.9 t -56.37 150.52 14.68 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 122.291 1.043 . . . . 0.0 112.383 176.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -63.98 -14.18 52.05 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -171.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 13.5 p -72.66 -44.01 62.39 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 120.144 1.338 . . . . 0.0 112.235 169.316 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -61.27 -44.7 96.8 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.673 0.669 . . . . 0.0 111.506 170.408 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 51' ' ' VAL . . . . . 0.678 HG22 HD12 ' B' ' 44' ' ' LEU . 52.6 t -57.73 -47.54 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.831 174.138 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 75.5 m -59.53 -40.3 86.72 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.86 0.864 . . . . 0.0 113.155 -177.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -54.32 -46.26 72.81 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.921 0.888 . . . . 0.0 112.086 171.377 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -73.67 -28.22 61.64 Favored 'General case' 0 CA--C 1.558 1.27 0 O-C-N 121.141 -0.974 . . . . 0.0 112.682 176.567 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 45.3 mt -73.66 -33.98 64.72 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 120.864 1.665 . . . . 0.0 113.613 174.518 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 33.6 m -52.78 -40.67 63.39 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.447 1.022 . . . . 0.0 113.461 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.2 t -70.16 -39.64 75.22 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.208 0.913 . . . . 0.0 112.329 177.285 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 2.3 tp -60.95 -47.47 86.27 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 128.071 2.548 . . . . 0.0 111.688 -174.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 33.1 mtm105 -80.17 4.75 16.42 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.827 1.651 . . . . 0.0 112.214 177.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -106.22 -47.62 1.06 Allowed Glycine 0 CA--C 1.532 1.112 0 C-N-CA 125.958 1.742 . . . . 0.0 112.02 169.766 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 92.8 m -76.56 13.74 0.92 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 126.514 1.925 . . . . 0.0 114.431 177.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.03 29.06 69.92 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 125.731 1.634 . . . . 0.0 114.418 174.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 24.9 mt -80.78 -26.49 37.17 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.377 -1.072 . . . . 0.0 112.943 176.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.5 m -147.17 152.3 13.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 126.152 1.781 . . . . 0.0 112.572 -171.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -130.13 158.12 42.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.783 1.633 . . . . 0.0 111.187 173.778 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.53 161.08 30.1 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.04 1.336 . . . . 0.0 112.267 167.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.401 HG22 ' H ' ' B' ' 68' ' ' TYR . 1.1 m -156.56 176.71 12.35 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.583 1.553 . . . . 0.0 107.046 168.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.401 ' H ' HG22 ' B' ' 67' ' ' THR . 38.6 t80 -117.52 118.88 33.36 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.928 0.891 . . . . 0.0 111.344 172.544 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.25 1.2 pp20? -77.32 -151.96 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.457 0.703 . . . . 0.0 111.233 167.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -66.98 -24.79 73.2 Favored Glycine 0 CA--C 1.54 1.594 0 O-C-N 119.572 -1.955 . . . . 0.0 116.035 -173.186 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 5.4 ttp85 -158.71 0.32 0.09 Allowed 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 119.263 1.532 . . . . 0.0 114.528 174.691 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -124.98 162.93 23.43 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 126.11 1.764 . . . . 0.0 109.327 -178.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 20.8 m -80.29 152.44 4.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 O-C-N 121.709 -0.619 . . . . 0.0 109.415 165.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 8.0 ptt180 -124.62 172.47 9.22 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.263 1.425 . . . . 0.0 110.331 174.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.46 ' O ' HG12 ' B' ' 34' ' ' VAL . 28.3 m-85 -120.7 143.79 48.56 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.321 1.048 . . . . 0.0 110.027 167.685 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -142.02 149.45 40.0 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.566 1.546 . . . . 0.0 110.566 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 6.1 mp -52.93 146.78 10.25 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 119.216 0.916 . . . . 0.0 109.138 169.185 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.17 -16.22 63.27 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -172.1 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -169.91 172.4 6.63 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 123.055 1.407 . . . . 0.0 112.51 171.543 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 86.4 p -49.73 -26.13 3.55 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.408 2.283 . . . . 0.0 111.282 163.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 8.5 t60 -60.26 -58.06 10.11 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 128.298 2.639 . . . . 0.0 112.032 179.739 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.11 -33.15 71.49 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 120.579 1.536 . . . . 0.0 110.25 174.636 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.13 -37.41 82.74 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.949 0.9 . . . . 0.0 112.318 -176.7 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.26 -44.02 63.45 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-O 117.506 -1.235 . . . . 0.0 111.683 174.589 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.09 -43.72 95.32 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 120.017 1.281 . . . . 0.0 113.518 177.644 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.475 HD21 HG12 ' B' ' 28' ' ' VAL . 5.0 tt -67.02 -49.78 64.18 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.084 0.954 . . . . 0.0 110.312 174.059 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.81 -33.04 47.78 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.84 1.21 . . . . 0.0 114.623 -167.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -74.11 -10.96 60.14 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 118.958 1.379 . . . . 0.0 112.201 169.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 57.9 tp 69.66 110.3 0.05 Allowed 'General case' 0 C--O 1.235 0.303 0 C-N-CA 129.59 3.156 . . . . 0.0 110.939 171.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 21.0 m -66.32 23.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 C-N-CA 126.295 1.838 . . . . 0.0 114.286 177.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 91' ' ' GLN . . . . . 0.426 ' C ' ' H ' ' B' ' 93' ' ' VAL . 24.6 mm-40 78.22 -9.63 1.48 Allowed 'General case' 0 C--N 1.327 -0.402 0 O-C-N 120.43 -1.419 . . . . 0.0 113.166 156.323 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 11.2 p -54.22 26.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.25 1 C-N-CA 132.226 4.21 . . . . 0.0 115.993 167.741 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 93' ' ' VAL . . . . . 0.426 ' H ' ' C ' ' B' ' 91' ' ' GLN . 1.8 t 60.29 31.71 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 127.044 2.138 . . . . 0.0 111.589 167.52 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 80.86 112.33 0.07 Allowed 'General case' 0 C--N 1.347 0.485 0 C-N-CA 127.697 2.399 . . . . 0.0 106.338 -167.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.554 1.105 0 C-N-CA 128.38 2.672 . . . . 0.0 114.861 176.422 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 C--O 1.223 -0.313 0 CA-C-O 117.287 -1.34 . . . . 0.0 113.568 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.72 -37.99 63.87 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 121.611 2.005 . . . . 0.0 113.663 -172.318 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.551 HH21 ' HB3' ' A' ' 61' ' ' CYS . 0.0 OUTLIER -53.68 -23.26 10.87 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.645 0.979 . . . . 0.0 113.645 177.599 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.416 ' HG ' HG23 ' B' ' 92' ' ' VAL . 3.1 tm? -56.14 -41.82 75.96 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.29 1.836 . . . . 0.0 111.92 174.409 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.38 -35.8 92.54 Favored Glycine 0 CA--C 1.53 0.993 0 CA-C-N 120.388 1.449 . . . . 0.0 112.114 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.66 -45.71 61.17 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.803 0.841 . . . . 0.0 110.986 170.196 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.92 -24.17 67.63 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.728 1.149 . . . . 0.0 112.862 -178.435 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.7 mp -82.26 -28.39 31.85 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.014 0.825 . . . . 0.0 112.712 169.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -87.91 67.23 8.98 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.559 1.944 . . . . 0.0 112.831 173.018 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.536 ' HB3' HH11 ' A' ' 23' ' ' ARG . 31.3 t70 -143.55 135.86 13.33 Favored Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 128.241 2.616 . . . . 0.0 107.353 -176.615 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -52.68 -102.74 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.902 1 C-N-CA 127.26 5.307 . . . . 0.0 116.722 -163.677 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.4 m -56.0 -30.72 62.25 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.573 1.149 . . . . 0.0 110.511 -177.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.607 HH21 HD12 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -50.33 -42.08 52.26 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 172.717 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 36.8 t -58.7 -43.48 90.07 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.314 -0.866 . . . . 0.0 111.346 175.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.5 tpt180 -63.67 -29.47 70.7 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 118.051 -0.976 . . . . 0.0 112.118 174.009 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.491 HG13 ' HA ' ' A' ' 23' ' ' ARG . 1.6 mt -62.56 -53.57 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 120.756 1.616 . . . . 0.0 110.999 167.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.607 HD12 HH21 ' A' ' 23' ' ' ARG . 8.5 mt -60.17 -39.47 86.54 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 117.704 -1.141 . . . . 0.0 112.608 -177.263 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -68.73 -27.35 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 CA-C-N 120.292 1.406 . . . . 0.0 112.825 175.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.432 ' HB1' ' CD2' ' A' ' 43' ' ' HIS . . . -82.25 1.5 36.36 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 126.167 1.787 . . . . 0.0 114.222 169.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.64 -20.0 14.59 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 120.651 -1.281 . . . . 0.0 111.853 168.833 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.2 mt -66.79 -44.64 80.75 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.375 1.47 . . . . 0.0 109.218 165.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -132.49 95.94 3.73 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.666 1.986 . . . . 0.0 110.99 168.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -179.22 -83.48 0.06 OUTLIER Glycine 0 N--CA 1.468 0.769 0 C-N-CA 125.999 1.761 . . . . 0.0 110.592 171.085 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 19.5 m 43.06 25.37 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 116.881 2.178 . . . . 0.0 116.881 171.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 99.1 m -83.61 -76.48 0.29 Allowed 'General case' 0 C--O 1.223 -0.307 0 O-C-N 121.047 -1.033 . . . . 0.0 109.919 178.099 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.417 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 0.2 OUTLIER -139.38 159.71 64.84 Favored Pre-proline 0 CA--C 1.54 0.578 0 CA-C-O 118.549 -0.739 . . . . 0.0 112.902 -170.532 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -57.27 -18.8 31.81 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.183 2.588 . . . . 0.0 114.819 175.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -97.18 -6.48 57.74 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 118.175 -1.347 . . . . 0.0 115.766 172.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.417 ' HG2' ' H ' ' A' ' 36' ' ' TYR . 0.0 OUTLIER -70.37 -28.7 65.31 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.43 2.115 . . . . 0.0 113.143 -170.429 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 23.4 mt -63.75 -18.67 64.29 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 123.839 0.856 . . . . 0.0 111.717 178.576 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.24 -45.03 68.58 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.273 0.629 . . . . 0.0 111.496 177.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.46 -41.02 69.92 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.786 0.834 . . . . 0.0 112.151 176.851 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.432 ' CD2' ' HB1' ' A' ' 29' ' ' ALA . 14.0 m-70 -64.04 -21.37 66.48 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.903 1.446 . . . . 0.0 114.903 176.31 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 86.8 mt -115.32 -15.59 11.56 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.803 1.641 . . . . 0.0 114.029 -172.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.7 4.14 57.0 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.021 0.82 . . . . 0.0 113.405 -170.292 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 71.9 mt -102.31 172.86 6.64 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.814 1.246 . . . . 0.0 111.286 -176.405 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.1 p -86.27 158.34 19.72 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.503 -0.748 . . . . 0.0 110.065 175.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -61.92 -21.33 64.66 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 174.576 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.0 p -73.52 -52.58 13.05 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.078 -1.013 . . . . 0.0 109.712 168.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -69.77 -30.05 67.53 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.009 0.924 . . . . 0.0 112.505 -173.557 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 80.0 t -67.25 -30.26 48.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 O-C-N 120.681 -1.262 . . . . 0.0 111.769 167.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 74.3 m -70.52 -16.11 62.85 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.607 -1.308 . . . . 0.0 114.091 -175.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -54.2 -58.95 5.44 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.761 0.824 . . . . 0.0 110.635 169.556 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -77.02 -14.81 59.79 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-O 117.837 -1.078 . . . . 0.0 113.78 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 92.9 mt -70.81 -26.99 63.56 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 121.241 1.837 . . . . 0.0 111.668 169.066 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 65.1 p -59.26 -47.32 85.79 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 -175.295 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.9 t -72.97 -38.12 66.83 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.766 0.712 . . . . 0.0 111.829 172.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.5 tp -51.1 -48.86 61.58 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.202 1.001 . . . . 0.0 112.397 176.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.478 ' HG2' HG23 ' A' ' 64' ' ' VAL . 43.8 mtm180 -88.96 -5.54 57.89 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.627 1.571 . . . . 0.0 113.56 -176.779 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -100.9 -41.48 2.65 Favored Glycine 0 N--CA 1.474 1.2 0 C-N-CA 125.538 1.542 . . . . 0.0 112.811 175.63 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.551 ' HB3' HH21 ' A' ' 13' ' ' ARG . 3.8 m -77.44 8.73 3.87 Favored 'General case' 0 CA--C 1.552 1.051 0 O-C-N 120.832 -1.393 . . . . 0.0 113.297 169.729 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 58.41 34.65 75.92 Favored Glycine 0 CA--C 1.533 1.191 0 O-C-N 120.904 -1.123 . . . . 0.0 114.045 176.394 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 26.2 mt -82.38 -25.88 33.38 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.275 1.538 . . . . 0.0 111.989 171.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.478 HG23 ' HG2' ' A' ' 59' ' ' ARG . 2.5 m -133.98 149.3 30.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 127.34 2.256 . . . . 0.0 109.366 176.257 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.6 t -129.08 135.82 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 C-N-CA 124.995 1.318 . . . . 0.0 109.883 -176.534 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.72 148.23 44.87 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.671 1.189 . . . . 0.0 112.863 171.27 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 34.2 m -160.0 162.77 34.37 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.498 1.919 . . . . 0.0 106.584 -178.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -87.65 138.74 31.2 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.136 1.334 . . . . 0.0 110.917 169.072 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.98 -20.2 39.01 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 118.318 0.508 . . . . 0.0 112.239 169.515 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 139.76 -47.31 0.9 Allowed Glycine 0 CA--C 1.528 0.906 0 C-N-CA 126.009 1.766 . . . . 0.0 112.237 175.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 19.8 ttp180 -101.0 -29.67 12.05 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.562 1.945 . . . . 0.0 112.027 171.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.13 171.21 13.93 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.662 1.985 . . . . 0.0 110.913 -170.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 13.0 p -87.35 144.46 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 124.011 0.924 . . . . 0.0 109.438 169.376 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -128.8 174.22 9.66 Favored 'General case' 0 CA--C 1.522 -0.126 0 C-N-CA 126.244 1.818 . . . . 0.0 109.718 178.615 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -117.23 170.85 8.36 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.373 1.069 . . . . 0.0 109.08 166.511 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -164.97 154.97 13.5 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.46 1.904 . . . . 0.0 109.246 177.39 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 tp -56.71 142.44 40.22 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.315 0.961 . . . . 0.0 111.683 171.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -83.39 11.34 6.97 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 116.224 1.935 . . . . 0.0 116.224 -169.178 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.2 t0 165.65 144.87 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 128.69 2.796 . . . . 0.0 110.874 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 83.8 p -45.67 -29.87 1.39 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.924 2.089 . . . . 0.0 114.074 167.111 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -61.93 -49.74 74.93 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 124.062 0.945 . . . . 0.0 112.744 174.799 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 54.0 mt -60.85 -42.71 98.36 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 176.142 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.97 -34.08 65.38 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.617 1.167 . . . . 0.0 112.014 -174.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.7 mtt-85 -71.79 -60.68 2.11 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.417 1.087 . . . . 0.0 113.212 177.34 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.45 -34.6 75.69 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 120.309 1.413 . . . . 0.0 112.543 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 70.0 tp -62.46 -49.73 74.28 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.659 1.584 . . . . 0.0 110.795 169.032 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -67.93 -39.82 89.23 Favored Glycine 0 N--CA 1.475 1.239 0 C-N-CA 126.616 2.055 . . . . 0.0 113.926 -176.233 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 51.9 tp10 -64.79 -8.23 14.21 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 127.763 2.425 . . . . 0.0 112.713 168.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.3 tp 67.69 36.38 3.64 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 128.721 2.808 . . . . 0.0 110.6 169.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 3.8 m 48.63 -18.05 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 131.483 3.913 . . . . 0.0 117.366 -168.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 56.2 mm-40 69.94 -7.39 0.94 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 128.271 2.628 . . . . 0.0 114.076 -174.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.439 HG13 ' H ' ' A' ' 92' ' ' VAL . 0.7 OUTLIER -66.61 -10.38 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 C-N-CA 126.39 1.876 . . . . 0.0 114.467 170.813 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 79.5 42.57 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.043 0 C-N-CA 129.937 3.295 . . . . 0.0 113.158 168.071 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 tt 78.09 95.85 0.06 Allowed 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 123.614 1.673 . . . . 0.0 109.09 -168.202 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -49.55 70.72 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 128.355 2.662 . . . . 0.0 116.336 169.586 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 94.1 t -58.73 130.97 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 N-CA-C 106.09 -1.818 . . . . 0.0 106.09 165.212 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.598 ' HA ' ' HB3' ' B' ' 12' ' ' ALA . 29.0 t70 -60.93 -80.3 0.03 OUTLIER 'General case' 0 C--O 1.235 0.33 0 O-C-N 123.905 0.753 . . . . 0.0 112.294 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 5.7 p 66.24 132.59 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 128.785 2.834 . . . . 0.0 108.777 -169.199 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -84.92 83.67 7.97 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 120.974 1.715 . . . . 0.0 110.011 178.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.52 151.23 76.94 Favored Pre-proline 0 CA--C 1.551 1.007 0 CA-C-N 114.042 -1.435 . . . . 0.0 109.717 177.188 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -86.17 -102.39 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 124.083 3.189 . . . . 0.0 108.196 174.343 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 34.9 t . . . . . 0 N--CA 1.447 -0.598 0 CA-C-O 123.438 1.589 . . . . 0.0 109.784 165.205 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? . . . . . 0 CA--C 1.543 0.677 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.598 ' HB3' ' HA ' ' A' ' 97' ' ' ASP . . . -82.22 -39.82 22.54 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 121.016 1.734 . . . . 0.0 111.154 166.481 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -59.07 -21.37 59.06 Favored 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 124.583 1.153 . . . . 0.0 111.518 176.259 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -47.78 -47.07 30.87 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.976 2.511 . . . . 0.0 111.668 165.796 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.07 -15.0 69.1 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-O 119.139 -0.812 . . . . 0.0 112.557 -175.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.39 -56.25 4.59 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 166.303 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.24 -27.81 68.72 Favored 'General case' 0 CA--C 1.549 0.914 0 N-CA-C 115.583 1.698 . . . . 0.0 115.583 -173.13 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 5.8 mp -84.19 -20.05 33.01 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 119.284 0.947 . . . . 0.0 113.458 171.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.6 51.88 1.95 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.092 1.357 . . . . 0.0 110.995 169.056 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -117.21 146.85 39.14 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 127.511 2.325 . . . . 0.0 107.808 176.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -59.78 -94.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.929 1 C-N-CA 126.248 4.632 . . . . 0.0 113.663 -168.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.3 m -58.54 -24.23 60.17 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 120.773 -1.204 . . . . 0.0 111.213 175.495 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.465 ' HD3' ' CD1' ' B' ' 58' ' ' LEU . 13.1 ttm-85 -70.72 -41.22 72.18 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 113.977 1.102 . . . . 0.0 113.977 -178.538 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 38.1 t -56.02 -42.62 76.76 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.84 1.2 . . . . 0.0 109.449 169.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -64.66 -33.87 76.95 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 116.936 -1.507 . . . . 0.0 113.179 174.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.5 mt -56.8 -62.75 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 CA-C-N 121.317 1.871 . . . . 0.0 108.419 168.286 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 41.2 mt -54.88 -43.13 72.9 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.155 -0.926 . . . . 0.0 112.204 -170.465 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.9 p -74.59 -19.49 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-N 119.535 1.061 . . . . 0.0 113.197 -178.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.57 -27.46 21.36 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.486 1.515 . . . . 0.0 112.629 172.434 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.82 -47.02 83.83 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 125.5 1.52 . . . . 0.0 109.523 170.43 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.36 -61.11 1.8 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 129.946 3.298 . . . . 0.0 112.252 179.342 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 32' ' ' ASP . . . . . 0.441 ' O ' ' HE1' ' B' ' 43' ' ' HIS . 26.1 t0 -95.53 34.73 1.43 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.929 2.492 . . . . 0.0 110.395 174.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -128.92 -80.75 0.27 Allowed Glycine 0 C--N 1.337 0.613 0 C-N-CA 125.281 1.42 . . . . 0.0 113.532 -173.183 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 27.5 m 27.79 24.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 N-CA-C 119.651 3.204 . . . . 0.0 119.651 -174.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 76.1 m -83.7 -67.28 0.8 Allowed 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 121.331 1.878 . . . . 0.0 112.138 -178.197 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -147.15 162.57 32.24 Favored Pre-proline 0 CA--C 1.54 0.566 0 CA-C-O 117.919 -1.039 . . . . 0.0 111.231 -173.356 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -55.65 -27.5 61.12 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 122.7 2.267 . . . . 0.0 112.983 169.28 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -83.83 -3.9 89.08 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 117.432 -1.76 . . . . 0.0 115.521 175.011 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.62 -36.92 57.14 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.953 2.376 . . . . 0.0 112.856 -172.419 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 14.7 mt -62.45 -22.31 66.11 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 123.431 0.693 . . . . 0.0 111.458 -179.459 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.87 -38.34 64.63 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.553 0.741 . . . . 0.0 111.904 176.373 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -52.61 13.38 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.618 0.767 . . . . 0.0 111.198 176.105 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 43' ' ' HIS . . . . . 0.441 ' HE1' ' O ' ' B' ' 32' ' ' ASP . 24.9 m170 -57.41 -24.16 53.77 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 65.9 mt -108.44 -11.23 15.19 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.603 1.561 . . . . 0.0 113.245 -176.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.36 8.04 42.66 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.292 0.948 . . . . 0.0 113.803 -170.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 53.4 mt -103.81 164.56 11.6 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.773 1.229 . . . . 0.0 112.066 -171.169 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 68.0 p -70.58 146.42 50.1 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.286 -0.884 . . . . 0.0 109.992 174.635 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 39.8 ptt180 -60.75 -17.07 46.45 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 172.651 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 47.6 p -73.6 -61.03 1.98 Allowed 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 166.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -66.57 -25.26 66.55 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.425 1.011 . . . . 0.0 113.124 -170.09 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 74.7 t -68.95 -31.11 49.2 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 CA-C-N 118.687 0.676 . . . . 0.0 111.896 169.094 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 75.8 m -61.28 -30.3 70.39 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.989 -1.069 . . . . 0.0 112.351 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -57.0 -13.68 2.94 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 128.053 2.541 . . . . 0.0 114.717 173.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -119.23 -8.01 10.19 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 120.325 -1.484 . . . . 0.0 114.411 170.593 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 71.4 mt -81.13 -25.06 37.21 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.067 0.947 . . . . 0.0 111.542 168.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 4.4 p -55.63 -49.63 72.33 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 57' ' ' CYS . . . . . 0.425 ' HB3' ' NH1' ' B' ' 23' ' ' ARG . 7.3 t -72.76 -35.32 67.45 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.765 1.166 . . . . 0.0 111.889 176.301 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 58' ' ' LEU . . . . . 0.465 ' CD1' ' HD3' ' B' ' 23' ' ' ARG . 1.4 tp -56.91 -52.61 64.47 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.261 2.224 . . . . 0.0 111.726 -176.258 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 28.7 mtm105 -84.4 14.48 4.42 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.747 1.619 . . . . 0.0 111.863 178.178 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -110.17 -50.48 0.67 Allowed Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.712 1.149 . . . . 0.0 111.231 169.174 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 81.1 m -73.47 3.93 5.46 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 125.99 1.716 . . . . 0.0 113.748 -178.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.56 24.17 70.86 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 118.759 -1.023 . . . . 0.0 113.57 -176.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 63.3 mt -73.46 -21.57 60.4 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.545 1.672 . . . . 0.0 112.522 170.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -145.31 154.5 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 126.982 2.113 . . . . 0.0 110.109 175.234 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 89.8 t -135.23 141.89 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 127.118 2.167 . . . . 0.0 109.331 -177.186 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.12 155.21 22.73 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 123.102 1.429 . . . . 0.0 114.004 174.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 29.5 m -160.27 172.28 17.66 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.711 2.004 . . . . 0.0 107.082 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -92.51 152.39 19.68 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 119.958 1.254 . . . . 0.0 111.72 168.527 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -96.34 -4.69 41.55 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.151 0.981 . . . . 0.0 112.034 167.528 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 121.0 -34.81 3.89 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 127.14 2.305 . . . . 0.0 112.802 176.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 23.8 ttp180 -120.42 -29.92 4.68 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 130.419 3.487 . . . . 0.0 111.822 -176.748 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -135.38 171.96 13.7 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 128.425 2.69 . . . . 0.0 110.896 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 8.3 p -87.52 150.23 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.797 1.239 . . . . 0.0 110.283 169.525 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 31.3 ptt85 -137.25 172.27 13.24 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 126.552 1.941 . . . . 0.0 109.814 -174.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -114.69 171.98 7.31 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.534 0.734 . . . . 0.0 110.201 167.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -160.95 151.05 17.57 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 127.0 2.12 . . . . 0.0 107.919 179.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.3 tp -60.45 157.8 13.3 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.618 1.167 . . . . 0.0 113.193 172.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.84 -30.92 58.68 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 116.366 1.988 . . . . 0.0 116.366 -177.249 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 42.0 t0 173.49 153.12 0.09 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.345 2.258 . . . . 0.0 109.091 -166.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 90.8 p -44.23 -30.91 0.86 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.191 1.796 . . . . 0.0 112.917 166.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -53.55 -59.01 5.15 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 126.236 1.814 . . . . 0.0 113.763 171.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 21.6 mt -60.77 -44.96 96.11 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.482 1.037 . . . . 0.0 108.202 176.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.6 -33.7 64.2 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.766 1.226 . . . . 0.0 112.262 -172.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 7.6 mtt-85 -70.78 -56.81 5.52 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.352 1.061 . . . . 0.0 113.342 175.395 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.84 -37.08 83.79 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 120.005 1.275 . . . . 0.0 112.697 -178.391 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 36.1 tp -63.57 -34.76 78.52 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.424 1.89 . . . . 0.0 111.781 169.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.68 -29.4 29.57 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 126.845 2.164 . . . . 0.0 114.646 -174.463 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -11.24 60.26 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.126 1.463 . . . . 0.0 111.568 167.709 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.5 tp 73.77 133.79 0.05 OUTLIER 'General case' 0 C--N 1.347 0.482 0 C-N-CA 130.903 3.681 . . . . 0.0 106.54 -169.023 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 79.0 t -67.75 5.5 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 -167.217 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 86.91 -25.18 0.1 Allowed 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.032 -1.042 . . . . 0.0 111.615 138.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.416 HG23 ' HG ' ' A' ' 14' ' ' LEU . 7.2 p -52.85 25.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.83 1 C-N-CA 134.702 5.201 . . . . 0.0 115.264 166.804 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 62.37 14.22 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 126.305 1.842 . . . . 0.0 113.689 171.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 4.7 tt 91.65 104.27 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 128.349 2.659 . . . . 0.0 108.735 -168.375 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.554 1.103 0 N-CA-C 115.862 1.801 . . . . 0.0 115.862 176.888 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.93 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.64 -31.27 24.77 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.951 1.3 . . . . 0.0 112.332 166.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.7 mtm105 -84.18 -32.37 24.63 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.991 1.316 . . . . 0.0 113.458 173.348 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -54.72 -49.75 69.99 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.834 1.254 . . . . 0.0 109.992 172.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.82 -24.92 70.25 Favored Glycine 0 N--CA 1.473 1.158 0 O-C-N 121.202 -0.937 . . . . 0.0 113.476 176.025 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.86 1.27 15.49 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.896 1.278 . . . . 0.0 112.336 173.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -118.41 -38.59 3.14 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.234 1.414 . . . . 0.0 111.848 167.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mp -86.18 -8.76 57.58 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -175.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -128.09 35.53 4.43 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.337 1.455 . . . . 0.0 110.698 167.759 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -114.59 144.42 31.81 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 127.379 2.271 . . . . 0.0 106.38 176.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -54.29 -94.41 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.791 1 C-N-CA 126.15 4.567 . . . . 0.0 114.314 -166.58 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.3 t -60.25 -23.86 64.42 Favored 'General case' 0 C--O 1.223 -0.342 0 O-C-N 121.375 -0.828 . . . . 0.0 111.51 175.014 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -69.73 -34.87 74.44 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.253 1.388 . . . . 0.0 113.783 -178.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.6 t -70.05 -36.82 75.28 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 121.44 1.927 . . . . 0.0 110.53 169.201 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.1 mtm180 -59.35 -46.98 87.14 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-O 117.65 -1.166 . . . . 0.0 112.532 172.112 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.466 HG12 HD11 ' A' ' 44' ' ' LEU . 1.1 mt -44.89 -56.88 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 CA-C-N 121.137 1.789 . . . . 0.0 110.307 172.19 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 94.8 mt -61.8 -41.39 97.69 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 117.702 -1.142 . . . . 0.0 111.545 -175.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.8 p -75.21 -27.76 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-N 120.793 1.633 . . . . 0.0 112.833 176.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.37 -30.26 63.18 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.423 1.489 . . . . 0.0 112.441 173.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.447 ' O ' HG13 ' A' ' 34' ' ' VAL . 1.4 mp -63.44 -47.04 83.52 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.425 167.305 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.51 -45.89 56.81 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.112 1.765 . . . . 0.0 112.469 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.402 ' O ' ' HE1' ' A' ' 43' ' ' HIS . 29.6 t0 -107.29 40.53 1.66 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.103 1.761 . . . . 0.0 111.102 174.616 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -150.56 -78.3 0.02 OUTLIER Glycine 0 C--N 1.339 0.731 0 O-C-N 120.555 -1.34 . . . . 0.0 115.267 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.447 HG13 ' O ' ' A' ' 30' ' ' LEU . 27.6 m 31.37 31.01 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 C-N-CA 128.055 2.542 . . . . 0.0 117.6 -168.075 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 36.1 m -84.65 -67.66 0.78 Allowed 'General case' 0 N--CA 1.469 0.481 0 O-C-N 120.551 -1.343 . . . . 0.0 113.933 -173.125 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -143.64 164.03 32.83 Favored Pre-proline 0 CA--C 1.54 0.565 0 CA-C-O 118.054 -0.974 . . . . 0.0 112.541 -171.778 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -66.19 -25.49 50.31 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 121.99 1.794 . . . . 0.0 113.061 -169.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.16 11.34 48.14 Favored Glycine 0 CA--C 1.53 0.979 0 CA-C-O 117.913 -1.493 . . . . 0.0 114.439 173.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.23 -34.27 77.72 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.501 2.151 . . . . 0.0 111.126 179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 46.0 mt -56.36 -21.54 25.36 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 124.901 1.28 . . . . 0.0 112.647 175.07 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.43 -28.4 69.78 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.189 -0.944 . . . . 0.0 112.194 -178.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.2 -57.05 3.99 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.769 0.828 . . . . 0.0 111.099 169.809 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.402 ' HE1' ' O ' ' A' ' 32' ' ' ASP . 28.2 m170 -53.41 -31.48 45.25 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -179.064 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.466 HD11 HG12 ' A' ' 26' ' ' ILE . 70.4 mt -98.09 -22.93 15.97 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.147 0.979 . . . . 0.0 113.44 -175.043 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.56 -0.73 48.07 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 124.787 1.184 . . . . 0.0 113.484 -169.282 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.9 mt -97.32 149.21 22.34 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.276 1.43 . . . . 0.0 110.326 -176.285 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.7 p -66.2 152.05 45.68 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 121.233 -0.917 . . . . 0.0 110.975 -174.705 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -56.14 -44.05 78.86 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.495 0.718 . . . . 0.0 111.988 -178.118 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.6 m -64.24 -35.56 81.22 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.588 1.155 . . . . 0.0 112.782 173.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -73.89 -44.54 54.94 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 178.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 67.9 t -60.6 -30.65 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 119.409 1.004 . . . . 0.0 112.447 176.12 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.8 m -53.16 -38.54 62.85 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 119.825 1.193 . . . . 0.0 113.683 174.47 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 64.3 m-80 -58.63 -48.02 82.43 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.236 1.014 . . . . 0.0 111.718 175.639 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 34.6 m80 -65.79 -31.73 72.86 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.569 1.148 . . . . 0.0 112.343 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 60.1 mt -74.46 -32.48 62.61 Favored 'General case' 0 C--O 1.222 -0.395 0 C-N-CA 124.088 0.955 . . . . 0.0 112.767 169.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.3 m -61.97 -33.97 75.28 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 120.798 1.636 . . . . 0.0 115.375 -170.141 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 38.5 t -77.04 -34.12 57.27 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.717 1.144 . . . . 0.0 111.512 170.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.3 tp -64.14 -38.28 90.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.37 2.268 . . . . 0.0 112.271 -177.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 66.4 mtm-85 -75.23 -13.51 60.45 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.905 1.682 . . . . 0.0 113.059 174.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.89 -34.99 4.71 Favored Glycine 0 N--CA 1.473 1.153 0 C-N-CA 126.317 1.913 . . . . 0.0 113.548 175.864 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 56.1 m -76.51 7.69 4.24 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.422 1.489 . . . . 0.0 111.425 168.494 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.48 -20.03 1.78 Allowed Glycine 0 CA--C 1.533 1.171 0 C-N-CA 126.71 2.1 . . . . 0.0 116.095 175.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.3 mt -55.63 -24.99 36.54 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 127.367 2.267 . . . . 0.0 115.675 -170.358 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.44 HG12 ' CD2' ' A' ' 30' ' ' LEU . 2.7 m -121.64 127.53 75.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 C-N-CA 124.27 1.028 . . . . 0.0 112.937 171.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 90.4 t -115.7 132.91 63.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 125.792 1.637 . . . . 0.0 109.513 -176.195 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -91.13 155.17 18.83 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 122.242 1.02 . . . . 0.0 112.684 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 26.3 m -147.79 152.09 37.11 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.301 1.44 . . . . 0.0 109.001 177.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -98.98 110.48 23.08 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.051 1.34 . . . . 0.0 111.14 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -87.52 68.37 9.6 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.036 2.135 . . . . 0.0 111.177 -179.165 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 63.01 -1.43 1.84 Allowed Glycine 0 CA--C 1.538 1.504 0 N-CA-C 117.72 1.848 . . . . 0.0 117.72 168.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.6 mtm-85 154.7 -25.83 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 131.533 3.933 . . . . 0.0 111.363 -172.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -94.43 179.16 5.38 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 166.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 24.5 m -128.43 168.89 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 O-C-N 121.042 -1.036 . . . . 0.0 108.838 168.238 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -137.63 -176.11 4.3 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.777 1.631 . . . . 0.0 111.14 172.169 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -135.43 151.33 50.31 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.769 2.027 . . . . 0.0 109.01 169.428 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.438 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -152.39 151.62 31.05 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.017 1.327 . . . . 0.0 110.58 -173.196 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -57.3 143.77 38.36 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.568 1.147 . . . . 0.0 109.711 173.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.49 -10.75 60.0 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 116.806 2.15 . . . . 0.0 116.806 -169.537 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -176.17 161.59 2.36 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.235 2.214 . . . . 0.0 109.563 173.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 90.2 p -41.59 -32.76 0.38 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 128.247 2.619 . . . . 0.0 112.711 166.148 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -42.07 -60.71 1.34 Allowed 'General case' 0 C--N 1.343 0.291 0 C-N-CA 126.666 1.986 . . . . 0.0 112.801 168.066 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.434 ' H ' HD22 ' A' ' 82' ' ' LEU . 0.3 OUTLIER -80.37 -34.96 36.05 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -170.344 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.69 -38.4 69.61 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 118.62 0.645 . . . . 0.0 112.664 169.407 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -71.78 -63.74 1.07 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.946 0.898 . . . . 0.0 113.245 173.113 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.47 -25.99 67.6 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.88 -1.137 . . . . 0.0 113.548 -171.83 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.77 -40.47 22.58 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 123.268 0.627 . . . . 0.0 111.779 169.584 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.12 -60.12 5.41 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 127.059 2.266 . . . . 0.0 115.045 -176.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.6 pm0 -66.44 -21.67 66.21 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.676 1.738 . . . . 0.0 111.406 168.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.8 tt 80.38 132.68 0.06 Allowed 'General case' 0 C--N 1.343 0.294 0 C-N-CA 128.565 2.746 . . . . 0.0 112.225 166.51 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 29.4 m -63.29 16.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 126.797 2.039 . . . . 0.0 114.732 178.241 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 73.22 -11.0 0.94 Allowed 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 126.365 1.866 . . . . 0.0 113.212 169.177 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 2.9 p -55.73 22.78 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 C-N-CA 129.864 3.266 . . . . 0.0 117.698 175.149 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.9 t 68.7 9.75 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 126.771 2.028 . . . . 0.0 112.779 166.179 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 95.31 110.51 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 131.09 3.756 . . . . 0.0 107.665 -168.185 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.3 74.75 0.05 Allowed 'General case' 0 CA--C 1.553 1.089 0 O-C-N 121.446 -0.783 . . . . 0.0 113.05 169.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.8 t -70.77 146.59 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 126.082 1.753 . . . . 0.0 111.8 174.311 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.69 78.8 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 128.69 2.796 . . . . 0.0 112.401 170.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 19.7 p -141.02 121.67 14.26 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.036 1.335 . . . . 0.0 112.61 -172.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -111.84 134.41 53.42 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.858 1.263 . . . . 0.0 110.041 173.182 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -165.11 158.62 14.23 Favored Pre-proline 0 CA--C 1.548 0.866 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 -170.443 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -83.16 170.32 12.22 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.972 2.448 . . . . 0.0 113.203 -172.514 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.6 t . . . . . 0 CA--C 1.558 1.274 0 C-N-CA 125.395 1.478 . . . . 0.0 110.205 167.144 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.458 0 N-CA-C 114.882 1.438 . . . . 0.0 114.882 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.81 -21.4 11.07 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 120.671 -1.268 . . . . 0.0 112.691 168.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 38.0 mtm105 -83.6 -46.72 12.05 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.151 1.781 . . . . 0.0 111.798 169.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -51.17 -57.89 7.58 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.913 1.685 . . . . 0.0 110.262 173.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.5 -23.71 75.2 Favored Glycine 0 C--N 1.339 0.725 0 CA-C-O 117.908 -1.495 . . . . 0.0 112.757 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 25.8 ttm105 -63.99 -49.19 73.44 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 119.792 1.796 . . . . 0.0 110.386 169.014 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.19 -33.85 75.33 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 120.065 1.302 . . . . 0.0 114.093 175.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 7.6 mp -84.57 -2.04 56.8 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 178.044 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -119.87 -12.82 9.13 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 172.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.55 157.32 27.08 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 126.347 1.859 . . . . 0.0 111.384 169.545 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -65.23 -99.49 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 0.992 1 C-N-CA 126.009 4.473 . . . . 0.0 111.725 -176.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 12.1 t -58.48 -25.27 62.13 Favored 'General case' 0 N--CA 1.464 0.262 0 O-C-N 120.637 -1.29 . . . . 0.0 112.469 175.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.54 -39.91 85.0 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 119.707 1.14 . . . . 0.0 112.844 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 44.0 t -66.54 -37.19 84.47 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.72 1.6 . . . . 0.0 111.008 169.496 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 7.2 mtm180 -61.53 -35.88 78.99 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 172.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 26' ' ' ILE . . . . . 0.452 HG12 HD11 ' B' ' 44' ' ' LEU . 1.8 mt -52.59 -59.9 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 CA-C-N 120.334 1.425 . . . . 0.0 108.851 169.122 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 96.9 mt -57.24 -45.95 83.45 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.75 -171.475 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 5.7 p -75.06 -31.3 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.58 -30.81 57.17 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.131 0.878 . . . . 0.0 112.387 174.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 12.1 tp -64.42 -37.09 86.3 Favored 'General case' 0 C--N 1.339 0.152 0 O-C-N 120.926 -1.109 . . . . 0.0 112.768 175.161 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.05 -31.75 8.28 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 128.907 2.883 . . . . 0.0 114.237 175.124 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.84 -33.17 18.67 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.663 1.985 . . . . 0.0 113.152 174.507 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -99.22 -65.02 0.84 Allowed Glycine 0 C--N 1.338 0.687 0 N-CA-C 115.465 0.946 . . . . 0.0 115.465 -165.343 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 16.1 m 34.5 38.8 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 125.969 1.708 . . . . 0.0 114.075 -167.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 30.0 m -86.47 -86.65 0.14 Allowed 'General case' 0 C--O 1.225 -0.23 0 C-N-CA 124.028 0.931 . . . . 0.0 110.944 -176.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -133.69 162.89 54.92 Favored Pre-proline 0 CA--C 1.544 0.72 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -169.127 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -63.91 -25.53 67.21 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 122.64 2.226 . . . . 0.0 113.843 -167.177 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.66 7.81 50.42 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-O 117.114 -1.937 . . . . 0.0 114.918 172.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.99 -31.97 71.55 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 121.083 2.442 . . . . 0.0 111.409 -175.084 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 31.4 mt -63.13 -18.75 63.77 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 125.32 1.448 . . . . 0.0 112.215 -179.143 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.0 -32.18 70.61 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 119.731 1.15 . . . . 0.0 112.245 177.165 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.62 -54.88 6.08 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.491 0.716 . . . . 0.0 111.306 170.5 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -53.55 -31.37 46.21 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.452 HD11 HG12 ' B' ' 26' ' ' ILE . 70.3 mt -100.55 -27.13 13.58 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.558 1.143 . . . . 0.0 112.984 -174.644 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.56 4.97 88.0 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 124.998 1.285 . . . . 0.0 113.27 -169.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 96.6 mt -105.78 150.3 25.67 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.019 1.328 . . . . 0.0 111.207 -172.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 9.5 p -64.34 149.63 47.82 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.262 -0.899 . . . . 0.0 110.402 -175.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -58.57 -35.56 72.57 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.654 0.612 . . . . 0.0 112.654 -177.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.7 m -66.82 -44.01 82.3 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.356 -0.84 . . . . 0.0 112.018 170.563 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -65.81 -45.31 82.81 Favored 'General case' 0 CA--C 1.548 0.884 0 O-C-N 121.162 -0.961 . . . . 0.0 112.215 177.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 94.8 t -59.59 -31.72 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 120.335 -1.478 . . . . 0.0 111.692 169.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 69.7 m -65.13 -26.99 68.43 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.02 1.282 . . . . 0.0 113.728 175.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -62.97 -55.58 24.6 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.104 0.866 . . . . 0.0 109.557 169.486 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 33.9 m80 -59.04 -39.86 83.29 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.594 1.158 . . . . 0.0 113.18 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 56.0 mt -66.59 -33.75 76.36 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 124.59 1.156 . . . . 0.0 112.709 172.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 59.9 m -63.7 -35.55 80.94 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 120.484 1.493 . . . . 0.0 114.293 -169.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 34.1 t -72.05 -34.69 68.95 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.597 0.635 . . . . 0.0 112.07 169.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.4 tp -68.41 -32.05 71.83 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.556 2.342 . . . . 0.0 112.581 -175.646 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 51.3 mtm-85 -82.09 -19.64 39.76 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.39 1.476 . . . . 0.0 112.239 171.375 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -88.88 -37.85 7.14 Favored Glycine 0 N--CA 1.476 1.325 0 C-N-CA 124.811 1.196 . . . . 0.0 113.398 177.103 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 97.0 m -81.39 15.34 2.05 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 126.332 1.853 . . . . 0.0 111.364 169.185 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.93 -26.3 1.16 Allowed Glycine 0 CA--C 1.534 1.259 0 C-N-CA 126.265 1.888 . . . . 0.0 116.525 172.55 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 21.3 mt -50.86 -29.41 11.78 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 127.664 2.386 . . . . 0.0 116.592 -168.801 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -118.03 122.44 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 124.915 1.286 . . . . 0.0 111.301 169.265 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 80.4 t -107.45 130.65 59.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 125.507 1.523 . . . . 0.0 108.656 -176.169 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -96.86 146.46 24.91 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 124.624 1.17 . . . . 0.0 111.395 -177.536 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 96.4 m -154.09 147.35 24.81 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 124.432 1.093 . . . . 0.0 109.001 -172.556 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -97.62 93.23 6.3 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.36 1.064 . . . . 0.0 111.719 -176.373 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -69.3 74.88 0.36 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.815 1.646 . . . . 0.0 114.078 173.487 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 63.15 -5.69 0.56 Allowed Glycine 0 N--CA 1.475 1.257 0 C-N-CA 126.808 2.147 . . . . 0.0 118.313 167.281 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 4.1 mtm-85 161.04 -24.98 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 130.36 3.464 . . . . 0.0 111.759 -175.719 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -100.6 170.4 8.39 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 166.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 11.1 m -115.1 163.32 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 119.036 0.834 . . . . 0.0 109.134 168.015 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 10.3 ptt-85 -129.63 172.93 11.09 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 122.2 1.0 . . . . 0.0 110.784 170.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -127.93 140.34 52.06 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 167.108 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -146.52 154.75 41.9 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 123.753 0.821 . . . . 0.0 110.675 -178.434 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 1.2 mp -57.25 142.96 41.24 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.593 0.757 . . . . 0.0 110.614 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.13 0.44 1.97 Allowed 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 118.751 2.871 . . . . 0.0 118.751 -167.461 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 11.8 t70 169.02 158.33 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 129.835 3.254 . . . . 0.0 109.832 173.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 88.7 p -40.58 -35.39 0.46 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.806 2.442 . . . . 0.0 112.756 167.169 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -38.66 -63.16 0.53 Allowed 'General case' 0 C--N 1.342 0.278 0 C-N-CA 127.242 2.217 . . . . 0.0 113.013 167.72 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 82' ' ' LEU . . . . . 0.511 ' H ' HD22 ' B' ' 82' ' ' LEU . 0.4 OUTLIER -75.2 -34.16 61.49 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -170.981 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.17 -30.22 71.41 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.857 0.863 . . . . 0.0 112.3 177.316 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.8 mmt85 -71.17 -65.74 0.71 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.645 1.178 . . . . 0.0 110.905 168.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.97 -25.83 63.93 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.599 1.333 . . . . 0.0 114.599 -173.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -87.26 -34.3 18.97 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.374 -0.829 . . . . 0.0 112.647 169.732 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.35 -58.33 5.11 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 127.27 2.367 . . . . 0.0 113.645 -175.332 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 14.0 pm0 -70.21 -17.72 63.15 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 119.22 1.51 . . . . 0.0 111.165 166.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 89' ' ' LEU . . . . . 0.406 ' C ' ' H ' ' B' ' 91' ' ' GLN . 26.5 tp 82.07 146.44 0.08 Allowed 'General case' 0 C--N 1.343 0.321 0 C-N-CA 129.989 3.315 . . . . 0.0 112.904 167.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 90' ' ' VAL . . . . . 0.497 HG23 HG12 ' B' ' 92' ' ' VAL . 5.8 m -57.34 5.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 127.513 2.325 . . . . 0.0 114.122 168.451 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 91' ' ' GLN . . . . . 0.406 ' H ' ' C ' ' B' ' 89' ' ' LEU . 7.3 mm-40 69.0 -9.27 0.6 Allowed 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 127.111 2.164 . . . . 0.0 114.228 176.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.497 HG12 HG23 ' B' ' 90' ' ' VAL . 1.2 p -56.26 26.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 130.174 3.39 . . . . 0.0 117.765 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 73.05 10.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 126.672 1.989 . . . . 0.0 112.496 168.572 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 78.99 101.27 0.06 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 127.716 2.407 . . . . 0.0 108.986 -171.224 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.552 1.039 0 C-N-CA 125.14 1.376 . . . . 0.0 114.681 177.4 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 pp . . . . . 0 N--CA 1.471 0.593 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.44 1.26 8.29 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.372 1.469 . . . . 0.0 113.878 176.632 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -112.21 -21.18 11.58 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.967 1.307 . . . . 0.0 112.478 169.042 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.08 -59.71 4.98 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.705 1.138 . . . . 0.0 109.534 168.411 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.08 -27.56 72.45 Favored Glycine 0 CA--C 1.538 1.473 0 O-C-N 121.292 -0.88 . . . . 0.0 113.234 -178.458 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -51.93 28.7 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.287 1.035 . . . . 0.0 111.478 172.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.44 -25.11 59.22 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.125 -0.984 . . . . 0.0 112.524 -175.211 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.1 mp -82.83 -6.96 59.67 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 118.138 -0.934 . . . . 0.0 111.362 168.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -92.34 -35.62 13.63 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 119.995 1.271 . . . . 0.0 112.28 166.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -47.56 127.81 10.51 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 125.309 1.443 . . . . 0.0 108.697 173.261 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -50.06 -85.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 1 C-N-CA 127.621 5.547 . . . . 0.0 113.516 -165.254 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.36 -22.24 29.78 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 126.614 1.965 . . . . 0.0 113.747 174.351 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 37.8 mtt180 -74.19 -40.69 62.34 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 120.249 1.386 . . . . 0.0 112.215 178.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 6.9 t -60.18 -48.32 82.21 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.353 0.979 . . . . 0.0 110.09 169.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -62.18 -35.84 80.06 Favored 'General case' 0 CA--C 1.556 1.178 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 176.222 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -55.27 -53.47 34.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 CA-C-N 120.674 1.579 . . . . 0.0 108.719 167.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.693 HD22 HD21 ' A' ' 77' ' ' LEU . 25.0 mt -63.88 -45.61 88.63 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 117.483 -1.246 . . . . 0.0 112.664 -174.11 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.2 m -58.27 -27.22 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 CA-C-N 120.667 1.576 . . . . 0.0 112.378 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.482 ' HB1' ' CD2' ' A' ' 43' ' ' HIS . . . -95.63 -18.43 20.55 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.972 0.909 . . . . 0.0 113.312 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.503 HD23 ' HA ' ' A' ' 30' ' ' LEU . 8.9 mt -68.72 -41.28 79.25 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 118.247 -0.883 . . . . 0.0 112.482 168.905 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.8 tt -29.81 -62.32 0.14 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 130.4 3.48 . . . . 0.0 113.251 -178.345 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -98.55 -17.5 18.65 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.746 2.018 . . . . 0.0 112.684 174.245 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.39 -43.16 25.76 Favored Glycine 0 C--N 1.341 0.853 0 CA-C-O 116.153 -2.471 . . . . 0.0 115.833 -168.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.6 m 4.03 48.65 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 C-N-CA 131.125 3.77 . . . . 0.0 119.798 177.116 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 68.7 m -104.61 -63.17 1.24 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.975 1.71 . . . . 0.0 110.424 176.381 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -151.26 149.14 23.91 Favored Pre-proline 0 N--CA 1.474 0.762 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -173.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -55.99 -44.44 47.06 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 121.756 1.638 . . . . 0.0 111.082 175.744 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -69.04 -5.06 45.56 Favored Glycine 0 CA--C 1.535 1.288 0 CA-C-O 118.276 -1.291 . . . . 0.0 114.678 177.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -69.91 -34.97 74.19 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 118.965 1.382 . . . . 0.0 111.383 173.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.8 mt -64.56 -3.2 2.88 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 118.43 0.559 . . . . 0.0 111.9 -177.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.96 -44.3 85.41 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.724 -0.61 . . . . 0.0 110.264 172.49 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.58 -38.55 70.92 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.821 0.849 . . . . 0.0 111.813 173.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.482 ' CD2' ' HB1' ' A' ' 29' ' ' ALA . 6.5 m-70 -62.9 -20.03 64.77 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.606 HD12 HG22 ' A' ' 51' ' ' VAL . 75.5 mt -121.24 -19.37 7.1 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.996 1.718 . . . . 0.0 114.285 -172.834 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.49 17.29 78.95 Favored Glycine 0 CA--C 1.535 1.289 0 CA-C-N 118.673 0.669 . . . . 0.0 112.438 -168.551 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 87.1 mt -111.09 157.3 20.15 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.693 1.246 . . . . 0.0 112.749 -173.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.3 t -62.97 147.47 50.45 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.466 -0.771 . . . . 0.0 109.904 168.681 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 19.3 ptt-85 -61.58 -13.63 23.38 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 174.089 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.6 m -66.7 -51.18 58.99 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.033 -1.042 . . . . 0.0 111.71 169.343 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -65.14 -44.92 87.05 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.036 0.935 . . . . 0.0 110.142 177.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.606 HG22 HD12 ' A' ' 44' ' ' LEU . 13.0 t -52.72 -48.38 49.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.266 171.824 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 66.5 m -60.84 -39.58 89.62 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 118.954 0.797 . . . . 0.0 112.487 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -57.89 -44.54 86.8 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.074 0.949 . . . . 0.0 111.858 173.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 23.0 m170 -61.73 -41.59 97.84 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 120.895 -1.128 . . . . 0.0 112.149 172.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 54.8 mt -75.09 -20.5 59.46 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.2 t -49.81 -51.64 38.23 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.889 1.276 . . . . 0.0 113.508 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 40.0 t -77.87 -39.8 42.13 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.574 0.75 . . . . 0.0 111.904 175.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.7 tp -55.58 -36.61 67.07 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.456 1.503 . . . . 0.0 112.302 -176.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.431 ' HD3' ' CE2' ' A' ' 75' ' ' TYR . 69.0 mtm180 -74.13 -40.23 62.78 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 173.024 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.43 -39.03 31.7 Favored Glycine 0 N--CA 1.467 0.733 0 C-N-CA 123.798 0.713 . . . . 0.0 112.122 -170.383 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 67.6 m -81.18 12.33 3.55 Favored 'General case' 0 CA--C 1.562 1.417 0 C-N-CA 126.206 1.802 . . . . 0.0 112.315 171.565 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.88 -12.08 54.55 Favored Glycine 0 N--CA 1.473 1.133 0 C-N-CA 128.574 2.988 . . . . 0.0 118.946 167.143 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.7 mt -58.59 -29.82 66.73 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.45 1.5 . . . . 0.0 114.815 -175.015 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.6 m -132.0 132.33 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.7 t -118.85 135.23 59.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 127.871 2.468 . . . . 0.0 110.883 -168.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.68 126.55 31.42 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.29 0.636 . . . . 0.0 111.845 175.473 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -141.67 156.45 45.64 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.413 1.085 . . . . 0.0 109.395 174.724 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.35 124.43 28.41 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.55 1.068 . . . . 0.0 110.112 168.16 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.0 -32.57 57.3 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 121.28 -0.888 . . . . 0.0 112.758 173.488 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 166.33 -17.92 0.09 OUTLIER Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.569 1.557 . . . . 0.0 115.246 174.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.96 -16.65 0.26 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.16 2.184 . . . . 0.0 113.584 177.294 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.04 173.98 10.98 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.659 1.984 . . . . 0.0 109.729 175.338 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 8.4 p -81.26 136.95 22.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 C-N-CA 124.315 1.046 . . . . 0.0 111.072 169.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -110.24 160.4 16.55 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 126.553 1.941 . . . . 0.0 109.648 169.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.431 ' CE2' ' HD3' ' A' ' 59' ' ' ARG . 3.4 m-30 -107.99 100.76 10.08 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 107.027 -1.471 . . . . 0.0 107.027 170.268 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -93.61 142.15 27.67 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.32 1.048 . . . . 0.0 110.055 179.08 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.693 HD21 HD22 ' A' ' 27' ' ' LEU . 8.6 mt -55.33 153.19 7.46 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.667 0.787 . . . . 0.0 112.049 171.701 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.85 -32.89 66.25 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 115.054 1.502 . . . . 0.0 115.054 -169.403 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -167.35 161.69 14.31 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 125.071 1.348 . . . . 0.0 109.718 -175.59 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 68.6 m -48.35 -32.59 7.7 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.363 1.065 . . . . 0.0 112.332 168.1 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -47.84 -52.78 17.79 Favored 'General case' 0 C--N 1.345 0.397 0 C-N-CA 125.614 1.565 . . . . 0.0 112.829 171.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.3 mt -76.03 -46.08 31.13 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 117.926 -1.035 . . . . 0.0 108.808 -173.325 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.52 -33.69 46.38 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 172.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 -68.01 -67.36 0.47 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.982 1.713 . . . . 0.0 112.327 173.871 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.94 -30.14 71.25 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.74 1.155 . . . . 0.0 113.276 -174.406 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 47.1 tp -65.56 -38.82 90.65 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.249 1.42 . . . . 0.0 110.905 169.209 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.02 -51.52 6.89 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 128.548 2.975 . . . . 0.0 115.091 -175.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -71.53 -2.49 17.07 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.43 1.615 . . . . 0.0 113.23 172.699 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 32.9 tp 69.84 110.62 0.05 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 128.605 2.762 . . . . 0.0 113.288 167.123 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.489 HG23 HG12 ' A' ' 92' ' ' VAL . 29.5 m -64.9 17.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 127.097 2.159 . . . . 0.0 116.376 -169.683 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.512 ' C ' ' H ' ' A' ' 93' ' ' VAL . 43.1 mm-40 75.55 -11.01 1.16 Allowed 'General case' 0 C--O 1.216 -0.676 0 O-C-N 120.525 -1.359 . . . . 0.0 113.277 158.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.489 HG12 HG23 ' A' ' 90' ' ' VAL . 4.3 p -70.74 40.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 126.769 2.028 . . . . 0.0 111.271 166.707 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.512 ' H ' ' C ' ' A' ' 91' ' ' GLN . 2.2 t 72.0 -33.49 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 130.82 3.648 . . . . 0.0 114.657 176.203 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 51.4 tp 128.91 94.08 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.66 1 C-N-CA 132.044 4.138 . . . . 0.0 105.792 -166.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.14 138.61 37.65 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -174.092 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 25.5 t -114.0 154.26 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 126.556 1.943 . . . . 0.0 108.917 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.8 -4.76 0.49 Allowed 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 127.205 2.202 . . . . 0.0 114.885 173.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.1 p -84.73 109.85 18.35 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.857 1.663 . . . . 0.0 113.254 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -89.61 157.95 17.82 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.194 0.998 . . . . 0.0 108.89 166.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -160.21 147.34 12.42 Favored Pre-proline 0 CA--C 1.556 1.19 0 CA-C-O 117.365 -1.303 . . . . 0.0 109.362 -169.127 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -38.77 146.84 0.14 Allowed 'Trans proline' 0 C--N 1.357 1.017 1 C-N-CA 127.111 5.208 . . . . 0.0 121.349 -166.573 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.548 0.885 0 CA-C-O 123.021 1.391 . . . . 0.0 108.645 168.209 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . 0.272 1.8 pp . . . . . 0 N--CA 1.479 0.994 0 N-CA-C 117.248 2.314 . . . . 0.0 117.248 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.38 -23.63 63.76 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 120.398 1.454 . . . . 0.0 112.731 178.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -20.44 61.4 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 116.626 -1.654 . . . . 0.0 112.055 172.204 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.58 -67.77 0.3 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 120.778 1.626 . . . . 0.0 108.589 170.012 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -57.63 -38.7 88.96 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-O 119.512 -0.604 . . . . 0.0 112.721 -175.449 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -62.47 -50.99 69.25 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 118.105 0.952 . . . . 0.0 112.669 173.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.27 -11.71 60.83 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.364 0.983 . . . . 0.0 113.37 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.3 mp -96.42 -14.2 22.61 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.34 1.056 . . . . 0.0 112.145 168.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.95 -13.86 56.9 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.397 1.079 . . . . 0.0 112.282 166.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -79.98 133.05 58.65 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 128.414 2.686 . . . . 0.0 108.927 -177.429 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -52.88 -84.7 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.614 1 C-N-CA 126.819 5.013 . . . . 0.0 113.297 -167.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.03 -23.29 67.38 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 126.251 1.821 . . . . 0.0 112.508 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 47.0 mtt85 -73.84 -43.44 58.7 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 120.248 1.385 . . . . 0.0 112.663 176.516 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 4.5 t -58.32 -44.87 88.83 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.918 1.235 . . . . 0.0 110.023 170.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 19.5 tpt180 -61.31 -33.86 74.28 Favored 'General case' 0 CA--C 1.559 1.301 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 172.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -63.83 -52.15 60.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 O-C-N 119.601 -1.937 . . . . 0.0 108.957 168.622 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 88.5 mt -59.47 -44.7 92.96 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 117.674 -1.155 . . . . 0.0 112.437 -177.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 3.8 m -59.32 -23.89 26.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 CA-C-N 120.427 1.467 . . . . 0.0 112.734 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 29' ' ' ALA . . . . . 0.55 ' HB1' ' CD2' ' B' ' 43' ' ' HIS . . . -98.92 -8.18 25.97 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.4 1.08 . . . . 0.0 112.784 -179.682 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.8 mt -87.14 -25.17 24.23 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.005 1.322 . . . . 0.0 112.932 168.704 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.2 -30.17 10.93 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 127.991 2.516 . . . . 0.0 111.676 166.144 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -131.0 -37.72 1.27 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.436 1.894 . . . . 0.0 115.447 -170.411 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.26 -63.23 3.01 Favored Glycine 0 C--N 1.343 0.963 0 C-N-CA 125.022 1.296 . . . . 0.0 114.688 -165.784 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 4.3 m 41.01 36.2 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 173.596 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 60.0 m -98.76 -76.37 0.54 Allowed 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 125.587 1.555 . . . . 0.0 112.198 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -143.08 153.29 60.02 Favored Pre-proline 0 N--CA 1.478 0.933 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 -169.171 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -54.41 -35.52 84.89 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.253 2.635 . . . . 0.0 112.64 178.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -80.41 -8.84 87.17 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-O 117.849 -1.528 . . . . 0.0 115.102 175.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.17 -32.35 73.74 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 120.627 2.213 . . . . 0.0 112.879 -171.592 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 5.2 mt -67.71 -7.87 30.63 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 118.543 0.611 . . . . 0.0 111.634 -178.092 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.51 -39.15 89.97 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.299 -0.875 . . . . 0.0 111.162 169.72 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.81 -44.22 33.44 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.295 1.038 . . . . 0.0 112.187 175.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 43' ' ' HIS . . . . . 0.55 ' CD2' ' HB1' ' B' ' 29' ' ' ALA . 25.6 m-70 -57.45 -25.04 59.08 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 178.772 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.655 HD12 HG22 ' B' ' 51' ' ' VAL . 66.5 mt -115.21 -19.71 10.69 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.374 1.87 . . . . 0.0 114.251 -173.278 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.89 17.9 77.22 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-N 119.137 0.881 . . . . 0.0 113.065 -169.058 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 85.9 mt -110.27 162.05 15.0 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.563 1.182 . . . . 0.0 112.889 -174.124 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.9 t -68.67 148.91 49.74 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.123 -0.986 . . . . 0.0 110.092 168.235 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 22.8 ptt-85 -60.29 -15.34 24.26 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 174.153 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 1.8 m -67.35 -50.79 58.44 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.986 -1.071 . . . . 0.0 111.68 169.199 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -65.92 -43.22 88.79 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.68 0.792 . . . . 0.0 110.398 176.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 51' ' ' VAL . . . . . 0.655 HG22 HD12 ' B' ' 44' ' ' LEU . 16.6 t -54.6 -44.39 69.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 O-C-N 121.588 -0.695 . . . . 0.0 112.074 171.354 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.1 m -62.3 -39.91 94.57 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.51 1.05 . . . . 0.0 112.802 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -55.78 -44.8 78.09 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.45 1.1 . . . . 0.0 111.487 172.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 22.2 m80 -63.27 -40.6 97.86 Favored 'General case' 0 CA--C 1.549 0.906 0 O-C-N 121.179 -0.95 . . . . 0.0 112.305 172.549 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 82.7 mt -73.83 -28.36 61.57 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -176.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 68.1 m -50.68 -53.39 31.54 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 120.798 1.636 . . . . 0.0 113.785 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 36.2 t -68.87 -42.85 76.47 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 118.551 0.614 . . . . 0.0 112.525 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 mp -49.0 -41.88 35.96 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.552 1.941 . . . . 0.0 114.287 174.26 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 85.7 mtm180 -91.4 -20.85 21.36 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -177.01 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -86.52 -45.72 5.44 Favored Glycine 0 N--CA 1.472 1.054 0 CA-C-N 119.921 1.237 . . . . 0.0 112.122 176.363 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 84.8 m -74.29 9.08 1.81 Allowed 'General case' 0 CA--C 1.561 1.399 0 C-N-CA 126.083 1.753 . . . . 0.0 113.612 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 84.81 -5.67 81.3 Favored Glycine 0 C--N 1.341 0.853 0 C-N-CA 128.797 3.094 . . . . 0.0 116.713 168.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 12.0 mt -64.26 -22.56 66.99 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 119.007 1.404 . . . . 0.0 114.6 -173.248 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 31.9 t -137.91 134.8 45.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 125.533 1.533 . . . . 0.0 112.284 -171.065 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 15.7 t -118.6 132.62 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 126.843 2.057 . . . . 0.0 111.281 -169.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -82.36 129.93 34.99 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.878 0.871 . . . . 0.0 110.8 169.59 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.01 159.76 42.03 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.111 0.964 . . . . 0.0 110.42 174.556 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.38 128.74 34.17 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.457 0.571 . . . . 0.0 109.912 166.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.65 -28.65 30.54 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.443 -0.786 . . . . 0.0 112.731 170.005 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 159.77 -39.79 0.47 Allowed Glycine 0 CA--C 1.531 1.038 0 C-N-CA 124.556 1.074 . . . . 0.0 115.005 172.219 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.31 -19.23 11.34 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.689 1.596 . . . . 0.0 113.103 172.534 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.85 171.74 13.8 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.485 1.914 . . . . 0.0 110.588 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 7.1 p -80.68 152.4 4.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 C-N-CA 124.328 1.051 . . . . 0.0 109.682 168.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 22.0 ptt180 -132.04 173.96 10.68 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.52 2.328 . . . . 0.0 110.749 177.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -120.09 120.93 37.67 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.643 166.422 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -109.87 164.04 12.96 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.159 1.384 . . . . 0.0 109.165 172.109 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 64.8 mt -70.02 166.35 19.91 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.725 -0.609 . . . . 0.0 111.018 172.195 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.8 -48.88 66.59 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 -177.702 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -161.99 164.66 28.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.988 2.115 . . . . 0.0 109.377 -171.177 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 73.2 m -51.53 -26.83 9.21 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.918 0.887 . . . . 0.0 112.58 168.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -52.26 -58.38 6.82 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 125.024 1.329 . . . . 0.0 112.292 170.582 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 8.9 mt -70.22 -42.62 72.03 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.563 1.074 . . . . 0.0 109.774 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.25 -35.77 50.69 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.242 1.017 . . . . 0.0 113.237 173.223 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 -67.01 -64.66 0.81 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.704 1.201 . . . . 0.0 112.337 175.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.63 -17.97 64.98 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 -176.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 43.0 tp -82.58 -30.94 29.26 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 127.104 2.162 . . . . 0.0 112.352 169.264 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -87.23 -59.71 1.73 Allowed Glycine 0 N--CA 1.473 1.102 0 C-N-CA 128.776 3.084 . . . . 0.0 114.252 -172.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -71.81 -16.57 62.18 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 119.045 1.422 . . . . 0.0 110.708 167.425 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 23.5 tp 78.24 147.79 0.09 Allowed 'General case' 0 C--N 1.343 0.312 0 C-N-CA 129.16 2.984 . . . . 0.0 114.488 165.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 90' ' ' VAL . . . . . 0.545 HG23 HG12 ' B' ' 92' ' ' VAL . 15.6 m -59.05 10.39 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 127.366 2.266 . . . . 0.0 114.46 168.024 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 70.57 -17.2 0.29 Allowed 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 127.083 2.153 . . . . 0.0 115.571 172.621 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.545 HG12 HG23 ' B' ' 90' ' ' VAL . 2.5 p -59.06 31.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 C-N-CA 130.622 3.569 . . . . 0.0 116.803 -178.033 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.4 t 69.77 12.96 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 127.702 2.401 . . . . 0.0 113.086 168.672 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 46.6 tp 84.06 104.41 0.05 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 129.285 3.034 . . . . 0.0 108.743 -169.523 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.831 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.165 168.979 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 pp . . . . . 0 N--CA 1.475 0.776 0 N-CA-C 113.747 1.018 . . . . 0.0 113.747 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.34 -20.76 66.54 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.973 0.909 . . . . 0.0 113.111 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.8 mmt180 -87.77 -43.03 12.18 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.141 0.977 . . . . 0.0 110.564 173.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -59.17 -43.34 92.11 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.55 1.14 . . . . 0.0 112.095 -178.175 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -56.13 -30.98 58.6 Favored Glycine 0 CA--C 1.533 1.205 0 CA-C-N 118.963 0.801 . . . . 0.0 112.586 176.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.6 ttp85 -90.69 -13.77 33.53 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 174.134 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.1 -30.05 62.15 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 121.033 1.742 . . . . 0.0 111.108 169.203 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.8 mp -81.96 -45.89 14.76 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.137 0.975 . . . . 0.0 110.298 169.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.19 64.98 5.19 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-O 122.459 1.123 . . . . 0.0 112.874 170.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -136.55 138.52 26.84 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 128.876 2.87 . . . . 0.0 109.523 -177.485 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -52.18 -89.26 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.807 1 C-N-CA 126.22 4.614 . . . . 0.0 114.159 -168.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 m -67.72 -24.22 65.35 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.833 0.853 . . . . 0.0 110.734 -177.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.502 ' HG2' HD13 ' A' ' 58' ' ' LEU . 16.9 ttm105 -74.74 -37.82 62.42 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.849 1.204 . . . . 0.0 112.601 -177.46 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 14.0 t -55.75 -46.48 77.82 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 120.126 1.33 . . . . 0.0 109.982 166.325 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 58.0 mmt-85 -58.95 -44.7 91.51 Favored 'General case' 0 C--O 1.217 -0.652 0 CA-C-O 117.801 -1.095 . . . . 0.0 112.809 174.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mm -53.26 -48.93 54.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 CA-C-N 120.867 1.667 . . . . 0.0 110.763 173.098 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 89.3 mt -61.88 -42.39 99.01 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 118.538 -0.744 . . . . 0.0 111.44 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -77.19 -26.26 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -179.2 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.82 -31.67 59.49 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.289 1.436 . . . . 0.0 111.056 173.376 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 tp -65.1 -45.11 86.54 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 116.567 -1.682 . . . . 0.0 111.882 169.269 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 mt -47.59 -45.3 27.2 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.58 1.952 . . . . 0.0 113.677 -178.007 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -98.3 -1.81 40.95 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 125.97 1.708 . . . . 0.0 113.193 177.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -107.7 -76.52 0.98 Allowed Glycine 0 C--N 1.341 0.85 0 C-N-CA 126.561 2.029 . . . . 0.0 113.636 -174.438 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.2 m 36.45 34.7 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 C-N-CA 127.576 2.351 . . . . 0.0 115.362 -169.165 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.56 -62.33 1.61 Allowed 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.247 -0.908 . . . . 0.0 112.814 -172.095 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -164.63 155.89 13.34 Favored Pre-proline 0 N--CA 1.476 0.835 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -169.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -57.79 129.88 35.72 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.075 1.85 . . . . 0.0 108.682 169.349 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.17 -2.67 83.77 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 117.486 -1.73 . . . . 0.0 114.312 -173.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.86 -36.08 78.26 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 120.828 2.314 . . . . 0.0 110.323 169.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.96 -19.67 63.02 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.601 1.161 . . . . 0.0 112.221 179.231 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.59 -25.58 68.3 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 118.393 0.542 . . . . 0.0 111.839 178.117 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.08 -54.76 5.48 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.98 0.912 . . . . 0.0 111.377 169.583 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -55.01 -26.38 36.65 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.436 HD12 HG22 ' A' ' 51' ' ' VAL . 57.0 mt -108.39 -12.79 14.98 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.26 1.424 . . . . 0.0 113.432 -176.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.45 6.11 32.82 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 124.202 0.906 . . . . 0.0 113.935 -171.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 57.5 mt -108.1 138.8 43.75 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.399 1.08 . . . . 0.0 111.39 -169.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.7 t -60.37 151.63 27.4 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.654 0.74 . . . . 0.0 112.324 -173.28 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -50.53 -35.91 31.76 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.374 1.469 . . . . 0.0 113.484 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.03 -45.74 80.37 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.373 1.069 . . . . 0.0 111.944 175.077 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -66.55 -45.5 79.19 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.36 -0.837 . . . . 0.0 111.569 175.497 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.436 HG22 HD12 ' A' ' 44' ' ' LEU . 2.6 t -63.39 -28.6 45.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 O-C-N 120.748 -1.22 . . . . 0.0 112.153 175.661 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.8 m -63.51 -41.53 98.51 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.007 0.821 . . . . 0.0 112.726 171.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -59.48 -34.03 72.06 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.912 0.885 . . . . 0.0 112.463 172.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -70.69 -45.75 64.42 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 121.105 -0.997 . . . . 0.0 112.849 172.009 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 83.2 mt -69.76 -18.58 63.51 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.312 1.445 . . . . 0.0 113.81 176.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 t -57.2 -55.56 33.13 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.97 1.259 . . . . 0.0 111.303 -178.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 16.0 t -69.6 -34.63 74.37 Favored 'General case' 0 C--O 1.219 -0.537 0 O-C-N 121.749 -0.594 . . . . 0.0 111.858 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.502 HD13 ' HG2' ' A' ' 23' ' ' ARG . 4.3 tp -64.76 -37.36 87.35 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.994 0.918 . . . . 0.0 112.514 -176.237 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.42 ' HG2' HG23 ' A' ' 64' ' ' VAL . 88.5 mtm180 -85.16 -30.4 23.97 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.884 1.273 . . . . 0.0 110.979 175.091 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.61 -44.55 81.78 Favored Glycine 0 N--CA 1.474 1.195 0 C-N-CA 123.915 0.769 . . . . 0.0 112.532 176.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 20.6 m -72.95 -10.2 59.55 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.376 1.47 . . . . 0.0 112.816 169.112 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.71 2.59 61.12 Favored Glycine 0 CA--C 1.533 1.187 0 O-C-N 120.531 -1.356 . . . . 0.0 115.127 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.5 mt -53.94 -25.94 23.0 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 120.092 1.946 . . . . 0.0 113.391 173.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.42 HG23 ' HG2' ' A' ' 59' ' ' ARG . 2.9 m -124.47 141.92 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.833 1.653 . . . . 0.0 113.881 169.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 65.6 t -133.92 137.8 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 126.186 1.795 . . . . 0.0 110.508 -175.059 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.468 ' HB2' ' CE1' ' A' ' 75' ' ' TYR . . . -91.28 154.43 19.26 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 174.77 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.8 m -143.06 135.34 27.26 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.332 1.853 . . . . 0.0 110.065 -173.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -79.63 105.36 10.87 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.827 0.851 . . . . 0.0 112.333 169.343 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.402 ' CG ' ' HD3' ' A' ' 74' ' ' ARG . 76.2 mm-40 -83.59 174.34 10.64 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.555 1.142 . . . . 0.0 110.76 167.169 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -69.57 24.16 0.38 Allowed Glycine 0 N--CA 1.481 1.649 0 N-CA-C 117.891 1.916 . . . . 0.0 117.891 -168.733 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.82 -14.04 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 128.174 2.59 . . . . 0.0 113.913 179.024 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -140.77 171.37 14.19 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 126.777 2.031 . . . . 0.0 108.191 -175.691 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 34.2 m -118.06 148.14 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 123.581 0.752 . . . . 0.0 109.004 170.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.402 ' HD3' ' CG ' ' A' ' 69' ' ' GLU . 9.2 ptt85 -117.21 -178.73 3.52 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.319 0.648 . . . . 0.0 112.499 174.728 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.468 ' CE1' ' HB2' ' A' ' 66' ' ' ALA . 12.0 m-85 -131.34 131.23 43.59 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.068 1.747 . . . . 0.0 106.886 166.004 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.88 163.73 25.7 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.673 1.589 . . . . 0.0 110.284 176.227 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.8 mp -59.3 146.25 40.23 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.763 0.825 . . . . 0.0 109.564 169.211 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -47.64 -40.86 20.76 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.808 1.243 . . . . 0.0 114.048 -178.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -167.92 167.24 12.97 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.737 1.615 . . . . 0.0 111.401 176.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -35.61 -35.79 0.06 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 130.399 3.479 . . . . 0.0 112.228 165.334 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -44.05 -61.23 1.54 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 126.587 1.955 . . . . 0.0 113.059 169.233 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.6 mt -74.75 -29.85 61.28 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.345 0.975 . . . . 0.0 110.24 -176.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.54 -26.83 68.88 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.633 -1.175 . . . . 0.0 111.69 178.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -67.67 -71.78 0.19 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 120.117 1.326 . . . . 0.0 111.688 172.375 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.48 -41.79 90.58 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.451 1.023 . . . . 0.0 112.262 -169.761 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.94 -35.42 74.52 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.846 1.259 . . . . 0.0 111.745 175.03 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.42 -45.6 94.57 Favored Glycine 0 CA--C 1.527 0.837 0 C-N-CA 126.064 1.792 . . . . 0.0 113.571 173.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . 0.328 16.4 pt-20 -85.25 21.12 1.78 Allowed 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.629 1.172 . . . . 0.0 112.953 169.655 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 33.9 tp 77.75 -43.71 0.4 Allowed 'General case' 0 N--CA 1.474 0.769 1 C-N-CA 131.856 4.062 . . . . 0.0 113.986 166.512 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.365 5.2 t 145.3 5.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.286 1 C-N-CA 134.787 5.235 . . . . 0.0 110.412 168.966 . . . . . . . . 3 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 87.47 -25.34 0.09 Allowed 'General case' 0 C--O 1.217 -0.658 0 O-C-N 120.119 -1.613 . . . . 0.0 111.115 137.478 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.32 48.1 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 130.391 3.476 . . . . 0.0 111.217 166.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER 68.54 -32.68 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 131.635 3.974 . . . . 0.0 115.145 175.668 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 50.1 tp 132.86 86.36 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.108 1 C-N-CA 132.417 4.287 . . . . 0.0 106.851 -167.57 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.22 16.22 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 118.708 2.855 . . . . 0.0 118.708 -168.501 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER 68.7 128.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 129.785 3.234 . . . . 0.0 114.508 176.2 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -72.8 2.52 6.54 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 127.333 2.253 . . . . 0.0 114.09 173.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 34.6 p -80.67 170.89 15.72 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.856 1.662 . . . . 0.0 111.446 172.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -134.61 126.69 29.7 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 165.592 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 48.1 mm-40 -151.05 170.06 8.35 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 126.968 2.107 . . . . 0.0 108.696 -167.501 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -73.6 -171.77 0.92 Allowed 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.657 2.238 . . . . 0.0 109.534 166.237 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 51.7 t . . . . . 0 CA--C 1.545 0.781 0 CA-C-O 123.352 1.548 . . . . 0.0 113.028 -177.945 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 pp . . . . . 0 N--CA 1.473 0.702 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.62 -25.55 68.01 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.398 1.079 . . . . 0.0 113.082 -178.207 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 15.9 mmt180 -84.0 -41.75 16.93 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.736 0.814 . . . . 0.0 110.498 176.022 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -57.95 -48.53 79.68 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.326 0.65 . . . . 0.0 111.523 177.009 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.75 -28.2 62.68 Favored Glycine 0 CA--C 1.533 1.165 0 CA-C-N 119.005 0.821 . . . . 0.0 113.046 -178.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -87.22 -21.53 25.79 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-O 118.028 -0.987 . . . . 0.0 113.651 171.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.45 -29.28 64.68 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 121.584 1.993 . . . . 0.0 112.205 172.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.2 mp -84.11 -44.74 13.73 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 118.089 -0.958 . . . . 0.0 110.489 169.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.68 66.68 5.23 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-O 122.804 1.288 . . . . 0.0 111.467 169.209 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -136.15 139.74 30.95 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 128.318 2.647 . . . . 0.0 109.242 -175.009 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -55.23 -79.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 125.179 3.92 . . . . 0.0 111.811 -171.012 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.88 -30.84 69.43 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 117.355 -1.307 . . . . 0.0 111.486 -178.046 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 64.5 mtt85 -72.95 -37.35 67.15 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 121.299 1.863 . . . . 0.0 112.715 -177.018 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 36.5 t -54.3 -48.69 71.0 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 121.438 1.926 . . . . 0.0 110.301 168.336 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 73.8 mmt-85 -58.59 -54.12 50.68 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.022 0.929 . . . . 0.0 112.949 175.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mm -49.78 -50.21 18.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 C-N-CA 125.939 1.696 . . . . 0.0 111.67 172.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 96.3 mt -65.56 -41.61 92.78 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.597 -175.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 p -78.08 -28.4 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 CA-C-N 119.102 0.865 . . . . 0.0 112.562 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.72 -31.73 69.9 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.494 1.118 . . . . 0.0 111.627 170.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.412 ' O ' HG13 ' B' ' 34' ' ' VAL . 3.6 tp -63.58 -45.51 90.12 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 117.087 -1.435 . . . . 0.0 112.466 169.434 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.1 mt -47.63 -45.62 27.93 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 127.311 2.244 . . . . 0.0 113.856 -176.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -106.9 18.1 22.26 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 126.171 1.789 . . . . 0.0 112.317 179.294 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.67 -75.07 0.23 Allowed Glycine 0 N--CA 1.47 0.937 0 C-N-CA 125.94 1.734 . . . . 0.0 113.554 -175.713 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 34' ' ' VAL . . . . . 0.588 ' HB ' ' HE ' ' B' ' 74' ' ' ARG . 26.7 m 36.71 34.61 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 127.047 2.139 . . . . 0.0 116.477 -171.343 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.6 -59.58 2.39 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 -171.335 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 36' ' ' TYR . . . . . 0.417 ' HA ' ' HA ' ' B' ' 74' ' ' ARG . 7.7 p90 -165.89 156.59 11.68 Favored Pre-proline 0 N--CA 1.473 0.684 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -170.17 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -57.51 129.97 36.57 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.209 1.939 . . . . 0.0 108.684 169.344 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.98 -0.83 81.94 Favored Glycine 0 CA--C 1.532 1.103 0 CA-C-O 117.252 -1.86 . . . . 0.0 114.559 -173.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.1 -37.56 83.17 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 121.045 2.422 . . . . 0.0 109.818 169.546 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mt -60.59 -21.07 62.22 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 124.673 1.189 . . . . 0.0 111.948 179.156 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.75 -27.59 69.3 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.787 -0.57 . . . . 0.0 112.149 178.118 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.23 -52.53 7.62 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.177 0.991 . . . . 0.0 111.474 170.159 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 9.4 m170 -54.88 -27.55 43.64 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 53.1 mt -108.29 -14.92 14.59 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.967 1.307 . . . . 0.0 113.961 -174.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.57 5.26 49.67 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.309 0.957 . . . . 0.0 114.107 -170.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 75.7 mt -105.03 137.51 42.67 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.653 1.181 . . . . 0.0 111.309 -171.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 12.6 t -60.84 152.03 28.3 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.513 -0.742 . . . . 0.0 112.16 -173.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -50.45 -42.68 54.5 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.983 1.313 . . . . 0.0 112.81 -178.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 1.5 m -64.3 -38.95 92.85 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.138 -0.977 . . . . 0.0 112.547 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -70.48 -45.83 64.92 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.256 0.623 . . . . 0.0 111.308 174.274 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.2 t -63.13 -31.23 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 O-C-N 120.981 -1.075 . . . . 0.0 111.694 176.378 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 39.2 m -56.67 -44.39 81.36 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.956 1.253 . . . . 0.0 113.056 169.765 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -60.74 -28.13 68.46 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.228 0.922 . . . . 0.0 112.869 176.234 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -78.52 -41.76 31.38 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.878 -1.139 . . . . 0.0 112.616 173.056 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 89.5 mt -72.28 -17.64 61.86 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.747 1.219 . . . . 0.0 114.064 174.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.3 t -58.97 -58.54 8.18 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.449 1.022 . . . . 0.0 111.601 -177.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 9.1 t -64.59 -39.27 93.43 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.714 -0.616 . . . . 0.0 111.415 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 tp -55.8 -48.43 75.4 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.917 2.487 . . . . 0.0 113.1 -177.769 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -80.5 -12.53 59.53 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.118 0.967 . . . . 0.0 111.859 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -82.36 -47.05 6.23 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.205 0.907 . . . . 0.0 111.307 169.478 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 59.8 m -67.95 -3.26 9.37 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 127.358 2.263 . . . . 0.0 114.414 174.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 62.47 22.82 64.04 Favored Glycine 0 N--CA 1.471 0.999 0 CA-C-N 119.852 1.205 . . . . 0.0 114.006 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 85.1 mt -69.5 -24.32 63.74 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.188 1.494 . . . . 0.0 112.761 171.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 1.5 m -146.82 140.57 20.12 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 C-N-CA 126.223 1.809 . . . . 0.0 111.328 -169.559 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 9.3 t -138.25 140.64 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 O-C-N 124.115 0.884 . . . . 0.0 110.22 -169.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.94 147.74 26.1 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.852 1.261 . . . . 0.0 113.261 174.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 45.4 m -138.15 135.55 35.81 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.892 1.677 . . . . 0.0 109.544 -177.227 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -79.26 120.83 24.29 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 123.977 0.798 . . . . 0.0 110.525 168.725 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -106.05 173.73 6.19 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.003 1.721 . . . . 0.0 109.5 175.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -68.36 23.79 0.27 Allowed Glycine 0 N--CA 1.481 1.649 0 N-CA-C 118.366 2.107 . . . . 0.0 118.366 -168.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 170.15 -9.61 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 128.929 2.891 . . . . 0.0 114.076 177.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -142.77 172.89 12.08 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.169 1.788 . . . . 0.0 108.524 -177.362 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 35.6 m -116.39 148.02 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 169.121 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 74' ' ' ARG . . . . . 0.588 ' HE ' ' HB ' ' B' ' 34' ' ' VAL . 0.0 OUTLIER -122.38 -179.32 4.15 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.541 0.686 . . . . 0.0 111.871 178.558 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -128.88 136.27 50.2 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 166.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 76' ' ' ALA . . . . . 0.437 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -134.6 161.59 34.67 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 124.6 1.16 . . . . 0.0 109.445 177.299 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.27 148.89 49.19 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 167.685 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.96 -27.97 69.2 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 115.873 1.805 . . . . 0.0 115.873 -169.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -172.94 162.42 4.69 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.234 1.813 . . . . 0.0 112.286 177.114 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.3 m -33.84 -38.57 0.06 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 129.524 3.13 . . . . 0.0 112.885 164.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -50.06 -58.15 6.12 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.588 1.955 . . . . 0.0 113.161 173.176 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 14.3 mt -72.66 -38.15 67.72 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.878 -1.139 . . . . 0.0 110.668 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -56.18 -31.37 63.35 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.975 1.31 . . . . 0.0 112.999 176.424 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -66.89 -66.24 0.58 Allowed 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 120.25 1.386 . . . . 0.0 111.5 171.103 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.48 -41.33 76.41 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.146 0.979 . . . . 0.0 112.527 -173.066 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -78.12 -32.47 50.46 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.27 1.828 . . . . 0.0 111.717 176.726 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.91 -45.59 91.99 Favored Glycine 0 N--CA 1.469 0.849 0 C-N-CA 125.637 1.589 . . . . 0.0 112.205 177.092 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . 0.313 19.6 pt-20 -92.05 20.0 6.26 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 167.748 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 89' ' ' LEU . . . . . 0.551 ' O ' HG13 ' B' ' 90' ' ' VAL . 24.8 tp 70.79 -42.87 0.54 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 131.057 3.743 . . . . 0.0 115.692 167.522 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 90' ' ' VAL . . . . . 0.551 HG13 ' O ' ' B' ' 89' ' ' LEU . 2.6 m 168.38 -21.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.956 1 C-N-CA 131.928 4.091 . . . . 0.0 110.581 -171.372 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 71.04 -15.73 0.39 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.454 2.302 . . . . 0.0 114.276 174.442 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.505 HG13 ' O ' ' B' ' 92' ' ' VAL . 3.6 p -59.21 37.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 129.408 3.083 . . . . 0.0 115.51 170.589 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 80.38 -24.6 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 C-N-CA 127.909 2.484 . . . . 0.0 112.682 175.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 56.0 tp 117.05 95.04 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 131.347 3.859 . . . . 0.0 105.919 -167.263 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.665 0 O-C-N 121.422 -0.799 . . . . 0.0 108.891 171.801 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 25.9 tp . . . . . 0 N--CA 1.474 0.746 0 CA-C-O 120.253 0.073 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.81 -3.51 12.68 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 66.5 mtt-85 -124.46 -38.44 2.41 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.06 1.344 . . . . 0.0 111.265 178.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.431 ' C ' HD13 ' A' ' 14' ' ' LEU . 1.8 tm? -50.9 -58.2 6.59 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.784 1.633 . . . . 0.0 107.941 166.865 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.12 -22.7 77.39 Favored Glycine 0 C--O 1.218 -0.856 0 CA-C-O 118.392 -1.227 . . . . 0.0 111.627 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.438 HH11 ' HG3' ' A' ' 16' ' ' ARG . 2.6 ttm-85 -68.75 -39.31 80.38 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 119.514 1.657 . . . . 0.0 111.688 171.57 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.88 -35.3 79.71 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.072 -1.018 . . . . 0.0 111.658 175.637 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.27 6.9 mp -87.53 10.42 17.85 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 123.536 0.734 . . . . 0.0 111.639 171.533 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -111.55 2.23 17.27 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 126.105 1.762 . . . . 0.0 113.52 166.76 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.418 ' CG ' ' HE ' ' A' ' 23' ' ' ARG . 7.4 t70 -105.07 136.3 19.19 Favored Pre-proline 0 CA--C 1.538 0.511 0 C-N-CA 126.08 1.752 . . . . 0.0 109.904 -172.012 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.433 ' HG2' ' H ' ' A' ' 22' ' ' THR . 55.2 Cg_endo -55.86 -62.94 0.21 Allowed 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 125.226 3.951 . . . . 0.0 111.201 -172.367 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.433 ' H ' ' HG2' ' A' ' 21' ' ' PRO . 85.3 m -62.6 -44.12 97.11 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 117.558 -1.211 . . . . 0.0 109.832 -174.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.418 ' HE ' ' CG ' ' A' ' 20' ' ' ASP . 30.1 mtm180 -68.51 -38.39 80.9 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 117.128 -1.415 . . . . 0.0 112.491 -175.862 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 88.1 m -57.97 -50.0 74.88 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 120.244 1.384 . . . . 0.0 111.02 170.255 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.3 ttm180 -62.54 -37.45 86.14 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 118.758 -0.639 . . . . 0.0 112.266 177.049 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.4 mt -54.04 -61.63 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 C-N-CA 125.059 1.344 . . . . 0.0 110.055 169.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 92.3 mt -56.15 -41.15 74.94 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.811 0.844 . . . . 0.0 111.501 -169.224 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.2 p -77.52 -32.43 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 175.542 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.79 -30.27 68.82 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 119.29 0.95 . . . . 0.0 112.507 174.3 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.512 ' O ' HG13 ' A' ' 34' ' ' VAL . 7.0 tp -64.47 -43.46 94.16 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 121.094 -1.004 . . . . 0.0 112.244 177.628 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -44.28 -36.11 2.61 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.958 2.903 . . . . 0.0 113.916 174.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -90.9 -41.08 11.36 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.3 1.84 . . . . 0.0 112.723 176.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.38 -69.93 1.3 Allowed Glycine 0 C--N 1.337 0.587 0 C-N-CA 124.026 0.822 . . . . 0.0 112.449 -168.181 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.577 HG12 ' HA ' ' A' ' 76' ' ' ALA . 16.3 m 37.88 33.23 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 125.371 1.469 . . . . 0.0 114.692 -167.425 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -83.91 -64.46 1.16 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.016 -1.053 . . . . 0.0 112.177 -171.375 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -156.97 157.11 30.53 Favored Pre-proline 0 N--CA 1.473 0.688 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -169.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -58.98 118.97 5.95 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.24 1.96 . . . . 0.0 108.52 171.477 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 90.68 1.46 73.97 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 117.335 -1.814 . . . . 0.0 114.936 -175.263 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.47 -35.83 78.74 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 121.184 2.492 . . . . 0.0 110.468 169.429 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 33.7 mt -54.45 -22.53 12.95 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 126.135 1.774 . . . . 0.0 112.077 174.685 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.86 -27.26 69.05 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.348 -1.47 . . . . 0.0 112.2 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.54 -57.09 4.01 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 118.203 0.456 . . . . 0.0 110.267 169.675 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 29.7 m170 -54.57 -31.0 55.9 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 -177.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 37.5 mt -103.05 -2.67 27.12 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.968 1.307 . . . . 0.0 113.417 -175.691 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.24 7.83 20.76 Favored Glycine 0 CA--C 1.535 1.324 0 CA-C-N 118.968 0.804 . . . . 0.0 114.441 -175.367 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 36.2 mt -107.25 160.19 15.78 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.61 1.164 . . . . 0.0 112.91 -171.304 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.564 HG23 ' H ' ' A' ' 50' ' ' ASN . 1.2 t -62.49 144.54 55.88 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.124 -0.985 . . . . 0.0 111.768 170.686 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -55.46 -29.21 58.28 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 127.007 2.123 . . . . 0.0 111.602 175.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 29.8 p -72.03 -57.33 4.37 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.431 -0.793 . . . . 0.0 111.739 169.104 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.564 ' H ' HG23 ' A' ' 47' ' ' THR . 14.8 t30 -66.09 -26.43 67.47 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 120.075 -1.641 . . . . 0.0 113.94 -175.341 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 75.9 t -66.54 -35.47 74.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 CA-C-N 120.402 1.456 . . . . 0.0 111.439 167.856 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.9 p -77.11 -22.29 52.94 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.697 -1.252 . . . . 0.0 114.137 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 -39.64 -44.94 1.58 Allowed 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 126.239 1.815 . . . . 0.0 111.198 167.536 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . 0.264 11.6 m-70 -104.33 -11.02 17.39 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -173.641 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 80.7 mt -71.64 -21.63 61.8 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.735 -1.228 . . . . 0.0 112.695 168.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.6 t -50.96 -42.59 60.01 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.576 1.08 . . . . 0.0 113.809 178.624 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 48.4 t -89.85 -32.15 17.03 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 118.79 0.723 . . . . 0.0 111.771 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 tp -56.58 -40.36 75.11 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.79 0.836 . . . . 0.0 111.311 176.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -78.32 -16.43 57.73 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 175.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -88.69 -56.19 2.03 Favored Glycine 0 N--CA 1.47 0.954 0 C-N-CA 125.931 1.729 . . . . 0.0 111.883 -177.32 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 52.0 m -64.27 -6.66 7.29 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 125.309 1.444 . . . . 0.0 111.942 168.052 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.49 6.62 84.52 Favored Glycine 0 C--N 1.341 0.849 0 C-N-CA 124.979 1.276 . . . . 0.0 114.176 171.254 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.7 mt -48.41 -28.73 3.42 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.262 1.425 . . . . 0.0 113.15 170.32 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.7 m -132.12 143.73 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 126.173 1.789 . . . . 0.0 112.23 173.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 45.4 t -126.5 143.3 40.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 127.154 2.182 . . . . 0.0 110.047 -175.662 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -89.54 154.03 20.32 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.111 1.364 . . . . 0.0 113.795 173.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.4 m -163.01 161.59 25.55 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.702 1.601 . . . . 0.0 108.471 -174.009 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.422 ' HA ' ' HA ' ' A' ' 73' ' ' VAL . 17.4 m-85 -80.47 156.63 26.49 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 119.672 1.124 . . . . 0.0 113.05 169.265 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -115.41 -152.5 0.5 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.04 1.336 . . . . 0.0 108.825 166.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.02 -22.19 60.07 Favored Glycine 0 CA--C 1.537 1.414 0 CA-C-N 121.01 1.732 . . . . 0.0 115.156 -175.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.74 -23.34 0.08 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.708 1.203 . . . . 0.0 113.871 169.397 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -95.14 -170.24 2.15 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.484 1.914 . . . . 0.0 109.982 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' A' ' 68' ' ' TYR . 35.1 m -109.9 166.09 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 124.61 1.164 . . . . 0.0 109.959 169.282 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.0 ptt180 -140.8 171.04 14.64 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 128.178 2.591 . . . . 0.0 110.319 -170.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -124.03 139.05 54.32 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.88 1.272 . . . . 0.0 108.008 167.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.577 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -131.98 161.4 33.22 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 126.314 1.846 . . . . 0.0 109.547 175.743 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.0 mt -60.77 159.53 10.87 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 118.732 0.696 . . . . 0.0 110.248 169.086 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -42.49 -44.37 4.05 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.436 1.494 . . . . 0.0 114.334 -176.603 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.411 ' CG ' ' H ' ' A' ' 80' ' ' SER . 17.4 t70 -177.55 -172.35 0.36 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 129.491 3.116 . . . . 0.0 109.576 169.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.411 ' H ' ' CG ' ' A' ' 79' ' ' ASP . 14.3 t -53.37 -20.92 5.0 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 127.32 2.248 . . . . 0.0 113.396 174.185 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -46.92 87.76 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.224 1.009 . . . . 0.0 111.692 176.406 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 8.8 mt -86.52 -31.99 20.98 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.193 0.906 . . . . 0.0 111.202 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.58 -28.6 65.69 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.036 0.835 . . . . 0.0 112.893 170.303 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.9 mmt180 -69.33 -65.68 0.68 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.256 1.422 . . . . 0.0 112.002 169.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.83 -19.54 64.18 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -175.09 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.34 -38.82 14.82 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.6 -1.312 . . . . 0.0 111.949 167.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.47 -52.71 20.16 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 126.361 1.934 . . . . 0.0 114.372 -177.086 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.26 -6.89 56.32 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.562 1.181 . . . . 0.0 112.56 169.462 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 18.8 tp 77.79 128.47 0.05 OUTLIER 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 129.393 3.077 . . . . 0.0 113.201 167.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.415 ' HB ' HG22 ' A' ' 92' ' ' VAL . 2.4 m -34.13 -21.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 131.129 3.771 . . . . 0.0 116.532 170.029 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 76.57 -9.9 1.41 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.287 1.835 . . . . 0.0 114.063 165.533 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.415 HG22 ' HB ' ' A' ' 90' ' ' VAL . 17.3 m -64.57 57.44 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.717 1 C-N-CA 132.497 4.319 . . . . 0.0 112.159 169.704 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . 0.396 0.5 OUTLIER 19.04 44.86 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.424 -1.762 0 CA-C-N 108.581 -3.918 . . . . 0.0 116.272 -162.805 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 50.8 tp 61.29 83.91 0.14 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.851 2.061 . . . . 0.0 111.674 -169.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.69 85.76 0.05 OUTLIER 'General case' 0 CA--C 1.55 0.948 0 O-C-N 121.057 -1.027 . . . . 0.0 111.712 170.398 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 89.9 t -59.04 153.94 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 127.829 2.452 . . . . 0.0 111.199 169.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -42.96 1.79 0.0 OUTLIER 'General case' 0 CA--C 1.565 1.524 1 C-N-CA 131.727 4.011 . . . . 0.0 117.162 169.885 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -97.17 146.82 24.7 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 128.23 2.612 . . . . 0.0 116.501 -169.42 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -89.21 73.29 8.11 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.967 1.707 . . . . 0.0 109.759 167.012 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -65.64 146.91 98.95 Favored Pre-proline 0 CA--C 1.549 0.907 0 O-C-N 120.845 -1.16 . . . . 0.0 109.93 169.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.67 97.17 0.78 Allowed 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.477 2.785 . . . . 0.0 112.746 -178.078 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.557 1.24 0 C-N-CA 129.452 3.101 . . . . 0.0 116.155 -178.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 19.0 tp . . . . . 0 N--CA 1.472 0.675 0 CA-C-O 120.504 0.192 . . . . 0.0 110.691 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.48 -3.07 3.87 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 116.416 2.006 . . . . 0.0 116.416 178.107 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 66.2 mtt-85 -124.29 -42.21 2.13 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.004 1.321 . . . . 0.0 110.757 -179.393 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.425 HD13 ' C ' ' B' ' 14' ' ' LEU . 0.9 OUTLIER -53.73 -52.89 58.67 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.94 1.696 . . . . 0.0 108.763 168.283 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.52 -23.19 78.34 Favored Glycine 0 C--O 1.222 -0.649 0 CA-C-O 118.645 -1.086 . . . . 0.0 111.392 -178.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.402 HH11 ' HG3' ' B' ' 16' ' ' ARG . 2.1 ttm-85 -68.37 -44.51 75.04 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.214 1.507 . . . . 0.0 110.515 168.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.99 -30.13 70.63 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.987 0.812 . . . . 0.0 112.511 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 5.9 mp -93.42 9.56 35.97 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 124.335 1.054 . . . . 0.0 113.095 169.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -111.6 1.63 16.91 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.625 1.57 . . . . 0.0 112.16 165.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -75.19 146.3 81.61 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 126.034 1.734 . . . . 0.0 112.371 -169.213 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -59.31 -19.3 49.92 Favored 'Trans proline' 0 C--N 1.349 0.571 1 C-N-CA 125.479 4.119 . . . . 0.0 116.073 179.706 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -143.09 -30.57 0.51 Allowed 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.121 -176.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.584 ' HG2' HD13 ' B' ' 58' ' ' LEU . 0.0 OUTLIER -61.11 -30.6 70.46 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.359 1.436 . . . . 0.0 112.744 176.974 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 88.0 m -53.4 -52.76 58.32 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.581 1.152 . . . . 0.0 111.134 168.018 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 12.5 ttm180 -61.53 -43.19 99.31 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.274 1.03 . . . . 0.0 112.413 173.288 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 26' ' ' ILE . . . . . 0.648 HG12 HD11 ' B' ' 44' ' ' LEU . 2.5 mt -51.36 -57.65 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 C-N-CA 124.734 1.214 . . . . 0.0 110.839 174.109 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 86.4 mt -55.81 -44.34 77.75 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.501 1.12 . . . . 0.0 111.817 -175.267 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 8.8 p -76.45 -31.41 20.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 CA-C-N 119.373 0.988 . . . . 0.0 113.1 178.187 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.13 -31.51 66.07 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.716 -0.615 . . . . 0.0 111.985 174.666 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' B' ' 30' ' ' LEU . 10.7 tp -60.64 -41.27 94.6 Favored 'General case' 0 C--N 1.341 0.221 0 O-C-N 120.924 -1.11 . . . . 0.0 112.828 178.366 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -43.33 -36.74 1.98 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 129.377 3.071 . . . . 0.0 113.423 173.17 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -90.33 -34.17 15.81 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.447 1.899 . . . . 0.0 112.697 178.881 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -93.38 -68.27 1.09 Allowed Glycine 0 C--N 1.338 0.676 0 C-N-CA 123.706 0.669 . . . . 0.0 114.105 -168.87 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 34' ' ' VAL . . . . . 0.409 HG12 ' HA ' ' B' ' 76' ' ' ALA . 31.2 m 36.78 33.98 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 C-N-CA 126.47 1.908 . . . . 0.0 115.311 -167.242 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.04 -63.6 1.35 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.456 -0.778 . . . . 0.0 113.064 -169.022 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 36' ' ' TYR . . . . . 0.41 ' HA ' ' HA ' ' B' ' 74' ' ' ARG . 6.0 p90 -161.1 161.31 24.0 Favored Pre-proline 0 C--O 1.24 0.59 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 -169.392 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -58.65 127.16 23.52 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.288 1.992 . . . . 0.0 107.601 167.883 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.47 2.93 90.7 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-O 117.321 -1.822 . . . . 0.0 114.782 -175.231 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 3.7 pp0? -62.8 -41.07 99.12 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 121.279 2.539 . . . . 0.0 110.394 169.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 29.7 mt -54.66 -19.07 5.38 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 125.647 1.579 . . . . 0.0 112.958 176.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.89 -32.47 67.74 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.571 1.078 . . . . 0.0 112.553 172.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.81 -51.29 11.61 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.286 0.634 . . . . 0.0 111.96 170.825 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 34.2 m170 -56.03 -24.29 38.37 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.997 1.481 . . . . 0.0 114.997 179.344 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.648 HD11 HG12 ' B' ' 26' ' ' ILE . 56.4 mt -112.29 -4.16 14.39 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.845 1.658 . . . . 0.0 113.277 -177.067 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 61.05 7.81 9.62 Favored Glycine 0 CA--C 1.536 1.377 0 CA-C-O 119.013 -0.881 . . . . 0.0 114.818 -172.425 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 16.2 mt -102.04 162.44 12.91 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.703 1.601 . . . . 0.0 113.067 -169.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.494 HG23 ' H ' ' B' ' 50' ' ' ASN . 1.5 t -61.57 138.5 58.3 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 121.237 -0.914 . . . . 0.0 111.24 172.416 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 66.7 mtt180 -49.93 -31.62 12.84 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.561 1.945 . . . . 0.0 111.936 173.305 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 60.7 p -72.47 -52.39 15.99 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 118.664 0.665 . . . . 0.0 112.724 173.578 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 50' ' ' ASN . . . . . 0.494 ' H ' HG23 ' B' ' 47' ' ' THR . 44.2 t30 -69.5 -25.57 64.12 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 120.662 1.573 . . . . 0.0 113.259 -179.476 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 51' ' ' VAL . . . . . 0.543 HG22 HD12 ' B' ' 44' ' ' LEU . 37.2 t -61.1 -51.87 68.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 O-C-N 121.514 -0.741 . . . . 0.0 109.436 167.36 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 78.0 p -75.77 -27.56 58.09 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 115.741 1.756 . . . . 0.0 115.741 -176.235 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -36.86 -56.15 0.87 Allowed 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 123.984 1.85 . . . . 0.0 109.895 168.181 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 27.4 m-70 -90.43 -4.33 57.08 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -178.389 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 86.9 mt -72.19 -16.64 61.96 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.73 -1.231 . . . . 0.0 108.979 164.289 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 21.3 t -49.92 -42.11 47.5 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.911 1.232 . . . . 0.0 112.64 168.43 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 7.2 t -84.34 -44.84 13.4 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 119.478 1.035 . . . . 0.0 112.03 178.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 58' ' ' LEU . . . . . 0.584 HD13 ' HG2' ' B' ' 23' ' ' ARG . 6.9 tp -56.71 -34.61 67.64 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.382 0.673 . . . . 0.0 111.683 -176.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 38.3 mtm105 -81.68 -31.46 32.23 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.121 0.968 . . . . 0.0 113.551 174.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.5 -50.14 39.67 Favored Glycine 0 N--CA 1.473 1.116 0 CA-C-N 119.253 0.933 . . . . 0.0 111.931 177.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 56.9 m -65.95 -0.63 2.43 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 125.737 1.615 . . . . 0.0 113.115 172.013 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.04 -8.78 10.82 Favored Glycine 0 C--N 1.342 0.863 0 C-N-CA 125.67 1.605 . . . . 0.0 114.88 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 20.7 mt -52.33 -28.12 18.05 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.819 1.647 . . . . 0.0 113.59 -176.193 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.414 HG12 ' CD2' ' B' ' 30' ' ' LEU . 3.0 m -125.98 141.64 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 126.624 1.97 . . . . 0.0 112.036 167.715 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 64.7 t -132.58 141.73 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 127.376 2.27 . . . . 0.0 109.557 -174.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.67 164.43 22.83 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.971 1.309 . . . . 0.0 113.175 178.415 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.44 ' HB ' ' HG2' ' B' ' 74' ' ' ARG . 0.2 OUTLIER -165.89 173.1 10.88 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.325 1.05 . . . . 0.0 108.671 178.896 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -94.9 157.15 16.04 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.21 0.604 . . . . 0.0 110.196 164.474 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -120.92 -151.03 0.47 Allowed 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.282 1.433 . . . . 0.0 109.321 167.523 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.6 -24.61 59.91 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-N 120.719 1.599 . . . . 0.0 115.105 -174.574 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.79 -21.94 0.08 Allowed 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 118.628 1.214 . . . . 0.0 113.93 168.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -97.1 -174.21 2.9 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.307 1.843 . . . . 0.0 109.78 -178.432 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 34.6 m -105.46 162.02 4.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.514 1.125 . . . . 0.0 109.482 168.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 74' ' ' ARG . . . . . 0.44 ' HG2' ' HB ' ' B' ' 67' ' ' THR . 6.7 ptt180 -137.54 175.45 9.59 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 126.928 2.091 . . . . 0.0 111.039 -171.793 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -129.14 141.41 51.19 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.435 1.094 . . . . 0.0 109.032 166.592 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 76' ' ' ALA . . . . . 0.409 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -138.47 159.77 41.22 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 125.855 1.662 . . . . 0.0 110.113 178.299 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 50.0 mt -58.21 152.62 16.74 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 122.699 0.4 . . . . 0.0 111.362 172.025 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -46.89 -46.64 21.31 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.834 1.654 . . . . 0.0 114.01 -174.133 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -162.3 166.12 25.74 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 127.014 2.126 . . . . 0.0 108.58 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 8.0 t -52.12 -20.11 2.33 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.035 1.334 . . . . 0.0 113.322 168.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.54 -48.07 82.08 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.86 1.664 . . . . 0.0 113.428 170.609 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 18.2 mt -75.96 -35.37 59.69 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 119.578 1.081 . . . . 0.0 110.084 176.179 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.17 -28.59 66.75 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 118.848 0.749 . . . . 0.0 112.823 173.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 12.0 mmt180 -76.15 -64.31 1.13 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.679 1.591 . . . . 0.0 112.314 174.133 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.81 -22.46 64.18 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -178.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.35 -45.12 13.1 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.262 -0.899 . . . . 0.0 111.097 168.661 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.59 -49.21 45.4 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.895 1.712 . . . . 0.0 115.006 -173.647 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.9 -5.23 55.17 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.644 1.222 . . . . 0.0 112.292 169.345 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 17.9 tp 77.49 127.58 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 128.825 2.85 . . . . 0.0 113.294 168.347 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 90' ' ' VAL . . . . . 0.414 ' HB ' HG22 ' B' ' 92' ' ' VAL . 2.2 m -35.71 -19.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 131.234 3.814 . . . . 0.0 115.951 168.266 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 75.37 -7.48 1.77 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 127.272 2.229 . . . . 0.0 114.273 167.325 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.414 HG22 ' HB ' ' B' ' 90' ' ' VAL . 13.5 m -69.45 60.29 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.616 1 C-N-CA 131.715 4.006 . . . . 0.0 112.069 174.055 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.39 0.5 OUTLIER 21.79 38.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.425 -1.697 2 CA-C-N 107.302 -4.499 . . . . 0.0 116.461 -163.375 . . . . . . . . 4 3 . 1 . 017 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 37.8 tp 64.39 73.8 0.42 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.023 1.729 . . . . 0.0 111.511 -169.326 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.955 0 O-C-N 120.764 -1.21 . . . . 0.0 111.91 169.696 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.1 tt . . . . . 0 N--CA 1.471 0.579 0 CA-C-O 120.807 0.337 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.41 -9.28 32.25 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.2 mmp_? -96.2 -58.53 2.05 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.376 -0.828 . . . . 0.0 108.983 165.885 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.411 ' CD2' HD21 ' A' ' 63' ' ' LEU . 1.6 tm? -59.94 -54.49 45.5 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.246 1.418 . . . . 0.0 111.878 -173.12 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.91 -28.79 73.96 Favored Glycine 0 CA--C 1.528 0.864 0 O-C-N 121.647 -0.658 . . . . 0.0 113.015 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 54.8 ttt-85 -74.9 -26.93 60.0 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.119 0.967 . . . . 0.0 111.78 174.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -87.21 -3.92 59.08 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.293 1.037 . . . . 0.0 113.616 172.226 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.1 mt -99.42 -24.22 14.86 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.747 1.219 . . . . 0.0 110.857 168.367 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.38 82.78 3.17 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.205 1.402 . . . . 0.0 114.166 -174.032 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -150.82 154.26 34.49 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 125.743 1.617 . . . . 0.0 111.229 -176.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -57.74 -67.4 0.07 OUTLIER 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 124.103 3.202 . . . . 0.0 112.025 175.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 55.9 m -74.2 -43.71 56.13 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.386 1.074 . . . . 0.0 111.241 -177.012 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.535 ' CD ' HD13 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -60.17 -32.83 71.43 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 118.343 -0.837 . . . . 0.0 112.704 -175.486 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.5 t -56.54 -53.45 57.38 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.292 0.951 . . . . 0.0 111.072 168.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -57.76 -46.28 84.74 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.747 -0.596 . . . . 0.0 112.49 175.496 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.7 mt -45.33 -56.48 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-N 118.677 0.671 . . . . 0.0 110.075 173.298 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 27' ' ' LEU . 21.5 mt -65.77 -32.78 74.51 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -169.352 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.6 m -66.85 -34.63 71.24 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 CA-C-N 120.435 1.471 . . . . 0.0 111.62 170.21 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.52 -6.15 57.77 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.078 1.351 . . . . 0.0 113.766 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -80.5 -48.11 13.28 Favored 'General case' 0 CA--C 1.519 -0.242 0 C-N-CA 125.262 1.425 . . . . 0.0 109.219 -178.169 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.0 mt -48.38 -59.36 3.52 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.913 2.485 . . . . 0.0 110.873 172.329 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -85.95 26.67 0.97 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.636 1.575 . . . . 0.0 111.827 174.785 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.07 -87.28 0.7 Allowed Glycine 0 C--N 1.337 0.601 0 C-N-CA 125.469 1.509 . . . . 0.0 111.274 -173.406 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.467 HG12 ' HA ' ' A' ' 76' ' ' ALA . 26.9 m 36.6 22.5 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 N-CA-C 118.826 2.899 . . . . 0.0 118.826 -179.62 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 98.5 m -83.72 -67.08 0.82 Allowed 'General case' 0 N--CA 1.471 0.579 0 O-C-N 120.137 -1.602 . . . . 0.0 112.887 -177.613 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.4 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 45.4 p90 -156.57 162.15 28.11 Favored Pre-proline 0 CA--C 1.544 0.749 0 O-C-N 121.25 -0.906 . . . . 0.0 113.015 -172.283 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -56.79 109.98 0.52 Allowed 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.607 2.871 . . . . 0.0 111.304 175.357 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 90.99 7.75 65.62 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-O 117.464 -1.742 . . . . 0.0 115.532 -175.193 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.4 ' HG2' ' H ' ' A' ' 36' ' ' TYR . 5.0 pp0? -59.66 -37.22 78.15 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 120.582 2.191 . . . . 0.0 110.564 168.799 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 20.3 mt -50.76 -26.21 5.34 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 126.054 1.741 . . . . 0.0 112.562 173.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.64 -36.95 77.4 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.895 -0.574 . . . . 0.0 112.253 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -42.58 62.33 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.233 0.469 . . . . 0.0 111.527 175.233 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.4 m-70 -60.13 -32.58 71.15 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 176.482 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 16.8 mt -105.6 -21.28 13.23 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -172.133 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.79 2.51 64.98 Favored Glycine 0 CA--C 1.536 1.374 0 CA-C-N 119.323 0.965 . . . . 0.0 114.331 -171.212 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -98.13 142.28 30.02 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.282 1.433 . . . . 0.0 109.759 175.447 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.8 p -61.4 150.94 33.79 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.136 -0.977 . . . . 0.0 111.853 -173.352 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -59.43 -19.83 50.39 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 175.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -78.17 -46.25 21.04 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 118.937 0.79 . . . . 0.0 110.981 171.655 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -65.73 -45.08 83.99 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.363 1.065 . . . . 0.0 112.552 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 80.9 t -61.22 -39.17 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 CA-C-N 118.53 0.604 . . . . 0.0 111.504 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 69.6 m -66.26 -26.46 67.36 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -178.704 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -51.32 -37.27 46.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.902 1.281 . . . . 0.0 111.727 170.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -90.34 -12.38 37.86 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 176.202 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 95.0 mt -81.23 -27.71 35.14 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 117.922 -1.037 . . . . 0.0 111.675 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.42 -37.47 83.62 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 121.0 1.727 . . . . 0.0 113.467 -177.76 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 51.5 t -86.48 -15.33 40.47 Favored 'General case' 0 CA--C 1.558 1.265 0 O-C-N 120.827 -1.171 . . . . 0.0 111.718 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.535 HD13 ' CD ' ' A' ' 23' ' ' ARG . 7.4 tp -68.11 -41.79 81.23 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 119.579 -1.95 . . . . 0.0 108.895 167.756 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 45.5 mtm180 -78.44 -13.51 59.81 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.066 1.746 . . . . 0.0 112.292 176.765 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -96.07 -57.38 1.15 Allowed Glycine 0 N--CA 1.47 0.901 0 C-N-CA 125.97 1.748 . . . . 0.0 111.659 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.7 m -74.48 23.63 0.09 Allowed 'General case' 0 CA--C 1.566 1.58 0 C-N-CA 125.098 1.359 . . . . 0.0 112.854 173.124 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 59.2 28.73 64.61 Favored Glycine 0 N--CA 1.476 1.313 0 C-N-CA 127.152 2.31 . . . . 0.0 117.482 167.062 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.411 HD21 ' CD2' ' A' ' 14' ' ' LEU . 70.6 mt -82.21 -30.14 31.02 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.187 0.995 . . . . 0.0 113.324 177.225 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.0 m -133.33 144.93 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.951 1.7 . . . . 0.0 111.092 -178.221 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 72.0 t -129.09 139.95 50.51 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 126.295 1.838 . . . . 0.0 109.179 -175.655 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.94 142.92 52.83 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.577 1.151 . . . . 0.0 112.267 172.616 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 16.8 m -155.58 155.38 33.24 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.438 1.095 . . . . 0.0 108.233 176.785 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.23 125.71 31.25 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 119.379 0.99 . . . . 0.0 109.144 167.896 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.42 -16.32 63.87 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.525 1.057 . . . . 0.0 113.525 175.174 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 154.71 -32.89 0.68 Allowed Glycine 0 CA--C 1.531 1.087 0 C-N-CA 126.804 2.145 . . . . 0.0 112.153 -179.056 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.48 -21.45 0.2 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.346 1.458 . . . . 0.0 113.376 172.8 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -104.59 169.26 8.56 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.393 2.277 . . . . 0.0 110.028 174.109 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 10.0 p -92.58 145.52 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.621 0.768 . . . . 0.0 110.948 173.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -131.27 164.4 25.67 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.139 1.775 . . . . 0.0 110.855 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -115.93 120.02 37.83 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.265 1.026 . . . . 0.0 108.547 167.417 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.467 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -121.76 155.37 35.42 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 118.59 0.632 . . . . 0.0 112.191 175.641 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 tp -52.82 140.71 23.42 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.855 1.262 . . . . 0.0 109.626 173.453 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.57 -31.55 72.66 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -171.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -164.79 179.56 6.46 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 -178.292 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 20.1 m -55.89 -33.03 64.24 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.088 1.755 . . . . 0.0 114.208 171.382 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -68.74 -45.02 72.56 Favored 'General case' 0 C--N 1.344 0.333 0 CA-C-N 119.926 1.239 . . . . 0.0 112.467 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.9 mt -69.94 -40.65 75.37 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 120.13 1.332 . . . . 0.0 109.881 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.9 -35.15 75.92 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.455 0.702 . . . . 0.0 109.877 -178.671 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -71.95 -50.2 31.02 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 126.377 1.871 . . . . 0.0 112.649 172.08 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.94 -46.63 77.48 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 121.115 1.779 . . . . 0.0 111.593 -177.266 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.4 -51.27 70.22 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.715 0.806 . . . . 0.0 109.647 171.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -79.99 21.69 4.71 Favored Glycine 0 CA--C 1.537 1.462 0 C-N-CA 126.465 1.983 . . . . 0.0 114.699 -179.562 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 23.5 tp10 -101.8 -65.49 0.98 Allowed 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 126.427 1.891 . . . . 0.0 108.782 167.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 7.7 tp 165.85 -29.34 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.95 1.7 . . . . 0.0 112.021 -167.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.293 22.9 t 58.39 11.59 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 127.514 2.326 . . . . 0.0 111.837 -166.22 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.467 ' C ' ' H ' ' A' ' 93' ' ' VAL . 1.8 tp-100 88.01 -19.32 0.23 Allowed 'General case' 0 C--O 1.218 -0.575 0 O-C-N 120.315 -1.49 . . . . 0.0 109.452 135.813 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.9 p -75.01 37.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 127.338 2.255 . . . . 0.0 110.268 163.387 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.467 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.6 t 71.19 -8.9 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 C-N-CA 127.776 2.43 . . . . 0.0 114.106 174.597 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 99.02 102.75 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 131.112 3.765 . . . . 0.0 107.865 -169.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.13 137.6 58.23 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.251 1.821 . . . . 0.0 115.179 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 25.4 m -74.97 162.39 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 126.53 1.932 . . . . 0.0 113.906 171.245 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.03 -41.13 97.53 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 128.738 2.815 . . . . 0.0 115.235 178.669 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 23.6 p -71.26 76.77 0.72 Allowed 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.767 1.167 . . . . 0.0 111.007 170.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . 0.267 1.8 p-10 -71.43 80.3 0.77 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 123.799 1.762 . . . . 0.0 109.473 169.178 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -61.2 138.42 94.45 Favored Pre-proline 0 CA--C 1.545 0.762 0 CA-C-N 114.205 -1.362 . . . . 0.0 109.894 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.76 160.49 49.52 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 123.97 3.114 . . . . 0.0 116.077 -166.662 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 8.1 t . . . . . 0 C--N 1.347 0.476 0 C-N-CA 125.721 1.608 . . . . 0.0 111.303 -169.114 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 tt . . . . . 0 N--CA 1.473 0.709 0 CA-C-O 120.637 0.256 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.28 -11.36 30.97 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 178.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 13.0 mmp_? -98.2 -56.2 2.55 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.227 1.011 . . . . 0.0 109.663 167.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -60.49 -51.58 68.84 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.369 1.468 . . . . 0.0 111.618 -173.517 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.97 -34.1 89.0 Favored Glycine 0 CA--C 1.529 0.952 0 C-N-CA 124.094 0.854 . . . . 0.0 112.976 175.724 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -70.19 -36.58 74.73 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.208 1.004 . . . . 0.0 111.109 175.786 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.3 -24.65 60.43 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.971 0.908 . . . . 0.0 112.745 175.159 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 11.7 mt -77.89 -29.87 50.48 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.414 1.086 . . . . 0.0 111.387 168.666 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -99.93 50.37 0.91 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.465 1.506 . . . . 0.0 114.436 -171.361 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -114.87 149.72 42.9 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 127.21 2.204 . . . . 0.0 108.593 174.37 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -61.48 -52.84 2.78 Favored 'Trans proline' 0 CA--C 1.534 0.485 0 C-N-CA 124.317 3.345 . . . . 0.0 111.888 -171.091 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.437 ' HB ' ' CD2' ' B' ' 54' ' ' HIS . 15.9 m -76.6 -41.63 45.43 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 117.866 -1.064 . . . . 0.0 110.759 177.124 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 22.3 mtm180 -59.51 -36.9 76.98 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 120.177 1.353 . . . . 0.0 112.963 -176.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 53.8 t -48.79 -55.92 10.17 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.547 0.739 . . . . 0.0 110.37 169.11 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 25' ' ' ARG . . . . . 0.493 ' HB3' HD22 ' B' ' 44' ' ' LEU . 7.9 mpt_? -57.93 -51.86 67.9 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 118.502 -0.761 . . . . 0.0 113.027 172.827 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 3.8 mt -44.7 -55.69 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 CA-C-N 119.387 0.994 . . . . 0.0 109.6 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 29.2 mt -64.26 -38.11 89.87 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 116.701 -1.618 . . . . 0.0 114.374 -169.576 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -65.92 -35.44 75.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 CA-C-N 120.88 1.673 . . . . 0.0 111.296 172.155 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.58 -13.44 56.54 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.793 1.237 . . . . 0.0 113.821 179.156 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.45 -47.08 28.84 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.045 0.938 . . . . 0.0 109.748 -175.279 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 mt -48.46 -48.35 37.66 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 128.735 2.814 . . . . 0.0 112.382 172.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -94.79 18.81 11.06 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.052 1.741 . . . . 0.0 111.968 175.493 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.73 -85.46 1.08 Allowed Glycine 0 C--O 1.222 -0.609 0 C-N-CA 125.343 1.449 . . . . 0.0 111.16 -172.11 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 34' ' ' VAL . . . . . 0.461 HG12 ' HA ' ' B' ' 76' ' ' ALA . 11.5 m 32.15 27.57 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 N-CA-C 118.761 2.874 . . . . 0.0 118.761 -174.769 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 73.1 m -81.82 -75.99 0.27 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 120.941 1.7 . . . . 0.0 111.497 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -155.72 166.52 16.13 Favored Pre-proline 0 CA--C 1.55 0.968 0 O-C-N 120.55 -1.344 . . . . 0.0 113.052 -170.05 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.18 89.73 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 124.756 3.637 . . . . 0.0 113.017 177.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 123.83 -4.97 9.14 Favored Glycine 0 C--O 1.221 -0.67 0 CA-C-O 117.309 -1.828 . . . . 0.0 115.624 -176.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -57.75 -34.99 70.12 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 120.425 2.113 . . . . 0.0 112.426 175.563 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 23.2 mt -53.85 -22.68 10.32 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 124.669 1.188 . . . . 0.0 112.445 177.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.33 88.84 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 118.926 -0.559 . . . . 0.0 111.938 -177.401 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.3 -34.86 65.96 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 122.999 0.52 . . . . 0.0 112.02 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 5.4 m-70 -65.54 -27.61 68.57 Favored 'General case' 0 CA--C 1.553 1.067 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 174.022 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.493 HD22 ' HB3' ' B' ' 25' ' ' ARG . 15.1 mt -114.7 -20.39 10.68 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.684 1.364 . . . . 0.0 114.684 -170.029 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.94 -2.1 61.19 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 125.204 1.383 . . . . 0.0 114.417 -171.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -93.96 143.72 26.1 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.693 1.197 . . . . 0.0 110.113 176.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.4 p -61.52 149.99 37.21 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 121.14 -0.975 . . . . 0.0 111.175 -177.057 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -60.8 -19.25 59.17 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 174.086 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 6.5 t -77.24 -37.66 52.74 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 118.752 0.705 . . . . 0.0 112.185 170.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -74.68 -47.91 29.03 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.751 0.821 . . . . 0.0 111.424 175.221 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 63.2 t -58.92 -38.1 71.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-N 119.643 1.11 . . . . 0.0 111.803 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 55.5 m -66.6 -21.52 66.13 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -56.38 -51.19 69.24 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 122.947 1.356 . . . . 0.0 109.835 174.873 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 54' ' ' HIS . . . . . 0.437 ' CD2' ' HB ' ' B' ' 22' ' ' THR . 55.4 m-70 -73.84 -8.92 57.89 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 172.911 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 95.6 mt -83.25 -22.69 33.0 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 117.358 -1.306 . . . . 0.0 112.285 173.465 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.34 -37.81 81.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 121.201 1.819 . . . . 0.0 112.627 178.243 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 48.5 t -91.06 -13.74 32.61 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 118.129 0.422 . . . . 0.0 111.32 176.568 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 4.9 tp -70.34 -42.99 71.14 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 119.461 -2.024 . . . . 0.0 109.286 167.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 37.1 mtm105 -83.07 -5.98 59.31 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.966 1.706 . . . . 0.0 112.519 174.584 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.22 -65.11 1.12 Allowed Glycine 0 C--N 1.336 0.536 0 N-CA-C 109.409 -1.477 . . . . 0.0 109.409 174.512 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 60.6 m -72.22 26.43 0.05 Allowed 'General case' 0 CA--C 1.564 1.482 0 C-N-CA 126.517 1.927 . . . . 0.0 113.287 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.95 20.76 58.07 Favored Glycine 0 N--CA 1.474 1.18 0 C-N-CA 127.515 2.483 . . . . 0.0 117.409 167.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 60.4 mt -77.65 -35.9 52.06 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.885 0.874 . . . . 0.0 113.205 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 1.7 m -126.64 142.07 44.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 126.273 1.829 . . . . 0.0 111.225 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 54.6 t -123.76 138.31 53.94 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 127.068 2.147 . . . . 0.0 108.85 -178.093 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.06 139.99 38.0 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 123.976 0.91 . . . . 0.0 111.317 176.339 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 41.1 m -152.48 159.58 43.33 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.584 1.554 . . . . 0.0 107.128 -174.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -87.86 135.69 33.28 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.497 1.499 . . . . 0.0 112.246 169.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -78.13 45.2 0.53 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.269 1.428 . . . . 0.0 109.808 167.457 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 76.51 -46.5 2.27 Favored Glycine 0 CA--C 1.534 1.262 0 O-C-N 120.204 -1.56 . . . . 0.0 113.011 -169.654 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -126.37 -46.43 1.62 Allowed 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.725 1.263 . . . . 0.0 114.073 -173.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -97.9 175.49 6.12 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.896 1.225 . . . . 0.0 110.504 173.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 14.9 p -93.34 141.29 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.255 1.022 . . . . 0.0 111.26 174.376 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 29.4 ptt180 -125.38 163.11 23.31 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 127.477 2.311 . . . . 0.0 110.853 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -113.19 118.82 35.76 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.993 0.917 . . . . 0.0 108.728 168.03 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 76' ' ' ALA . . . . . 0.461 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -119.09 152.26 36.8 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.077 0.951 . . . . 0.0 111.355 178.243 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 tp -52.77 141.69 20.69 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.95 0.9 . . . . 0.0 109.989 171.351 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.54 -32.28 72.1 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -172.466 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -164.94 176.1 8.95 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 22.5 m -52.23 -31.66 33.22 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.104 1.762 . . . . 0.0 114.501 171.374 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 7.9 m-70 -72.19 -44.37 63.1 Favored 'General case' 0 C--N 1.345 0.37 0 CA-C-O 117.286 -1.34 . . . . 0.0 112.822 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 9.5 mt -69.13 -40.28 78.38 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 120.665 1.575 . . . . 0.0 109.701 174.288 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.23 -38.7 84.19 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.612 0.765 . . . . 0.0 109.874 -179.185 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 4.8 tpm_? -71.36 -50.13 35.3 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.571 1.549 . . . . 0.0 112.776 171.069 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.61 -44.36 86.76 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 121.589 1.995 . . . . 0.0 111.657 -173.57 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.67 -53.26 58.48 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.616 1.167 . . . . 0.0 109.45 170.545 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.46 -7.86 83.25 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.175 1.369 . . . . 0.0 115.63 -172.448 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 28.1 tp10 -69.07 -63.51 1.05 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 126.387 1.875 . . . . 0.0 109.016 169.799 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 10.7 tp 163.22 -26.59 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.838 2.055 . . . . 0.0 113.232 -170.128 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . 0.305 42.1 t 58.17 11.97 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 126.827 2.051 . . . . 0.0 111.935 -164.065 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 91' ' ' GLN . . . . . 0.432 ' C ' ' H ' ' B' ' 93' ' ' VAL . 3.0 tp-100 86.34 -23.06 0.15 Allowed 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 125.136 1.374 . . . . 0.0 110.818 135.613 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.6 p -69.01 33.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 C-N-CA 129.068 2.947 . . . . 0.0 112.444 168.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 93' ' ' VAL . . . . . 0.432 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.3 OUTLIER 67.88 11.56 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 126.966 2.106 . . . . 0.0 113.402 176.0 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 tt 91.97 101.23 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 130.228 3.411 . . . . 0.0 109.709 -176.039 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.802 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -178.715 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.47 0.562 0 CA-C-O 118.698 -0.668 . . . . 0.0 111.482 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.82 -44.15 90.8 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.652 1.115 . . . . 0.0 112.569 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -64.58 -61.21 2.35 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.704 -0.622 . . . . 0.0 111.312 172.776 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -52.67 63.99 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.757 1.623 . . . . 0.0 110.272 -171.307 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.63 -32.49 71.01 Favored Glycine 0 CA--C 1.529 0.942 0 CA-C-O 118.672 -1.071 . . . . 0.0 113.411 -170.793 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -33.87 66.18 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.412 1.606 . . . . 0.0 111.19 175.062 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.13 -31.25 71.57 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 118.648 0.658 . . . . 0.0 111.754 176.184 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.7 mp -84.48 -30.31 25.31 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 118.567 -0.73 . . . . 0.0 111.496 174.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.12 60.65 1.05 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.374 1.47 . . . . 0.0 113.961 171.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -153.26 155.14 31.59 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 124.663 1.185 . . . . 0.0 109.042 174.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -59.76 -95.24 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.76 1 C-N-CA 126.156 4.571 . . . . 0.0 113.733 -166.528 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.6 p -44.92 -30.09 0.94 Allowed 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 127.386 2.274 . . . . 0.0 113.436 169.569 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.3 ttm105 -73.74 -43.16 59.89 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.076 0.853 . . . . 0.0 112.407 -175.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 8.2 t -54.21 -51.96 62.77 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.547 0.739 . . . . 0.0 109.346 166.474 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -52.17 -50.78 61.15 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.35 1.06 . . . . 0.0 113.2 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.7 mm -50.76 -48.12 28.19 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 124.049 0.94 . . . . 0.0 111.736 174.358 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 77.4 mt -65.22 -48.23 74.06 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 118.726 0.694 . . . . 0.0 112.278 -176.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.1 p -69.42 -27.42 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 123.483 0.713 . . . . 0.0 112.301 179.018 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.21 -38.46 66.08 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.75 0.82 . . . . 0.0 111.697 169.408 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.527 ' O ' HG13 ' A' ' 34' ' ' VAL . 3.3 tp -64.61 -28.75 69.84 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 120.308 1.413 . . . . 0.0 114.569 -175.746 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 mt -42.32 -30.02 0.29 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.88 1.672 . . . . 0.0 112.614 169.313 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -110.74 -32.43 6.86 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 126.987 2.115 . . . . 0.0 111.446 167.11 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.22 8.06 34.01 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 128.711 3.053 . . . . 0.0 116.034 -166.484 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.574 HG12 ' HA ' ' A' ' 76' ' ' ALA . 23.5 m -58.87 26.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.029 0 C-N-CA 127.215 2.206 . . . . 0.0 116.583 168.252 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 73.6 m -82.44 -81.86 0.15 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.425 1.09 . . . . 0.0 111.464 172.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.23 156.54 78.01 Favored Pre-proline 0 N--CA 1.47 0.568 0 CA-C-O 118.11 -0.948 . . . . 0.0 111.461 -172.112 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -56.92 -36.31 99.01 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.035 2.49 . . . . 0.0 113.448 -174.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -85.3 1.52 88.52 Favored Glycine 0 CA--C 1.533 1.217 0 CA-C-O 118.554 -1.137 . . . . 0.0 115.327 177.238 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.29 -30.4 66.22 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.807 1.804 . . . . 0.0 113.28 -170.223 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mt -60.3 -16.9 38.66 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.091 0.557 . . . . 0.0 111.81 -179.36 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.32 -36.87 76.42 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.812 0.845 . . . . 0.0 111.702 175.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -51.73 16.57 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.01 0.924 . . . . 0.0 111.313 175.043 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -55.94 -33.35 64.66 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 21.7 mt -105.37 -15.68 14.96 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -174.439 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.75 11.19 68.86 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-N 119.657 1.117 . . . . 0.0 114.035 -170.606 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.9 mp -95.11 155.63 16.65 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 117.996 0.898 . . . . 0.0 112.492 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.7 p -64.84 151.81 44.51 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.245 0.618 . . . . 0.0 110.308 170.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -40.84 81.58 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.941 -0.475 . . . . 0.0 111.148 176.612 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.1 m -63.38 -38.5 91.41 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.353 0.661 . . . . 0.0 112.219 176.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 44.4 t-20 -70.99 -49.26 47.23 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.807 -0.558 . . . . 0.0 111.199 176.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 1.3 t -55.98 -35.88 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 120.338 -1.476 . . . . 0.0 112.765 172.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 72.0 m -66.69 -32.78 74.31 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -57.64 -38.63 75.35 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.759 0.708 . . . . 0.0 111.616 171.581 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 23.3 m80 -69.72 -39.5 76.8 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.396 -0.815 . . . . 0.0 112.577 175.486 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.8 mt -75.28 -12.92 60.38 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.771 0.828 . . . . 0.0 113.137 177.264 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.6 t -60.4 -55.36 34.52 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.404 1.002 . . . . 0.0 110.675 168.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.8 t -67.69 -39.67 84.43 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.326 -0.859 . . . . 0.0 111.739 177.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.4 tp -62.02 -37.69 85.86 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -175.326 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.422 ' HG2' HG23 ' A' ' 64' ' ' VAL . 45.0 mtm105 -82.46 -7.3 59.64 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.865 0.866 . . . . 0.0 111.9 177.091 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -102.13 -45.24 1.76 Allowed Glycine 0 CA--C 1.535 1.283 0 C-N-CA 126.036 1.779 . . . . 0.0 114.685 178.217 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 7.2 m -67.36 4.41 1.0 Allowed 'General case' 0 CA--C 1.563 1.447 0 C-N-CA 126.008 1.723 . . . . 0.0 112.229 168.102 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.97 21.21 78.24 Favored Glycine 0 C--N 1.343 0.955 0 C-N-CA 126.018 1.771 . . . . 0.0 114.36 170.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.1 mt -85.13 -22.92 28.65 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.121 1.368 . . . . 0.0 113.61 -174.508 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.422 HG23 ' HG2' ' A' ' 59' ' ' ARG . 2.4 m -137.28 147.4 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 C-N-CA 125.795 1.638 . . . . 0.0 111.286 -178.52 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 88.5 t -130.37 144.63 37.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.82 1.648 . . . . 0.0 109.849 -179.024 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.59 134.36 34.81 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.91 0.884 . . . . 0.0 111.769 172.663 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.9 166.6 24.34 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.483 0.713 . . . . 0.0 109.596 171.801 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -80.39 127.48 32.45 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 165.346 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.265 0.0 OUTLIER -78.73 -16.22 57.5 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 120.038 1.29 . . . . 0.0 114.313 171.706 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 130.65 -21.74 4.71 Favored Glycine 0 N--CA 1.477 1.4 0 C-N-CA 125.602 1.572 . . . . 0.0 113.987 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.1 -19.78 1.49 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.558 2.743 . . . . 0.0 112.62 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 -148.28 173.14 13.32 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 129.564 3.146 . . . . 0.0 111.071 -177.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 14.1 p -88.97 145.13 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 167.336 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 -126.98 165.83 18.68 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.978 1.711 . . . . 0.0 111.224 -179.469 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 17.2 m-30 -112.49 120.75 42.71 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 164.333 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.574 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -121.44 154.36 36.66 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.932 1.293 . . . . 0.0 109.819 -178.299 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 81.6 mt -57.58 151.01 17.85 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.994 0.815 . . . . 0.0 110.226 169.732 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.51 -37.21 75.12 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 -168.328 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -162.18 167.8 23.52 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 126.288 1.835 . . . . 0.0 109.064 175.366 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 51.1 m -44.76 -32.16 1.44 Allowed 'General case' 0 C--O 1.214 -0.775 0 CA-C-O 117.604 -1.189 . . . . 0.0 110.998 167.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -37.58 -65.03 0.34 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.702 1.601 . . . . 0.0 114.026 169.017 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 15.3 mt -73.46 -41.0 63.72 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.749 1.613 . . . . 0.0 110.826 -176.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.67 -26.55 65.64 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 177.197 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -79.22 -59.79 2.63 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 126.793 2.037 . . . . 0.0 109.469 178.198 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.88 -37.72 85.6 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.83 -42.9 85.04 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.74 -0.6 . . . . 0.0 109.483 169.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.51 -34.17 73.3 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 126.296 1.903 . . . . 0.0 117.043 -174.878 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.77 -11.97 59.91 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 121.533 2.666 . . . . 0.0 112.261 167.669 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 41.2 tp 64.08 113.33 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 127.85 2.46 . . . . 0.0 109.225 -174.002 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 19.3 m -66.61 26.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 126.281 1.832 . . . . 0.0 114.907 -175.333 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.438 ' C ' ' H ' ' A' ' 93' ' ' VAL . 39.2 mm-40 79.98 -2.96 2.01 Favored 'General case' 0 N--CA 1.442 -0.856 0 O-C-N 119.911 -1.743 . . . . 0.0 111.271 157.371 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 13.5 p -60.63 31.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 131.153 3.781 . . . . 0.0 113.871 166.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.438 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.3 t 56.87 18.96 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 127.987 2.515 . . . . 0.0 113.99 169.572 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 tt 99.59 105.74 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 129.891 3.276 . . . . 0.0 107.099 -169.285 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.29 61.5 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.992 2.117 . . . . 0.0 116.078 -176.313 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.5 t -64.35 152.51 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 125.165 1.386 . . . . 0.0 108.427 167.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.93 -72.45 0.38 Allowed 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.796 1.638 . . . . 0.0 113.186 178.21 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.1 p 70.91 144.36 0.06 Allowed 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 129.596 3.158 . . . . 0.0 115.13 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -90.93 131.94 36.25 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 163.058 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -168.32 138.43 2.06 Favored Pre-proline 0 CA--C 1.541 0.597 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.46 -179.43 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -69.55 166.27 27.89 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 122.676 2.251 . . . . 0.0 111.626 174.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 5.7 t . . . . . 0 CA--C 1.553 1.061 0 C-N-CA 126.582 1.953 . . . . 0.0 111.151 -176.653 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.532 0.283 0 CA-C-O 118.05 -0.976 . . . . 0.0 112.645 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.75 -56.18 17.51 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.999 1.272 . . . . 0.0 111.752 171.051 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -59.03 -58.95 6.41 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.802 0.841 . . . . 0.0 111.828 175.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.72 -52.52 56.66 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 125.869 1.668 . . . . 0.0 109.945 -172.398 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.59 -39.25 96.62 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-O 118.358 -1.246 . . . . 0.0 112.247 -175.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -37.59 79.77 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.123 1.461 . . . . 0.0 110.923 174.131 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.86 -16.43 60.68 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 178.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 10.3 mp -90.62 -32.73 16.13 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 118.962 0.801 . . . . 0.0 110.031 168.266 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -74.85 56.0 0.71 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.392 1.877 . . . . 0.0 113.633 169.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -146.63 135.15 10.94 Favored Pre-proline 0 CA--C 1.544 0.714 0 C-N-CA 125.419 1.488 . . . . 0.0 107.167 178.475 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -46.89 -70.01 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.803 1 C-N-CA 125.628 4.218 . . . . 0.0 113.525 -166.219 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 12.1 p -70.18 -16.49 63.08 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 117.849 -1.072 . . . . 0.0 112.59 -178.264 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.535 ' HG3' HD13 ' B' ' 58' ' ' LEU . 0.0 OUTLIER -72.16 -46.3 56.96 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 116.551 -1.69 . . . . 0.0 112.252 -176.486 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 38.0 t -45.99 -52.34 11.93 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.454 1.025 . . . . 0.0 110.404 169.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -61.01 -50.37 73.64 Favored 'General case' 0 C--O 1.225 -0.221 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 179.379 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 26' ' ' ILE . . . . . 0.437 HG13 HH22 ' B' ' 23' ' ' ARG . 5.2 mm -51.37 -56.99 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.841 1.2 . . . . 0.0 110.526 171.782 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 59.7 mt -62.17 -42.76 99.57 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 118.699 -0.667 . . . . 0.0 111.906 -169.673 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 6.3 p -73.23 -32.64 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 123.614 0.765 . . . . 0.0 112.69 177.605 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 29' ' ' ALA . . . . . 0.434 ' HB1' ' CD2' ' B' ' 43' ' ' HIS . . . -75.33 -31.6 60.65 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.409 0.55 . . . . 0.0 111.891 176.149 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.403 ' O ' HG13 ' B' ' 34' ' ' VAL . 7.8 tp -62.0 -40.83 96.99 Favored 'General case' 0 C--N 1.341 0.235 0 O-C-N 121.093 -1.004 . . . . 0.0 112.536 -178.344 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.76 -31.0 1.81 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 130.023 3.329 . . . . 0.0 114.383 172.297 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -100.99 -14.06 18.01 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 127.032 2.133 . . . . 0.0 112.626 -178.54 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -114.68 -71.91 0.53 Allowed Glycine 0 C--N 1.344 1.006 0 C-N-CA 124.87 1.224 . . . . 0.0 115.642 -169.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 34' ' ' VAL . . . . . 0.51 HG12 ' HA ' ' B' ' 76' ' ' ALA . 35.0 m 32.6 34.48 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 N-CA-C 117.314 2.339 . . . . 0.0 117.314 -169.004 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 68.6 m -82.9 -84.08 0.13 Allowed 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 125.975 1.71 . . . . 0.0 112.326 176.763 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 36' ' ' TYR . . . . . 0.405 ' H ' ' HB3' ' B' ' 39' ' ' GLN . 0.1 OUTLIER -130.72 163.31 49.53 Favored Pre-proline 0 CA--C 1.543 0.701 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -172.459 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -57.81 -42.2 61.65 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.336 2.024 . . . . 0.0 111.943 178.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -72.11 -1.83 50.69 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 117.955 -1.47 . . . . 0.0 114.645 174.197 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 39' ' ' GLN . . . . . 0.405 ' HB3' ' H ' ' B' ' 36' ' ' TYR . 5.8 pt20 -64.17 -51.5 63.52 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.533 1.666 . . . . 0.0 111.322 -177.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 5.3 mt -66.48 -28.57 68.68 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 118.77 0.714 . . . . 0.0 109.248 -174.417 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -75.06 23.96 0.1 Allowed 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 172.598 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -143.43 -45.39 0.28 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.385 2.674 . . . . 0.0 108.111 168.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 43' ' ' HIS . . . . . 0.434 ' CD2' ' HB1' ' B' ' 29' ' ' ALA . 0.3 OUTLIER -53.13 -29.55 31.71 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 126.323 1.849 . . . . 0.0 113.819 170.756 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.7 mt -101.61 -18.59 15.82 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 126.045 1.738 . . . . 0.0 113.323 175.836 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.27 -2.47 52.0 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 124.285 0.945 . . . . 0.0 114.667 -170.444 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mp -92.84 144.84 24.88 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.052 1.426 . . . . 0.0 110.383 -178.229 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 21.2 p -58.86 156.35 11.52 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.065 0.946 . . . . 0.0 113.544 -169.033 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -37.39 79.14 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 121.465 -0.772 . . . . 0.0 111.314 178.16 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 26.6 m -63.3 -47.08 83.8 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.754 0.822 . . . . 0.0 111.933 170.066 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -62.78 -50.43 71.05 Favored 'General case' 0 CA--C 1.546 0.795 0 O-C-N 121.038 -1.039 . . . . 0.0 112.375 178.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 3.9 t -67.8 -19.57 25.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 O-C-N 121.007 -1.058 . . . . 0.0 111.739 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 61.2 m -72.2 -46.61 55.52 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.496 1.498 . . . . 0.0 113.674 171.576 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -49.74 -46.91 50.89 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 123.644 1.687 . . . . 0.0 111.208 173.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -59.46 -55.08 39.21 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 113.134 -1.848 . . . . 0.0 113.783 170.441 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 52.5 mt -67.59 -14.99 63.41 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 120.003 -1.686 . . . . 0.0 112.78 -178.14 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.2 t -50.69 -50.96 53.68 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 119.452 1.024 . . . . 0.0 111.065 168.746 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.95 -21.19 31.88 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.821 1.191 . . . . 0.0 112.875 -171.414 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 58' ' ' LEU . . . . . 0.535 HD13 ' HG3' ' B' ' 23' ' ' ARG . 4.7 tp -73.02 -47.17 47.35 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 121.659 -0.651 . . . . 0.0 111.69 176.632 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 43.3 mtm180 -72.35 -26.4 61.9 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.786 0.834 . . . . 0.0 110.94 174.88 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.3 -46.32 12.83 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-O 119.292 -0.727 . . . . 0.0 113.745 176.215 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 54.1 m -75.8 -15.93 60.18 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 119.161 1.481 . . . . 0.0 113.772 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 107.65 9.36 28.91 Favored Glycine 0 C--N 1.344 0.992 0 C-N-CA 125.259 1.409 . . . . 0.0 115.622 169.125 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 3.1 mt -85.12 -17.26 37.82 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 120.006 1.903 . . . . 0.0 114.55 -169.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.73 143.09 42.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 126.455 1.902 . . . . 0.0 110.455 177.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 98.1 t -131.1 141.2 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.304 1.041 . . . . 0.0 110.024 -176.593 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.49 136.87 33.24 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.496 1.119 . . . . 0.0 112.144 173.58 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -142.15 166.22 25.31 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.113 0.965 . . . . 0.0 109.506 172.235 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -77.36 127.38 32.47 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 165.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.254 0.0 OUTLIER -75.15 -21.13 59.01 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 172.757 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 135.21 -19.44 3.86 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.781 1.658 . . . . 0.0 114.02 -177.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 5.1 tmt_? -142.63 -25.48 0.63 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 129.503 3.121 . . . . 0.0 111.608 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -138.66 179.39 6.51 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 127.557 2.343 . . . . 0.0 110.8 -177.252 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 14.8 p -91.1 145.16 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.943 0.897 . . . . 0.0 108.865 166.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 20.2 ptt180 -128.92 164.29 23.44 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 126.295 1.838 . . . . 0.0 110.093 176.449 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -108.0 149.21 28.68 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 106.005 -1.85 . . . . 0.0 106.005 162.475 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 76' ' ' ALA . . . . . 0.51 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -146.56 158.3 43.88 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 125.227 1.411 . . . . 0.0 108.571 176.786 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 62.3 mt -59.28 152.91 19.83 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.385 0.993 . . . . 0.0 109.32 167.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.79 -34.99 76.88 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -168.455 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -159.62 167.56 28.18 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 123.121 1.439 . . . . 0.0 110.292 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 14.7 m -50.28 -30.62 12.25 Favored 'General case' 0 C--O 1.22 -0.473 0 C-N-CA 125.601 1.56 . . . . 0.0 110.337 167.675 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -46.73 -65.52 0.55 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.118 1.367 . . . . 0.0 113.789 171.606 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 11.9 mt -67.68 -41.09 84.25 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 121.075 1.761 . . . . 0.0 111.036 -177.627 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.02 -24.09 65.9 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 177.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -80.03 -64.52 1.17 Allowed 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 124.982 1.313 . . . . 0.0 110.707 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.54 -34.9 77.84 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.112 1.152 . . . . 0.0 114.112 -178.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tt -65.32 -41.57 93.84 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 121.4 -0.813 . . . . 0.0 109.459 169.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.86 -40.14 95.37 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 126.709 2.099 . . . . 0.0 115.835 -175.328 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.06 -15.23 62.53 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 120.88 2.34 . . . . 0.0 112.9 169.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 43.2 tp 67.78 111.41 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 127.603 2.361 . . . . 0.0 109.834 -169.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 20.1 m -61.41 28.21 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 128.207 2.603 . . . . 0.0 115.232 174.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 81.87 -15.17 0.73 Allowed 'General case' 0 CA--C 1.535 0.394 0 O-C-N 119.768 -1.832 . . . . 0.0 113.077 156.499 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.3 p -56.14 31.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.098 1 C-N-CA 132.854 4.461 . . . . 0.0 115.649 168.172 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 2.0 t 56.71 26.27 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 128.15 2.58 . . . . 0.0 113.415 167.587 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 tt 80.42 106.47 0.07 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 127.51 2.324 . . . . 0.0 105.109 -167.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.554 1.098 0 C-N-CA 126.156 1.783 . . . . 0.0 115.695 -169.48 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 tm? . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.449 ' HA ' ' HB1' ' B' ' 19' ' ' ALA . . . -64.58 -14.9 59.9 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 175.558 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -93.03 -43.57 8.84 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.376 1.07 . . . . 0.0 111.991 172.601 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.684 ' CD1' HG21 ' B' ' 92' ' ' VAL . 3.4 tm? -62.89 -37.63 87.71 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.635 1.574 . . . . 0.0 112.417 -177.125 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.18 -23.23 52.14 Favored Glycine 0 CA--C 1.536 1.389 0 CA-C-N 120.034 1.288 . . . . 0.0 112.741 170.839 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.9 ttp85 -100.24 -0.43 38.62 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.903 1.446 . . . . 0.0 114.903 171.651 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -86.64 -35.66 19.24 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.918 1.235 . . . . 0.0 109.248 167.165 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.6 mp -70.65 -38.01 73.78 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 167.791 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -92.54 35.45 1.02 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 171.184 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.73 149.17 74.0 Favored Pre-proline 0 CA--C 1.542 0.664 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 165.513 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -41.79 -89.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.351 0.659 1 C-N-CA 126.495 4.797 . . . . 0.0 113.793 -167.257 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.52 -31.14 72.04 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 124.997 1.319 . . . . 0.0 111.066 175.416 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 54.5 mtm-85 -58.69 -33.76 70.52 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 119.547 1.067 . . . . 0.0 113.746 -177.39 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 49.3 t -58.64 -54.29 48.73 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.295 0.952 . . . . 0.0 110.694 172.446 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -72.01 -34.26 68.72 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.356 -0.84 . . . . 0.0 112.295 -179.436 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.5 mm -52.14 -46.39 43.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 124.61 1.164 . . . . 0.0 109.222 167.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 41.7 mt -64.71 -46.06 83.92 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 117.298 -1.334 . . . . 0.0 111.969 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.4 m -64.29 -35.23 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 CA-C-N 121.391 1.905 . . . . 0.0 112.235 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.37 -1.74 46.63 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.978 1.311 . . . . 0.0 113.483 177.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.54 -52.72 7.28 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 124.87 1.268 . . . . 0.0 108.533 169.201 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -44.47 -60.31 2.02 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.823 2.849 . . . . 0.0 114.015 -171.843 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -101.16 18.09 20.77 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 126.324 1.849 . . . . 0.0 111.279 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.574 ' HA3' HE22 ' A' ' 39' ' ' GLN . . . -109.44 -80.01 1.15 Allowed Glycine 0 C--N 1.337 0.635 0 C-N-CA 127.718 2.58 . . . . 0.0 111.164 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.4 m 36.93 28.72 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 116.405 2.002 . . . . 0.0 116.405 -177.228 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 31.5 m -83.57 -72.12 0.47 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 120.506 1.503 . . . . 0.0 113.588 -173.715 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.43 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -137.36 160.8 64.1 Favored Pre-proline 0 N--CA 1.471 0.621 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -178.234 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -60.94 113.22 1.63 Allowed 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.234 1.956 . . . . 0.0 108.76 171.42 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.35 -2.33 60.97 Favored Glycine 0 CA--C 1.538 1.508 0 CA-C-O 118.099 -1.389 . . . . 0.0 116.042 -173.498 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.574 HE22 ' HA3' ' A' ' 33' ' ' GLY . 2.5 pp0? -58.13 -20.1 37.76 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 120.579 2.189 . . . . 0.0 114.597 176.641 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.5 HD12 ' H ' ' A' ' 40' ' ' LEU . 1.8 mp -71.87 -9.16 57.93 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-O 118.758 -0.639 . . . . 0.0 112.327 176.218 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.96 -44.09 94.63 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.668 0.667 . . . . 0.0 111.688 177.571 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.7 -50.91 63.16 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 123.458 0.703 . . . . 0.0 110.684 172.631 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 -59.1 -27.62 65.74 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -177.226 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.9 mt -113.39 -22.39 10.41 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -173.377 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.44 -3.19 33.99 Favored Glycine 0 CA--C 1.535 1.301 0 CA-C-N 119.545 1.066 . . . . 0.0 114.337 -169.354 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -84.31 139.21 32.46 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.44 1.12 . . . . 0.0 109.803 175.16 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.403 HG23 ' H ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER -55.16 147.82 15.51 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.545 -0.722 . . . . 0.0 111.053 -179.373 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -48.78 -27.75 3.19 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.483 1.113 . . . . 0.0 113.057 169.536 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.2 m -69.03 -46.35 68.18 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.1 0.96 . . . . 0.0 111.62 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.403 ' H ' HG23 ' A' ' 47' ' ' THR . 29.1 t-20 -74.41 -39.35 62.69 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.119 0.872 . . . . 0.0 111.978 177.049 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.2 t -55.87 -48.43 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 118.621 -0.704 . . . . 0.0 110.57 169.296 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 39.2 m -64.88 -40.01 94.44 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 120.087 1.312 . . . . 0.0 113.073 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -56.08 -51.79 66.62 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.476 1.11 . . . . 0.0 111.675 176.361 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 -70.74 -28.51 64.76 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 120.595 -1.316 . . . . 0.0 113.506 177.769 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.9 mt -70.26 -30.07 67.01 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 117.933 -1.032 . . . . 0.0 112.751 172.351 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.1 p -49.52 -44.26 46.19 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.346 1.43 . . . . 0.0 113.259 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.5 t -70.51 -42.09 71.74 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.615 1.966 . . . . 0.0 112.873 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.1 tp -63.4 -29.54 70.82 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.927 1.691 . . . . 0.0 112.03 -177.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 56.1 mtm180 -83.67 -12.38 55.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.474 1.509 . . . . 0.0 113.651 172.287 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -97.17 -48.38 2.06 Favored Glycine 0 N--CA 1.474 1.21 0 C-N-CA 124.446 1.022 . . . . 0.0 111.13 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 69.1 m -68.49 10.62 0.23 Allowed 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 127.836 2.454 . . . . 0.0 114.142 170.146 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 63.48 14.5 54.62 Favored Glycine 0 N--CA 1.474 1.171 0 C-N-CA 126.581 2.038 . . . . 0.0 116.583 174.037 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 86.1 mt -75.7 -28.72 58.73 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 120.619 -1.518 . . . . 0.0 113.427 -179.147 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -134.05 135.12 55.14 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 125.757 1.623 . . . . 0.0 112.834 176.555 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 87.0 t -124.89 138.88 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 125.817 1.647 . . . . 0.0 109.235 -175.557 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.19 152.22 36.68 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 122.624 1.202 . . . . 0.0 112.9 178.118 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.2 m -160.4 163.21 33.3 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.769 1.627 . . . . 0.0 108.103 -170.254 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -85.87 148.32 25.85 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 119.125 0.875 . . . . 0.0 111.248 167.295 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.93 -14.39 41.98 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 121.35 -0.844 . . . . 0.0 111.745 167.62 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 138.21 -14.92 3.49 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 126.976 2.227 . . . . 0.0 113.628 -176.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 65.3 ttt-85 -157.49 -43.91 0.07 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.038 2.135 . . . . 0.0 111.861 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -101.33 179.33 4.39 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.408 1.883 . . . . 0.0 110.459 169.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 25.9 m -105.6 160.11 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 123.793 0.837 . . . . 0.0 112.484 171.148 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.8 ptt85 -142.88 170.28 15.98 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 129.397 3.079 . . . . 0.0 109.788 -172.778 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -110.9 120.36 42.14 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.358 1.063 . . . . 0.0 108.703 167.362 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -108.71 146.15 33.95 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.491 1.516 . . . . 0.0 111.159 174.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 tp -56.83 135.28 55.65 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 118.238 -0.886 . . . . 0.0 108.837 170.266 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.47 -42.34 70.56 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -170.565 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -154.35 159.28 41.09 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.849 1.66 . . . . 0.0 112.796 176.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.56 -36.98 0.12 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 130.797 3.639 . . . . 0.0 113.468 165.522 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -56.37 -48.3 77.12 Favored 'General case' 0 C--N 1.342 0.252 0 C-N-CA 126.178 1.791 . . . . 0.0 113.336 174.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 11.0 mt -69.59 -41.63 75.52 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 175.849 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.57 -37.99 76.94 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.974 1.309 . . . . 0.0 111.027 -175.411 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 -68.04 -55.42 12.65 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-O 117.538 -1.22 . . . . 0.0 112.177 173.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.41 -40.2 95.75 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 121.895 2.134 . . . . 0.0 112.753 -177.407 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.0 tp -61.54 -43.99 97.86 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.65 1.98 . . . . 0.0 112.664 170.549 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -78.55 -32.56 41.57 Favored Glycine 0 N--CA 1.478 1.442 0 C-N-CA 126.882 2.182 . . . . 0.0 114.301 -176.027 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -66.99 -6.12 15.61 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.538 1.135 . . . . 0.0 110.084 166.225 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 32.1 tp 78.56 -34.65 0.17 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 130.661 3.584 . . . . 0.0 112.794 167.177 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 153.37 -21.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.021 1 C-N-CA 134.012 4.925 . . . . 0.0 111.423 173.19 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 46.2 mm-40 71.24 -23.99 0.18 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.866 2.066 . . . . 0.0 114.428 -178.73 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.8 p -71.51 42.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 126.59 1.956 . . . . 0.0 115.135 -172.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER 63.28 17.73 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 C-N-CA 126.996 2.119 . . . . 0.0 112.504 177.183 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 62.4 mt 84.6 107.51 0.05 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 129.976 3.31 . . . . 0.0 109.693 -171.354 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.75 76.1 0.85 Allowed 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.089 -1.007 . . . . 0.0 110.002 169.413 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.0 t -44.74 149.09 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 127.487 2.315 . . . . 0.0 114.652 -169.216 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.62 25.75 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 128.532 2.733 . . . . 0.0 114.937 171.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 44.0 p -104.53 170.61 7.79 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.655 -1.278 . . . . 0.0 112.723 175.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -99.94 2.95 44.1 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 128.83 2.852 . . . . 0.0 113.842 -176.442 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -53.43 141.7 42.36 Favored Pre-proline 0 CA--C 1.556 1.192 0 N-CA-C 116.151 1.908 . . . . 0.0 116.151 -167.113 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -72.97 -168.97 0.45 Allowed 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 125.236 3.957 . . . . 0.0 111.489 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 49.6 t . . . . . 0 CA--C 1.548 0.874 0 O-C-N 120.429 -1.42 . . . . 0.0 111.881 175.331 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 tm? . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.68 -5.7 39.4 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.933 1.457 . . . . 0.0 114.933 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -86.08 -46.64 10.28 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 118.658 -0.687 . . . . 0.0 110.464 168.024 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.96 -41.37 99.51 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.368 0.985 . . . . 0.0 112.104 -168.857 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.8 -6.3 11.63 Favored Glycine 0 CA--C 1.542 1.774 0 CA-C-O 119.004 -0.887 . . . . 0.0 114.432 173.273 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 49.6 ttp85 -115.4 -3.68 12.41 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 127.187 2.195 . . . . 0.0 113.851 172.407 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -92.65 -27.96 16.97 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.478 1.511 . . . . 0.0 110.906 167.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 3.8 mp -79.18 -44.58 21.61 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 168.246 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.449 ' HB1' ' HA ' ' A' ' 12' ' ' ALA . . . -87.69 32.57 0.72 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 125.299 1.44 . . . . 0.0 114.619 171.807 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -64.17 151.94 89.25 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 126.924 2.09 . . . . 0.0 111.977 172.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -44.67 -36.27 10.17 Favored 'Trans proline' 0 C--N 1.357 0.987 1 C-N-CA 125.579 4.186 . . . . 0.0 114.718 177.7 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.45 ' HB ' HH21 ' B' ' 23' ' ' ARG . 5.6 m -130.18 -34.89 1.62 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.824 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.618 ' HG2' HD13 ' B' ' 58' ' ' LEU . 0.0 OUTLIER -60.28 -26.94 66.89 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 117.211 -1.376 . . . . 0.0 112.091 -179.742 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 42.3 t -55.13 -65.43 0.59 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 120.14 1.336 . . . . 0.0 112.193 168.582 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 17.4 ttm180 -68.65 -33.2 73.6 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.152 -0.968 . . . . 0.0 111.713 -177.286 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.1 mm -48.92 -55.03 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 O-C-N 121.049 -1.032 . . . . 0.0 109.053 168.543 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.416 HD22 HD11 ' B' ' 77' ' ' LEU . 56.6 mt -62.82 -36.44 83.17 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 116.798 -1.572 . . . . 0.0 112.613 -174.853 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 3.6 m -64.27 -38.48 82.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 CA-C-N 120.849 1.659 . . . . 0.0 111.045 175.131 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.35 -7.1 59.14 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.307 1.043 . . . . 0.0 113.547 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.15 -55.3 6.25 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 170.48 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -44.05 -61.29 1.51 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 128.433 2.693 . . . . 0.0 112.558 177.586 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -86.97 5.19 38.47 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.051 1.34 . . . . 0.0 112.086 -176.139 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.53 -73.16 0.53 Allowed Glycine 0 C--N 1.341 0.833 0 C-N-CA 126.465 1.983 . . . . 0.0 113.657 -173.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 25.4 m 37.65 29.52 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 116.183 1.92 . . . . 0.0 116.183 -174.48 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 25.7 m -82.91 -73.37 0.41 Allowed 'General case' 0 C--N 1.342 0.251 0 CA-C-N 120.358 1.435 . . . . 0.0 114.218 -173.243 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 36' ' ' TYR . . . . . 0.469 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 1.0 OUTLIER -148.36 164.68 20.79 Favored Pre-proline 0 N--CA 1.47 0.526 0 N-CA-C 114.012 1.115 . . . . 0.0 114.012 -175.486 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -55.1 119.65 6.87 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.136 1.891 . . . . 0.0 108.768 169.117 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.43 -4.05 83.97 Favored Glycine 0 CA--C 1.535 1.339 0 CA-C-O 117.249 -1.861 . . . . 0.0 115.897 -174.545 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 39' ' ' GLN . . . . . 0.469 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 2.4 pp0? -57.22 -27.17 61.78 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 121.203 2.501 . . . . 0.0 112.948 176.761 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 3.4 mt -67.96 -22.7 65.02 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 124.509 1.124 . . . . 0.0 111.593 178.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.16 -43.49 98.79 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 118.549 0.613 . . . . 0.0 111.156 -173.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.94 -50.86 64.76 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.664 0.786 . . . . 0.0 111.571 173.624 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -54.75 -35.77 64.09 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 178.722 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 17.3 mt -103.21 -21.64 13.84 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -172.42 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.41 -1.69 33.96 Favored Glycine 0 CA--C 1.537 1.467 0 CA-C-N 119.177 0.899 . . . . 0.0 113.418 -168.587 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -90.08 121.85 32.52 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 125.386 1.474 . . . . 0.0 108.531 176.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.8 t -47.7 139.08 7.63 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.29 1.036 . . . . 0.0 112.548 -175.109 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.12 -28.35 4.19 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.816 1.647 . . . . 0.0 113.577 174.749 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 50.3 m -62.32 -58.28 8.26 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.002 0.921 . . . . 0.0 111.358 170.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -76.12 -34.91 59.47 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.427 1.012 . . . . 0.0 113.483 -178.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 1.5 t -50.2 -47.83 24.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.906 1.23 . . . . 0.0 109.648 169.545 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 5.2 m -83.22 -27.9 29.64 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -177.091 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -45.88 -34.8 4.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.27 1.428 . . . . 0.0 112.429 173.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -113.26 2.12 15.44 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 127.373 2.269 . . . . 0.0 114.311 -178.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 46.7 mt -72.58 -24.64 61.12 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 119.615 -1.928 . . . . 0.0 109.116 166.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 18.3 p -43.11 -42.74 4.15 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.092 1.357 . . . . 0.0 111.75 167.615 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 12.5 t -75.36 -43.03 52.6 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 58' ' ' LEU . . . . . 0.618 HD13 ' HG2' ' B' ' 23' ' ' ARG . 6.5 tp -62.85 -34.57 77.62 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.488 1.515 . . . . 0.0 110.967 -176.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.449 ' HG2' HG23 ' B' ' 64' ' ' VAL . 60.5 mtm180 -82.46 -7.56 59.64 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.164 1.385 . . . . 0.0 113.867 173.719 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -97.89 -49.37 1.78 Allowed Glycine 0 N--CA 1.474 1.174 0 CA-C-N 119.391 0.996 . . . . 0.0 111.778 175.464 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 99.5 m -72.02 13.46 0.3 Allowed 'General case' 0 CA--C 1.565 1.551 0 C-N-CA 126.741 2.016 . . . . 0.0 113.223 175.008 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.89 0.04 12.53 Favored Glycine 0 N--CA 1.471 1.025 0 C-N-CA 127.597 2.522 . . . . 0.0 116.59 176.248 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.556 HD12 HD12 ' B' ' 58' ' ' LEU . 41.6 mt -65.62 -30.29 70.98 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.654 1.727 . . . . 0.0 113.702 -171.037 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.449 HG23 ' HG2' ' B' ' 59' ' ' ARG . 0.7 OUTLIER -123.7 141.08 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 126.433 1.893 . . . . 0.0 111.771 170.842 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 74.3 t -123.7 138.15 54.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 125.538 1.535 . . . . 0.0 109.118 174.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.62 148.5 30.24 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.458 1.103 . . . . 0.0 113.013 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 8.7 m -160.48 162.87 33.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.144 1.378 . . . . 0.0 108.194 -168.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -81.75 147.28 29.52 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.842 1.201 . . . . 0.0 111.55 167.89 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.21 -14.62 43.38 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.169 0.895 . . . . 0.0 111.781 167.427 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 139.51 -18.01 3.06 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 126.851 2.167 . . . . 0.0 113.02 -177.715 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 58.5 ttt-85 -153.37 -46.09 0.09 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 127.326 2.251 . . . . 0.0 111.446 -176.344 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -97.61 -177.88 3.94 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.599 1.96 . . . . 0.0 109.975 170.075 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 33.8 m -109.09 158.74 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 123.869 0.868 . . . . 0.0 112.822 171.043 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 10.0 ptt85 -140.08 173.57 11.39 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 128.71 2.804 . . . . 0.0 110.12 -171.105 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -117.9 120.14 36.96 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.304 1.042 . . . . 0.0 108.476 167.813 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -103.96 151.43 23.19 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.901 1.28 . . . . 0.0 110.196 172.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.416 HD11 HD22 ' B' ' 27' ' ' LEU . 2.0 tp -60.43 143.81 52.48 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 168.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -42.66 -60.42 1.56 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.107 0.963 . . . . 0.0 112.612 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 79' ' ' ASP . . . . . 0.461 ' CG ' ' H ' ' B' ' 80' ' ' SER . 11.8 t70 -166.8 -174.83 2.87 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.42 1.488 . . . . 0.0 113.658 171.539 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.461 ' H ' ' CG ' ' B' ' 79' ' ' ASP . 4.2 m -35.65 -39.26 0.14 Allowed 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 130.196 3.398 . . . . 0.0 113.757 172.782 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -55.45 -52.41 63.71 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.344 1.057 . . . . 0.0 113.035 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 19.2 mt -75.1 -34.39 61.73 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.036 1.289 . . . . 0.0 110.08 175.321 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.31 -38.19 88.47 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.32 0.648 . . . . 0.0 110.729 -174.122 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -67.95 -55.04 14.21 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-O 117.425 -1.274 . . . . 0.0 111.816 169.677 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.99 -32.45 72.92 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 122.407 2.367 . . . . 0.0 113.977 -174.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.41 -43.37 50.28 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.245 1.418 . . . . 0.0 112.285 171.355 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -79.72 -26.35 56.56 Favored Glycine 0 CA--C 1.54 1.645 0 C-N-CA 124.809 1.195 . . . . 0.0 114.918 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -69.57 -10.6 58.83 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.704 1.202 . . . . 0.0 109.397 165.278 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 60.2 tp 80.87 -42.6 0.19 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 130.798 3.639 . . . . 0.0 110.574 171.229 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 90' ' ' VAL . . . . . 0.46 ' CG2' HG22 ' B' ' 92' ' ' VAL . 0.0 OUTLIER 160.54 -27.25 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.548 1 C-N-CA 133.057 4.543 . . . . 0.0 110.573 170.438 . . . . . . . . 4 4 . 1 . 020 nuclear build core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 79.93 -12.2 1.08 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.323 2.249 . . . . 0.0 113.129 -178.022 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.684 HG21 ' CD1' ' A' ' 14' ' ' LEU . 27.2 m -80.34 70.02 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 CA-C-O 125.641 2.639 . . . . 0.0 114.749 -168.117 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.344 0.7 OUTLIER 34.38 27.47 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.432 -1.347 2 C-N-CA 133.825 4.85 . . . . 0.0 114.595 -167.312 . . . . . . . . 4 3 . 1 . 020 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 34.3 mt 74.61 71.32 0.1 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.497 2.319 . . . . 0.0 110.985 -168.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.72 0 O-C-N 121.063 -1.023 . . . . 0.0 111.731 169.47 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp . . . . . 0 N--CA 1.488 1.442 0 N-CA-C 116.876 2.176 . . . . 0.0 116.876 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.93 -36.88 64.71 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.302 0.955 . . . . 0.0 111.475 -169.352 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.7 ttm105 -58.55 -48.05 82.18 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 117.648 -1.168 . . . . 0.0 110.622 169.748 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.66 -51.5 69.68 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.11 1.364 . . . . 0.0 111.095 -179.051 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.22 -38.86 91.35 Favored Glycine 0 CA--C 1.533 1.213 0 CA-C-N 119.044 0.838 . . . . 0.0 112.372 177.262 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -87.11 10.14 17.64 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.249 1.42 . . . . 0.0 114.174 175.972 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -117.93 -2.48 11.3 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.761 2.424 . . . . 0.0 111.469 169.364 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.0 mp -105.13 -36.26 7.33 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.232 0.923 . . . . 0.0 109.734 165.871 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.44 86.14 2.57 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 168.12 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -130.69 156.3 80.03 Favored Pre-proline 0 CA--C 1.54 0.576 0 C-N-CA 127.489 2.315 . . . . 0.0 110.71 -173.335 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -77.64 -122.81 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.361 3.374 . . . . 0.0 109.575 -174.603 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 54.1 m -57.65 -17.38 14.37 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 119.924 -1.735 . . . . 0.0 113.003 170.707 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.46 -18.27 60.66 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 120.8 -1.188 . . . . 0.0 112.606 171.475 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.5 t -85.38 -29.43 24.43 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 120.351 -1.468 . . . . 0.0 110.911 166.077 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.2 -43.28 74.27 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.678 -0.639 . . . . 0.0 109.798 167.859 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.549 HG23 HD13 ' A' ' 40' ' ' LEU . 1.3 mm -52.14 -51.3 31.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 CA-C-N 118.94 0.791 . . . . 0.0 112.177 169.211 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 52.9 mt -62.88 -38.39 90.67 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.126 0.788 . . . . 0.0 113.126 -177.167 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.9 p -79.18 -28.83 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 CA-C-N 119.395 0.998 . . . . 0.0 113.195 175.701 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.41 3.15 13.96 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.654 1.182 . . . . 0.0 112.953 169.351 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.474 HD22 ' CE2' ' A' ' 75' ' ' TYR . 0.3 OUTLIER -83.62 -52.38 6.5 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.02 1.328 . . . . 0.0 108.603 168.163 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.46 -52.73 27.17 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 128.728 2.811 . . . . 0.0 111.94 178.144 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -90.85 36.97 0.91 Allowed 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.861 2.064 . . . . 0.0 111.358 174.163 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -147.28 -93.26 0.12 Allowed Glycine 0 C--N 1.338 0.667 0 C-N-CA 125.588 1.566 . . . . 0.0 113.331 -172.77 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 28.4 m 38.84 29.44 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 C-N-CA 127.356 2.262 . . . . 0.0 116.053 -170.805 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.432 ' HB2' ' HG2' ' A' ' 39' ' ' GLN . 69.4 m -68.44 -89.43 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 127.872 2.469 . . . . 0.0 113.489 176.166 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.426 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 17.7 m-85 -142.93 144.63 30.02 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 126.622 1.969 . . . . 0.0 110.72 -172.935 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -63.24 135.31 49.8 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 123.081 2.521 . . . . 0.0 111.162 -174.107 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.64 -3.13 56.44 Favored Glycine 0 CA--C 1.534 1.224 0 CA-C-O 118.628 -1.095 . . . . 0.0 114.589 -175.211 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.432 ' HG2' ' HB2' ' A' ' 35' ' ' CYS . 2.7 pp0? -70.17 -17.85 63.18 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.773 1.787 . . . . 0.0 112.841 176.198 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.549 HD13 HG23 ' A' ' 26' ' ' ILE . 5.8 mt -50.68 -22.02 1.87 Allowed 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.5 0.591 . . . . 0.0 111.525 171.227 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.39 -32.32 73.89 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.685 0.994 . . . . 0.0 113.685 178.468 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.8 -44.43 27.48 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.105 0.562 . . . . 0.0 110.448 169.118 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -63.65 -30.78 71.84 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.743 1.217 . . . . 0.0 114.081 -176.139 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 27.6 mt -101.41 -14.09 17.7 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.008 1.723 . . . . 0.0 113.71 176.223 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.57 0.39 31.32 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.43 1.014 . . . . 0.0 114.241 -170.612 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 88.8 mt -89.62 136.68 32.89 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.062 1.345 . . . . 0.0 109.732 -179.488 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.1 p -59.07 159.14 7.64 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -168.405 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 71.6 mtp85 -54.37 -30.4 51.65 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.836 176.634 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.4 m -69.09 -57.62 5.17 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.467 1.031 . . . . 0.0 111.225 169.56 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -54.9 -41.37 70.84 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.388 -0.82 . . . . 0.0 112.995 -178.797 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.4 t -71.95 -32.65 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 O-C-N 121.486 -0.759 . . . . 0.0 111.962 176.862 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 68.8 m -69.55 -33.75 73.22 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.364 0.984 . . . . 0.0 112.19 178.477 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -54.9 -48.81 72.56 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.729 0.695 . . . . 0.0 111.788 169.649 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 32.0 m80 -62.6 -40.28 96.43 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 177.538 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 84.1 mt -75.9 -17.86 59.62 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.54 1.536 . . . . 0.0 114.218 179.769 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 t -66.31 -41.84 89.16 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.858 1.208 . . . . 0.0 111.895 179.479 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 46.4 t -67.57 -48.28 67.36 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-O 122.8 1.286 . . . . 0.0 110.884 168.839 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.472 ' HB3' ' CG2' ' A' ' 64' ' ' VAL . 1.1 tp -62.45 -37.75 87.12 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.591 1.557 . . . . 0.0 114.362 -169.241 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.431 ' HG2' HG23 ' A' ' 64' ' ' VAL . 1.2 mtt85 -89.76 8.65 30.72 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 114.679 1.362 . . . . 0.0 114.679 173.808 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -108.38 -55.77 0.58 Allowed Glycine 0 N--CA 1.474 1.224 0 C-N-CA 124.959 1.266 . . . . 0.0 111.138 171.879 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 56.0 m -74.76 15.31 0.39 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 128.262 2.625 . . . . 0.0 112.863 179.409 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.97 -5.68 24.09 Favored Glycine 0 C--N 1.34 0.799 0 C-N-CA 128.415 2.912 . . . . 0.0 116.296 169.497 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.4 mt -60.93 -30.42 70.19 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.57 1.685 . . . . 0.0 114.106 -173.059 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.472 ' CG2' ' HB3' ' A' ' 58' ' ' LEU . 1.5 m -138.87 151.21 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 125.854 1.662 . . . . 0.0 111.115 169.395 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.2 t -149.86 144.7 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 123.234 0.614 . . . . 0.0 112.559 176.059 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -78.89 140.43 38.11 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.108 1.363 . . . . 0.0 113.092 178.527 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.5 m -143.07 134.07 25.6 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 126.062 1.745 . . . . 0.0 106.956 -168.969 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -61.78 127.04 29.54 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 121.18 1.809 . . . . 0.0 111.191 172.851 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.313 2.8 pp20? -85.34 -134.15 0.06 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 118.147 -0.93 . . . . 0.0 110.314 174.344 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -72.77 -37.77 57.12 Favored Glycine 0 CA--C 1.531 1.068 0 CA-C-N 120.892 1.678 . . . . 0.0 113.408 176.27 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.0 ttp85 -154.9 -9.38 0.13 Allowed 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -179.524 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -111.8 -173.08 2.17 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.618 2.367 . . . . 0.0 107.707 171.37 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 4.3 m -104.8 146.42 12.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 124.017 0.927 . . . . 0.0 108.916 166.768 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -111.27 -162.66 0.81 Allowed 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 127.279 2.231 . . . . 0.0 109.713 172.752 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.474 ' CE2' HD22 ' A' ' 30' ' ' LEU . 1.1 p90 -159.24 96.87 1.33 Allowed 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 127.107 2.163 . . . . 0.0 106.557 -172.092 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -94.23 156.16 16.68 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.701 1.6 . . . . 0.0 111.233 -177.466 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.1 mt -62.7 160.13 14.84 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 165.471 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -42.44 -47.04 4.94 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.545 1.138 . . . . 0.0 114.056 -177.932 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -169.02 172.37 7.59 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 126.309 1.843 . . . . 0.0 108.63 176.728 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -34.33 -36.67 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 128.762 2.825 . . . . 0.0 111.226 162.836 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -38.96 -67.83 0.19 Allowed 'General case' 0 C--N 1.344 0.35 0 C-N-CA 128.552 2.741 . . . . 0.0 113.542 168.662 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 17.4 mt -79.07 -36.01 41.56 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 118.673 -0.679 . . . . 0.0 109.757 -173.16 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.77 -34.19 62.29 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.924 0.784 . . . . 0.0 112.597 170.096 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 -83.14 -59.73 2.38 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.738 178.738 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.35 -32.36 73.76 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -176.232 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.77 -35.98 59.96 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 121.417 -0.802 . . . . 0.0 110.656 169.846 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.58 -42.87 62.29 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 125.403 1.478 . . . . 0.0 114.44 -173.76 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -77.83 -23.61 48.95 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.734 1.267 . . . . 0.0 111.96 169.352 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 22.1 tp 80.74 146.38 0.09 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 129.583 3.153 . . . . 0.0 113.859 166.19 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.9 m -48.9 -7.39 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 129.142 2.977 . . . . 0.0 117.14 -178.387 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 74.89 -44.01 0.53 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 128.147 2.579 . . . . 0.0 113.008 172.893 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.8 p -50.94 44.68 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.34 1 C-N-CA 133.793 4.837 . . . . 0.0 118.435 -169.804 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 59.25 10.35 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 128.896 2.878 . . . . 0.0 112.756 -172.622 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.2 tt 75.28 113.9 0.06 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.821 2.448 . . . . 0.0 106.056 -165.503 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.51 77.94 0.11 Allowed 'General case' 0 CA--C 1.551 1.013 0 O-C-N 121.137 -0.977 . . . . 0.0 112.477 -177.274 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.0 m -57.98 140.81 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 125.743 1.617 . . . . 0.0 114.468 -174.948 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.79 104.0 0.07 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.94 2.496 . . . . 0.0 110.216 171.544 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 11.9 p -153.18 -72.3 0.14 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.458 1.103 . . . . 0.0 111.041 -169.157 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . 0.251 30.9 m-20 64.21 43.49 4.88 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 127.377 2.271 . . . . 0.0 112.996 171.591 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -66.39 158.12 79.29 Favored Pre-proline 0 CA--C 1.544 0.735 0 CA-C-N 113.769 -1.56 . . . . 0.0 110.413 168.028 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -59.8 161.8 17.47 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.463 2.776 . . . . 0.0 111.357 169.412 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.812 0 CA-C-O 121.29 0.566 . . . . 0.0 111.004 -178.408 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 27.2 tp . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 116.708 2.114 . . . . 0.0 116.708 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.09 -33.67 63.71 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 119.217 0.917 . . . . 0.0 111.041 -169.339 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 7.0 ttm105 -55.23 -46.81 76.0 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 118.521 -0.752 . . . . 0.0 110.719 169.267 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.34 -50.0 74.34 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.906 1.282 . . . . 0.0 111.063 -179.666 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -59.07 -31.3 68.52 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-N 119.323 0.965 . . . . 0.0 112.831 177.624 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.6 3.08 55.09 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 174.436 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.09 -17.49 14.31 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 127.587 2.355 . . . . 0.0 111.706 172.701 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 4.3 mp -93.8 -44.91 7.89 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.416 0.687 . . . . 0.0 110.853 168.151 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.71 70.55 7.49 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.734 0.778 . . . . 0.0 110.807 172.675 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -127.12 132.97 24.57 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 128.066 2.546 . . . . 0.0 106.105 176.404 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -52.89 -94.01 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.862 1 C-N-CA 126.603 4.868 . . . . 0.0 115.806 -165.936 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 5.3 m -58.19 -25.37 61.49 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.623 1.569 . . . . 0.0 111.214 178.517 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 13.4 ttp180 -73.91 -34.69 64.47 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 179.635 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 52.8 t -63.03 -36.97 85.35 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.573 1.533 . . . . 0.0 109.572 167.605 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.1 mtm180 -61.78 -41.41 97.68 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.949 0.9 . . . . 0.0 112.354 169.823 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mm -61.41 -47.47 93.3 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 CA-C-N 120.235 1.38 . . . . 0.0 111.48 170.284 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 52.8 mt -62.47 -40.9 98.13 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.814 0.845 . . . . 0.0 112.101 -179.301 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 3.7 p -77.59 -28.2 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 177.462 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.17 -12.23 59.67 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 121.138 -0.976 . . . . 0.0 113.183 170.208 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.08 -54.07 16.97 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.292 1.037 . . . . 0.0 108.806 169.263 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 2.6 mt -41.3 -66.7 0.31 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 128.164 2.586 . . . . 0.0 111.201 173.273 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -79.75 32.05 0.25 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.667 1.987 . . . . 0.0 112.403 177.836 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -143.74 -80.91 0.05 OUTLIER Glycine 0 C--N 1.338 0.693 0 C-N-CA 125.002 1.287 . . . . 0.0 113.832 -173.867 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 23.6 m 37.43 22.83 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 N-CA-C 118.447 2.758 . . . . 0.0 118.447 -175.289 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 91.3 m -76.11 -69.66 0.49 Allowed 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.979 1.718 . . . . 0.0 113.274 179.87 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -144.14 159.12 53.75 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 123.684 0.794 . . . . 0.0 112.785 -168.629 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -60.79 138.18 77.67 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 123.748 2.965 . . . . 0.0 111.757 173.892 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 66.39 0.0 7.27 Favored Glycine 0 CA--C 1.533 1.204 0 CA-C-O 119.099 -0.834 . . . . 0.0 114.578 177.79 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -67.51 -29.16 68.5 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 119.077 1.439 . . . . 0.0 111.217 -178.154 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.7 mp -56.07 -15.16 3.24 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 124.23 1.012 . . . . 0.0 112.892 177.591 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.0 -46.04 78.85 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.635 0.774 . . . . 0.0 111.739 170.75 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.25 -42.24 75.88 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.096 0.862 . . . . 0.0 111.417 174.494 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -63.57 -31.05 72.1 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.103 1.361 . . . . 0.0 113.751 -177.48 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 29.9 mt -99.18 -10.38 22.54 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.55 1.54 . . . . 0.0 113.485 175.391 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.63 8.11 55.72 Favored Glycine 0 CA--C 1.537 1.428 0 CA-C-N 118.984 0.811 . . . . 0.0 113.737 -169.303 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 91.3 mt -88.83 162.82 15.96 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 118.615 1.208 . . . . 0.0 111.742 -177.232 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.5 p -70.67 154.81 41.5 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.634 -1.291 . . . . 0.0 110.287 175.26 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 68.0 mtp85 -54.03 -40.47 67.09 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.096 172.019 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 5.6 m -59.2 -49.39 78.04 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.172 0.989 . . . . 0.0 112.877 173.163 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -61.6 -46.62 89.05 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.595 -0.691 . . . . 0.0 110.934 178.657 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 19.3 t -67.18 -37.1 78.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.047 -179.204 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 56.6 m -58.86 -42.91 90.52 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 119.825 1.193 . . . . 0.0 112.855 170.984 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 34.9 m-20 -56.52 -46.57 80.5 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.05 0.841 . . . . 0.0 111.269 176.374 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -66.26 -40.65 90.3 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 121.719 -0.613 . . . . 0.0 112.32 176.759 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 88.2 mt -68.5 -18.49 64.4 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.908 0.883 . . . . 0.0 113.054 175.24 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.03 -53.74 54.28 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.229 1.377 . . . . 0.0 112.225 -179.16 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 17.5 t -65.99 -44.51 84.64 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.244 0.545 . . . . 0.0 110.326 173.86 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 2.5 tp -55.54 -40.53 71.99 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.092 1.757 . . . . 0.0 113.796 -172.816 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 64.5 mtm180 -83.53 -11.86 56.9 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.057 1.343 . . . . 0.0 113.367 176.447 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -85.62 -54.34 2.82 Favored Glycine 0 N--CA 1.47 0.949 0 C-N-CA 124.466 1.031 . . . . 0.0 110.673 170.828 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 31.2 m -58.45 -6.06 0.63 Allowed 'General case' 0 CA--C 1.56 1.356 0 C-N-CA 126.583 1.953 . . . . 0.0 114.519 174.708 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.87 -2.18 42.88 Favored Glycine 0 CA--C 1.531 1.08 0 C-N-CA 124.65 1.119 . . . . 0.0 114.065 -175.396 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 79.6 mt -57.24 -26.4 60.69 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.387 1.875 . . . . 0.0 113.386 -177.281 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -132.43 143.75 38.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 127.276 2.23 . . . . 0.0 110.177 168.508 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 22.1 t -143.3 139.09 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 125.726 1.61 . . . . 0.0 109.624 -172.54 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.7 153.59 40.01 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 178.108 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 93.7 m -162.01 139.67 8.69 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.36 1.464 . . . . 0.0 108.639 -178.828 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -71.12 123.39 22.04 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 119.946 1.248 . . . . 0.0 109.489 169.037 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.296 0.0 OUTLIER -69.97 -76.35 0.1 Allowed 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.711 1.141 . . . . 0.0 110.351 179.251 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -142.29 -29.98 0.14 Allowed Glycine 0 CA--C 1.534 1.277 0 C-N-CA 127.408 2.432 . . . . 0.0 113.282 169.714 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 6.4 ttp85 -145.93 -10.21 0.52 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.703 1.601 . . . . 0.0 113.914 179.067 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -117.56 172.07 7.59 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 127.0 2.12 . . . . 0.0 109.413 170.012 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 27.8 m -97.88 145.88 8.79 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 164.439 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -126.51 175.49 7.87 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 126.864 2.066 . . . . 0.0 109.718 -176.008 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -120.65 117.03 26.47 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 164.349 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -93.03 166.05 12.55 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.488 1.515 . . . . 0.0 109.123 169.525 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -66.93 166.67 13.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.857 0.863 . . . . 0.0 109.428 167.363 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -47.68 -47.52 29.56 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.538 1.135 . . . . 0.0 113.649 174.77 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -176.72 170.36 2.39 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 126.638 1.975 . . . . 0.0 109.427 -179.442 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -34.65 -36.96 0.05 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 129.373 3.069 . . . . 0.0 111.491 162.723 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -43.25 -69.39 0.14 Allowed 'General case' 0 C--N 1.341 0.205 0 C-N-CA 128.698 2.799 . . . . 0.0 113.295 169.626 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 19.0 mt -70.55 -28.76 65.16 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.22 0.918 . . . . 0.0 111.237 177.528 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -66.49 -34.54 78.14 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.001 0.818 . . . . 0.0 111.388 -176.81 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -79.57 -55.51 4.98 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 117.273 -1.346 . . . . 0.0 110.134 171.611 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.92 -32.17 67.51 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -176.019 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.63 -43.89 15.15 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.386 -0.822 . . . . 0.0 110.939 169.796 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.47 -29.51 71.58 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 125.106 1.336 . . . . 0.0 114.776 -170.134 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -82.88 -25.0 32.94 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.827 1.251 . . . . 0.0 112.451 168.556 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 21.4 tp 71.22 142.71 0.06 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 129.962 3.305 . . . . 0.0 112.238 -177.754 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 90' ' ' VAL . . . . . 0.477 HG23 HG12 ' B' ' 92' ' ' VAL . 12.1 m -42.62 -4.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 C-N-CA 129.487 3.115 . . . . 0.0 117.187 168.606 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 71.68 -29.55 0.2 Allowed 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 128.969 2.908 . . . . 0.0 114.565 173.29 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.477 HG12 HG23 ' B' ' 90' ' ' VAL . 4.5 p -58.8 39.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 131.619 3.968 . . . . 0.0 116.488 -175.736 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 60.83 11.63 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 128.779 2.832 . . . . 0.0 113.259 -177.13 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.0 tt 78.85 113.68 0.07 Allowed 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 128.74 2.816 . . . . 0.0 106.35 -166.905 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.887 0 O-C-N 121.045 -1.035 . . . . 0.0 111.868 175.721 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 mm? . . . . . 0 CA--C 1.545 0.762 0 N-CA-C 110.624 -0.139 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.11 -42.29 96.92 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 120.661 -1.274 . . . . 0.0 113.363 168.962 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.5 mmt180 -59.93 -43.93 94.64 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 121.461 -0.774 . . . . 0.0 110.367 173.129 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -58.93 -42.26 89.3 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.421 1.888 . . . . 0.0 112.551 176.25 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.7 -30.11 76.59 Favored Glycine 0 N--CA 1.47 0.904 0 O-C-N 120.689 -1.257 . . . . 0.0 112.999 177.199 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.7 ttt-85 -73.44 -41.3 63.39 Favored 'General case' 0 C--O 1.221 -0.395 0 O-C-N 121.725 -0.867 . . . . 0.0 110.817 169.991 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.83 -32.65 65.97 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 176.554 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.5 mt -75.15 -44.93 44.15 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.344 1.058 . . . . 0.0 112.772 172.122 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -84.28 -14.24 50.35 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 116.56 2.059 . . . . 0.0 116.56 -175.507 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -50.94 148.7 7.21 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 126.74 2.016 . . . . 0.0 115.082 -170.843 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -49.41 -64.97 0.18 Allowed 'Trans proline' 0 C--N 1.351 0.666 1 C-N-CA 125.889 4.393 . . . . 0.0 112.652 -173.538 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 52.8 m -82.39 -31.58 29.61 Favored 'General case' 0 C--O 1.226 -0.145 0 CA-C-O 118.452 -0.785 . . . . 0.0 111.756 175.054 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.514 ' CD ' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -72.89 -32.06 65.12 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 120.313 1.415 . . . . 0.0 114.406 -171.304 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.8 t -61.46 -50.38 73.02 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.0 0.818 . . . . 0.0 110.39 170.438 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -57.63 -45.48 85.36 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.812 1.245 . . . . 0.0 113.044 174.363 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 mm -51.6 -53.39 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.388 1.075 . . . . 0.0 110.607 169.515 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.6 mt -56.28 -51.91 66.43 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 117.617 -1.183 . . . . 0.0 111.74 178.993 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -61.21 -38.18 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 CA-C-N 119.532 1.06 . . . . 0.0 112.404 -178.645 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.83 -15.41 61.17 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 176.327 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.0 tp -74.12 -40.16 62.85 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 120.778 1.626 . . . . 0.0 112.806 175.487 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.434 HD12 HD22 ' A' ' 86' ' ' LEU . 3.4 mt -51.56 -46.61 63.47 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.596 1.559 . . . . 0.0 110.978 175.116 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -86.12 11.98 10.64 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 126.533 1.933 . . . . 0.0 113.277 176.305 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.41 -92.79 0.92 Allowed Glycine 0 N--CA 1.468 0.794 0 C-N-CA 126.848 2.166 . . . . 0.0 114.447 -174.345 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.465 HG12 ' HA ' ' A' ' 76' ' ' ALA . 30.4 m 36.04 41.12 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 127.182 2.193 . . . . 0.0 114.75 -167.326 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 98.9 m -87.38 -102.99 0.07 Allowed 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 124.14 0.976 . . . . 0.0 110.679 175.761 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -112.52 168.87 7.03 Favored Pre-proline 0 CA--C 1.55 0.976 0 O-C-N 120.034 -1.666 . . . . 0.0 114.356 -170.17 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.25 111.4 2.26 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.14 1.893 . . . . 0.0 109.899 -176.002 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.54 7.21 76.05 Favored Glycine 0 CA--C 1.532 1.096 0 CA-C-O 119.166 -0.797 . . . . 0.0 114.354 -175.974 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.01 -21.79 23.4 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 119.45 1.625 . . . . 0.0 115.076 177.97 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.7 mp -63.72 -17.04 62.6 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 123.384 0.674 . . . . 0.0 111.845 175.971 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.33 -25.2 67.76 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.915 0.78 . . . . 0.0 112.992 173.607 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.55 -50.17 14.58 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.656 0.662 . . . . 0.0 110.146 168.706 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -56.29 -38.78 71.68 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 179.752 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.4 mt -99.36 -19.83 16.81 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.42 1.088 . . . . 0.0 113.438 -172.515 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.64 -11.03 3.51 Favored Glycine 0 CA--C 1.539 1.544 0 C-N-CA 124.525 1.059 . . . . 0.0 113.254 -168.303 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.38 128.15 34.81 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 125.147 1.379 . . . . 0.0 108.051 175.461 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.2 t -56.33 154.99 7.42 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 122.29 1.043 . . . . 0.0 112.019 -176.649 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.6 ptt-85 -54.93 -16.53 2.78 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.129 0.971 . . . . 0.0 113.316 175.02 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.6 t -65.32 -67.79 0.41 Allowed 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.404 1.002 . . . . 0.0 109.48 167.766 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -54.5 -42.81 71.22 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.604 1.093 . . . . 0.0 112.836 176.947 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.3 t -63.4 -45.48 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-O 118.389 -0.815 . . . . 0.0 111.41 177.005 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 26.0 m -71.57 -35.4 70.56 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.793 1.633 . . . . 0.0 112.837 178.311 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -56.15 -56.79 16.56 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.595 1.558 . . . . 0.0 110.094 173.746 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -73.0 -28.65 62.5 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -179.87 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 44.0 mt -64.3 -33.9 76.89 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.895 1.225 . . . . 0.0 111.72 169.671 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 66.7 m -62.04 -45.31 94.13 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.368 1.44 . . . . 0.0 113.683 -170.795 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 17.6 t -72.14 -21.07 61.52 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 119.432 1.015 . . . . 0.0 112.293 170.816 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.514 HD13 ' CD ' ' A' ' 23' ' ' ARG . 8.2 tp -67.31 -38.12 84.45 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 120.525 1.511 . . . . 0.0 110.439 171.528 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.423 ' HG2' HG23 ' A' ' 64' ' ' VAL . 90.9 mtm-85 -73.78 -15.24 61.2 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.078 1.351 . . . . 0.0 112.305 172.889 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.18 -58.51 1.56 Allowed Glycine 0 C--N 1.338 0.69 0 N-CA-C 109.323 -1.511 . . . . 0.0 109.323 179.499 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 69.7 m -60.89 10.82 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 128.113 2.565 . . . . 0.0 114.375 173.191 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 62.87 16.12 56.3 Favored Glycine 0 N--CA 1.469 0.864 0 C-N-CA 127.229 2.347 . . . . 0.0 115.631 173.668 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 82.6 mt -78.45 -26.91 46.3 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.532 1.166 . . . . 0.0 112.941 -179.566 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.423 HG23 ' HG2' ' A' ' 59' ' ' ARG . 2.8 m -132.54 142.81 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.771 1.228 . . . . 0.0 113.686 178.249 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 20.5 t -129.78 139.88 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.979 2.112 . . . . 0.0 109.893 -177.987 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.03 138.16 43.88 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.272 0.629 . . . . 0.0 112.272 170.726 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.98 161.51 35.47 Favored 'General case' 0 CA--C 1.509 -0.604 0 CA-C-O 121.706 0.765 . . . . 0.0 110.191 170.503 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -73.69 122.66 22.7 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 105.893 -1.892 . . . . 0.0 105.893 165.152 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -75.39 -22.99 57.02 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.773 1.169 . . . . 0.0 112.542 169.804 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 118.69 105.32 2.21 Favored Glycine 0 C--N 1.337 0.584 0 N-CA-C 106.798 -2.521 . . . . 0.0 106.798 -168.344 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 13.8 ttt85 76.01 -57.33 0.57 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.615 1.966 . . . . 0.0 111.621 -169.209 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -98.14 -166.95 1.44 Allowed 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 119.13 0.877 . . . . 0.0 111.249 -179.426 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 10.4 p -128.67 149.63 33.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 126.255 1.822 . . . . 0.0 108.649 -176.797 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.5 ptt180 -136.0 169.73 17.14 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 126.268 1.827 . . . . 0.0 110.998 -177.732 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -112.34 139.5 47.85 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 164.012 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.465 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -139.81 150.86 45.21 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.533 1.133 . . . . 0.0 110.394 -178.142 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.05 129.41 20.72 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.28 1.032 . . . . 0.0 108.302 170.031 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.9 -24.34 66.83 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -170.533 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -161.09 156.61 24.76 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 123.217 1.484 . . . . 0.0 112.9 -179.817 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 91.2 p -43.04 -36.48 1.61 Allowed 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 128.809 2.844 . . . . 0.0 114.87 168.519 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 -58.5 -42.88 88.62 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.08 -1.012 . . . . 0.0 112.559 175.904 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.3 mt -73.06 -38.3 66.51 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 118.685 0.675 . . . . 0.0 109.389 179.062 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.55 89.05 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.469 0.708 . . . . 0.0 109.23 -179.53 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -70.98 -51.97 22.47 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.951 1.7 . . . . 0.0 113.495 175.581 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.2 -45.19 95.62 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.734 1.152 . . . . 0.0 112.736 -179.654 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.434 HD22 HD12 ' A' ' 31' ' ' LEU . 2.0 tt -56.49 -55.59 31.88 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.836 0.855 . . . . 0.0 108.99 169.468 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.78 -17.54 78.32 Favored Glycine 0 CA--C 1.543 1.835 0 C-N-CA 125.601 1.572 . . . . 0.0 115.603 -167.93 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -73.58 -23.25 59.92 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 119.36 1.58 . . . . 0.0 110.361 166.998 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 52.7 tp 72.81 117.83 0.05 OUTLIER 'General case' 0 C--N 1.343 0.314 0 C-N-CA 129.261 3.024 . . . . 0.0 107.68 -171.872 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 21.7 t -69.1 18.78 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 125.902 1.681 . . . . 0.0 113.591 -169.078 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 91.19 -21.64 0.1 Allowed 'General case' 0 C--O 1.221 -0.446 0 O-C-N 119.494 -2.004 . . . . 0.0 110.349 126.319 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.413 ' C ' ' H ' ' A' ' 94' ' ' LEU . 7.7 p -72.44 41.61 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 127.628 2.371 . . . . 0.0 111.43 165.376 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER 68.6 -27.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 C-N-CA 129.608 3.163 . . . . 0.0 113.57 -173.162 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.413 ' H ' ' C ' ' A' ' 92' ' ' VAL . 45.8 tp 138.28 112.67 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.35 1 C-N-CA 133.116 4.566 . . . . 0.0 106.032 -169.644 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.41 106.84 0.27 Allowed 'General case' 0 CA--C 1.546 0.813 0 O-C-N 121.603 -0.686 . . . . 0.0 111.356 169.432 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.2 t -58.87 158.8 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 127.494 2.317 . . . . 0.0 110.916 169.89 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -85.85 18.83 2.76 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.261 1.824 . . . . 0.0 115.015 -179.568 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.485 ' HG1' ' N ' ' B' ' 11' ' ' LEU . 9.4 p -75.36 96.99 3.5 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.198 0.999 . . . . 0.0 111.906 -178.347 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.79 49.34 1.77 Allowed 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 126.662 1.985 . . . . 0.0 110.534 170.503 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 100' ' ' GLN . . . . . 0.422 ' HB3' ' HD2' ' A' ' 101' ' ' PRO . 66.6 mm-40 -103.1 -174.41 0.34 Allowed Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 127.674 2.389 . . . . 0.0 112.43 -169.738 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.422 ' HD2' ' HB3' ' A' ' 100' ' ' GLN . 36.9 Cg_endo -65.28 149.7 88.2 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.988 2.459 . . . . 0.0 110.495 164.207 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.9 t . . . . . 0 CA--C 1.535 0.39 0 CA-C-O 124.303 2.002 . . . . 0.0 114.994 -170.339 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.485 ' N ' ' HG1' ' A' ' 98' ' ' THR . 4.4 mm? . . . . . 0 CA--C 1.545 0.75 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.62 -29.08 69.82 Favored 'General case' 0 CA--C 1.546 0.793 0 O-C-N 119.605 -1.934 . . . . 0.0 112.45 170.44 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 11.8 mmt-85 -66.04 -39.52 90.24 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.94 0.896 . . . . 0.0 111.691 170.39 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -57.32 -41.29 79.67 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.146 1.378 . . . . 0.0 111.879 -178.55 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -61.77 -37.24 93.97 Favored Glycine 0 N--CA 1.476 1.305 0 CA-C-N 120.339 1.427 . . . . 0.0 113.535 -178.391 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 9.2 ttt-85 -80.58 -24.11 39.41 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 118.054 0.927 . . . . 0.0 111.937 170.611 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.39 -33.94 74.51 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.138 -1.601 . . . . 0.0 112.498 170.289 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 17.5 mt -83.62 -42.14 17.04 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.163 0.985 . . . . 0.0 111.242 174.409 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -100.08 65.23 1.26 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.833 1.253 . . . . 0.0 112.746 173.307 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -120.81 149.56 50.96 Favored Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 126.082 1.753 . . . . 0.0 108.974 176.881 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -59.74 -63.73 0.12 Allowed 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 124.601 3.534 . . . . 0.0 112.725 -171.839 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.3 m -77.99 -37.75 46.49 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-O 118.709 -0.662 . . . . 0.0 110.066 174.877 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.666 ' CD ' HD13 ' B' ' 58' ' ' LEU . 0.5 OUTLIER -67.0 -37.2 83.77 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -169.6 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 22.2 t -62.7 -49.53 74.74 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.644 1.111 . . . . 0.0 111.139 171.811 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 64.5 mtt180 -53.81 -46.67 71.18 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.243 1.017 . . . . 0.0 112.982 172.841 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 11.3 mm -51.9 -53.27 18.36 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 C-N-CA 124.63 1.172 . . . . 0.0 110.787 170.47 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 78.2 mt -57.85 -47.38 82.86 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 117.837 -1.077 . . . . 0.0 111.667 179.131 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.5 m -64.29 -39.52 85.81 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 119.914 1.233 . . . . 0.0 112.813 -179.995 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.32 -8.64 59.78 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -179.274 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' B' ' 30' ' ' LEU . 13.2 mt -69.42 -45.17 69.8 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 118.279 -0.867 . . . . 0.0 112.907 169.207 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 31' ' ' LEU . . . . . 0.409 HD12 HD22 ' B' ' 86' ' ' LEU . 0.9 OUTLIER -44.48 -63.29 0.92 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.27 2.628 . . . . 0.0 112.569 -176.525 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -95.63 8.31 43.76 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 126.53 1.932 . . . . 0.0 112.788 -177.365 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.14 -85.88 1.83 Allowed Glycine 0 C--N 1.338 0.66 0 C-N-CA 127.818 2.628 . . . . 0.0 110.435 173.185 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 34.11 44.53 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.754 1.621 . . . . 0.0 113.552 -167.728 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 88.6 m -105.18 -145.54 0.38 Allowed 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 123.571 1.653 . . . . 0.0 109.655 170.038 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.79 166.03 13.42 Favored Pre-proline 0 C--N 1.317 -0.847 0 N-CA-C 117.609 2.448 . . . . 0.0 117.609 -160.47 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -72.32 110.9 3.07 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 122.25 1.966 . . . . 0.0 107.797 -175.996 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.81 13.27 75.61 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-O 118.227 -1.319 . . . . 0.0 114.908 -171.676 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.59 -36.82 64.83 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.603 1.701 . . . . 0.0 111.297 171.013 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.5 mp -56.14 -15.8 4.26 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 124.634 1.174 . . . . 0.0 113.926 -179.756 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.16 -43.74 92.09 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 119.233 0.924 . . . . 0.0 111.507 172.933 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.43 -25.04 54.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.764 0.826 . . . . 0.0 113.125 175.347 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -70.26 -32.71 70.67 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.422 -0.799 . . . . 0.0 112.813 172.288 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 12.8 mt -111.0 -20.18 12.51 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -169.426 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.88 4.83 78.12 Favored Glycine 0 CA--C 1.535 1.285 0 CA-C-N 119.926 1.239 . . . . 0.0 113.75 -169.731 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -100.24 135.67 41.32 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 125.065 1.346 . . . . 0.0 110.82 178.503 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 6.2 t -55.9 154.47 7.24 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.385 -0.822 . . . . 0.0 112.544 177.796 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 32.9 ptt-85 -51.57 -23.76 4.57 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.251 1.42 . . . . 0.0 113.539 174.88 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 25.7 t -63.66 -67.08 0.46 Allowed 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 118.526 0.603 . . . . 0.0 110.751 169.484 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -58.07 -35.73 71.79 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.209 1.003 . . . . 0.0 113.455 -179.892 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 15.4 t -59.43 -47.96 88.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 118.767 0.712 . . . . 0.0 111.793 169.899 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 35.7 m -78.31 -32.54 49.36 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -175.638 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -60.15 -49.85 76.01 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.053 0.941 . . . . 0.0 110.176 176.477 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -72.95 -34.36 66.47 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 117.981 -1.009 . . . . 0.0 113.68 175.363 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 28.3 mt -56.38 -30.72 63.06 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 120.643 1.565 . . . . 0.0 112.526 169.571 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 67.7 m -69.54 -49.8 51.0 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 120.144 1.338 . . . . 0.0 114.571 -170.79 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 16.6 t -63.19 -27.55 69.44 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 119.708 1.14 . . . . 0.0 111.678 171.599 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 58' ' ' LEU . . . . . 0.666 HD13 ' CD ' ' B' ' 23' ' ' ARG . 11.8 tp -66.36 -39.98 89.47 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.108 2.163 . . . . 0.0 112.35 177.271 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.472 ' HG2' HG23 ' B' ' 64' ' ' VAL . 82.2 mtm-85 -67.65 -33.52 75.11 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 119.145 0.884 . . . . 0.0 110.327 173.228 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -71.46 -53.64 9.87 Favored Glycine 0 N--CA 1.466 0.634 0 N-CA-C 110.251 -1.14 . . . . 0.0 110.251 179.226 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 57.1 m -55.98 -4.6 0.13 Allowed 'General case' 0 CA--C 1.56 1.332 0 C-N-CA 128.112 2.565 . . . . 0.0 113.961 173.877 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.78 16.66 67.47 Favored Glycine 0 C--N 1.343 0.953 0 C-N-CA 127.347 2.403 . . . . 0.0 113.645 170.083 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.618 HD12 HD12 ' B' ' 58' ' ' LEU . 90.7 mt -94.52 -21.11 19.08 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 -169.648 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.472 HG23 ' HG2' ' B' ' 59' ' ' ARG . 4.5 m -140.44 156.17 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -173.77 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 96.2 t -147.21 149.48 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 125.702 1.601 . . . . 0.0 111.019 -173.144 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.4 125.2 41.89 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.012 0.925 . . . . 0.0 111.906 169.168 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.15 165.85 16.84 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.254 1.021 . . . . 0.0 110.313 -176.154 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -76.04 122.57 24.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.817 168.675 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -85.78 -24.97 26.63 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 118.316 0.507 . . . . 0.0 111.357 167.067 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 125.96 105.33 1.47 Allowed Glycine 0 C--N 1.34 0.778 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -174.191 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 71.15 -52.1 0.69 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.999 2.12 . . . . 0.0 111.403 -169.639 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -91.45 -178.04 4.99 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.643 1.177 . . . . 0.0 110.444 177.568 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 11.2 p -125.61 138.24 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 125.976 1.71 . . . . 0.0 108.884 179.896 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 38.1 ptt180 -115.17 166.28 12.0 Favored 'General case' 0 CA--C 1.509 -0.628 0 C-N-CA 124.708 1.203 . . . . 0.0 109.415 -176.78 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -115.75 135.94 53.54 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 168.979 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -141.77 160.91 39.22 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.88 1.672 . . . . 0.0 112.055 -169.098 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 49.7 mt -68.19 152.67 45.13 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.803 0.841 . . . . 0.0 109.271 167.421 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.22 -22.35 38.86 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 -169.5 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -167.07 158.14 12.0 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.383 1.473 . . . . 0.0 112.76 179.068 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 89.5 p -40.01 -39.84 0.94 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 128.811 2.845 . . . . 0.0 114.949 168.221 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -55.97 -43.81 77.92 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.701 0.8 . . . . 0.0 111.571 175.9 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 1.9 mt -78.0 -42.14 33.61 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.408 1.004 . . . . 0.0 110.194 -176.471 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.12 -38.9 63.06 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.852 0.861 . . . . 0.0 111.043 171.777 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 18.5 tpt180 -70.95 -52.72 18.15 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.574 1.55 . . . . 0.0 113.659 177.041 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.94 -40.38 88.73 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 118.89 0.768 . . . . 0.0 112.43 177.622 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.409 HD22 HD12 ' B' ' 31' ' ' LEU . 0.8 OUTLIER -57.88 -49.32 77.13 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.971 1.308 . . . . 0.0 109.883 169.564 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.05 -29.95 63.94 Favored Glycine 0 CA--C 1.536 1.384 0 C-N-CA 125.636 1.588 . . . . 0.0 114.768 -169.552 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -73.75 -14.63 61.15 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 118.971 1.385 . . . . 0.0 111.128 167.197 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 28.2 tp 70.78 157.08 0.16 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 129.001 2.921 . . . . 0.0 107.922 -166.861 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 90' ' ' VAL . . . . . 0.535 HG21 ' H ' ' B' ' 95' ' ' ALA . 27.8 m -53.91 -11.84 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 O-C-N 121.055 -1.028 . . . . 0.0 112.654 167.397 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 91' ' ' GLN . . . . . 0.427 ' C ' ' H ' ' B' ' 93' ' ' VAL . 3.6 tp-100 76.5 -20.04 0.39 Allowed 'General case' 0 C--N 1.345 0.376 0 C-N-CA 127.742 2.417 . . . . 0.0 112.287 161.487 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.412 HG13 ' O ' ' B' ' 92' ' ' VAL . 3.9 p -68.05 38.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 128.593 2.757 . . . . 0.0 113.903 169.515 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 93' ' ' VAL . . . . . 0.427 ' H ' ' C ' ' B' ' 91' ' ' GLN . 2.3 t 74.72 -34.42 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 C-N-CA 130.039 3.336 . . . . 0.0 112.301 -178.718 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 38.3 tp 155.3 111.12 0.0 OUTLIER 'General case' 0 C--N 1.341 0.236 0 C-N-CA 131.664 3.986 . . . . 0.0 108.123 178.073 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 95' ' ' ALA . . . . . 0.535 ' H ' HG21 ' B' ' 90' ' ' VAL . . . . . . . . 0 CA--C 1.546 0.82 0 O-C-N 121.638 -0.664 . . . . 0.0 109.557 165.943 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . 0.258 4.0 pp . . . . . 0 N--CA 1.469 0.49 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.53 -46.75 89.01 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.465 1.03 . . . . 0.0 111.004 168.613 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -59.11 -38.31 79.26 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 120.452 1.478 . . . . 0.0 112.679 174.705 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -63.36 -57.47 10.23 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.036 0.834 . . . . 0.0 110.853 177.366 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -61.15 -32.34 80.12 Favored Glycine 0 CA--C 1.533 1.178 0 O-C-N 121.335 -0.853 . . . . 0.0 113.007 178.267 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -68.15 -4.04 12.47 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.295 1.548 . . . . 0.0 114.144 -178.807 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -128.31 -15.87 4.54 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 167.898 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.6 mp -101.39 -15.76 17.1 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 178.641 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.23 75.09 4.62 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.571 1.548 . . . . 0.0 107.329 167.281 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -164.46 147.92 7.69 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 123.757 0.823 . . . . 0.0 113.125 -168.441 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -63.63 -96.87 0.0 OUTLIER 'Trans proline' 0 CA--C 1.547 1.145 1 C-N-CA 125.45 4.1 . . . . 0.0 111.512 174.065 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.3 p -47.98 -35.6 11.17 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 128.12 2.568 . . . . 0.0 112.912 169.677 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.552 ' CG ' HD11 ' A' ' 58' ' ' LEU . 5.5 ttm180 -75.96 -46.71 28.33 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 121.532 1.969 . . . . 0.0 113.94 -169.17 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 37.3 t -59.17 -42.42 90.76 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.93 0.786 . . . . 0.0 109.514 169.943 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -54.66 -43.37 72.34 Favored 'General case' 0 CA--C 1.555 1.163 0 CA-C-O 117.93 -1.033 . . . . 0.0 112.641 171.251 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.1 mt -56.28 -51.7 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 CA-C-N 121.858 2.117 . . . . 0.0 110.338 172.338 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.17 -40.05 88.56 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 118.486 -0.769 . . . . 0.0 112.796 -177.165 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.6 p -81.67 -24.62 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 CA-C-N 119.637 1.108 . . . . 0.0 113.067 178.324 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.75 -31.03 63.14 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.638 1.175 . . . . 0.0 111.972 172.844 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.587 ' O ' HG13 ' A' ' 34' ' ' VAL . 1.1 tp -64.64 -39.68 94.12 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 120.787 -1.196 . . . . 0.0 113.513 170.441 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -44.6 -44.41 8.87 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.626 2.37 . . . . 0.0 114.283 -174.753 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -103.56 -19.31 14.41 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.36 1.064 . . . . 0.0 112.978 169.089 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.71 -2.28 57.41 Favored Glycine 0 C--O 1.218 -0.871 0 CA-C-O 114.992 -3.115 . . . . 0.0 117.257 -165.076 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.587 HG13 ' O ' ' A' ' 30' ' ' LEU . 19.7 m -32.99 54.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 N-CA-C 119.668 3.21 . . . . 0.0 119.668 169.418 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.9 m -109.42 -67.47 0.98 Allowed 'General case' 0 C--O 1.224 -0.287 0 O-C-N 119.828 -1.795 . . . . 0.0 110.728 -174.167 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -148.78 157.14 41.13 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-O 117.901 -1.047 . . . . 0.0 110.976 -174.456 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -55.98 -31.93 83.94 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.166 2.578 . . . . 0.0 113.827 179.121 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -81.33 -8.26 87.36 Favored Glycine 0 CA--C 1.532 1.135 0 CA-C-O 118.352 -1.249 . . . . 0.0 114.851 176.338 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.85 -37.58 84.73 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 119.554 1.677 . . . . 0.0 111.531 -170.881 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.5 mt -58.5 -24.58 60.84 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 123.699 0.8 . . . . 0.0 111.33 178.996 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.59 -36.67 67.14 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 119.265 0.938 . . . . 0.0 111.427 -175.366 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.39 -51.94 10.88 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.933 0.893 . . . . 0.0 112.529 172.756 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 3.1 m170 -53.57 -32.92 52.89 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 178.239 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.485 HD12 HG22 ' A' ' 51' ' ' VAL . 55.6 mt -97.33 -11.31 24.19 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 126.442 1.897 . . . . 0.0 112.617 -179.104 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 61.69 18.42 56.41 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-O 118.598 -1.112 . . . . 0.0 113.867 -170.812 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.8 mt -122.19 148.17 45.28 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 119.277 1.539 . . . . 0.0 113.733 -169.661 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.3 t -58.79 138.12 57.35 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.074 178.572 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.4 -24.82 65.44 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -171.325 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.7 m -63.8 -47.89 79.06 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.4 1.08 . . . . 0.0 112.687 170.196 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -75.2 -32.83 61.31 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 118.76 0.709 . . . . 0.0 111.712 178.341 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.485 HG22 HD12 ' A' ' 44' ' ' LEU . 24.9 t -58.89 -41.52 83.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 120.982 -1.074 . . . . 0.0 110.343 167.848 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 57.8 m -63.1 -40.29 97.19 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 177.844 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -51.07 -50.52 58.53 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.488 1.115 . . . . 0.0 111.572 173.405 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -69.87 -37.23 76.01 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 115.4 -2.238 . . . . 0.0 113.598 176.205 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.445 ' HA ' HD13 ' A' ' 58' ' ' LEU . 37.7 mt -61.25 -34.09 74.58 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 121.437 1.926 . . . . 0.0 113.279 175.464 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.4 m -53.12 -39.26 63.34 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.184 -0.947 . . . . 0.0 113.441 -177.797 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 3.2 t -66.99 -51.08 59.45 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 118.878 0.763 . . . . 0.0 111.085 176.603 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.618 ' H ' HD12 ' A' ' 58' ' ' LEU . 2.6 mp -59.64 -36.2 75.9 Favored 'General case' 0 N--CA 1.484 1.259 0 O-C-N 120.792 -1.192 . . . . 0.0 111.885 -175.394 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 90.4 mtm180 -76.17 -21.7 56.22 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.336 1.055 . . . . 0.0 112.71 -176.721 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.3 -36.11 4.5 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.893 1.235 . . . . 0.0 114.49 176.991 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 59.9 m -70.63 -17.03 62.88 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 125.003 1.321 . . . . 0.0 112.441 173.396 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 95.17 20.14 28.7 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 128.137 2.78 . . . . 0.0 115.782 172.295 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.1 mt -83.4 -20.38 34.27 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 119.333 1.567 . . . . 0.0 114.499 177.091 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.531 HG23 ' HB3' ' A' ' 58' ' ' LEU . 61.9 t -134.33 140.74 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 124.637 1.175 . . . . 0.0 110.612 -179.057 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.6 t -135.31 135.93 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 126.273 1.829 . . . . 0.0 108.672 -170.977 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.09 157.57 37.52 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 122.628 1.204 . . . . 0.0 112.214 172.399 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 30.3 m -153.54 154.34 34.11 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.842 1.657 . . . . 0.0 106.587 175.301 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -74.23 162.44 28.93 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.936 0.789 . . . . 0.0 112.379 169.758 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -139.91 171.32 14.38 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 126.309 1.844 . . . . 0.0 111.911 178.246 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -68.14 75.42 0.26 Allowed Glycine 0 CA--C 1.527 0.834 0 C-N-CA 125.837 1.684 . . . . 0.0 112.525 179.366 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 95.9 18.96 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 129.945 3.298 . . . . 0.0 111.987 179.7 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -158.06 -178.63 7.44 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 120.972 -1.08 . . . . 0.0 110.551 -175.17 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 32.5 m -121.76 156.48 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 124.148 0.979 . . . . 0.0 109.198 167.257 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -132.51 178.3 6.95 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 124.767 1.227 . . . . 0.0 110.452 -170.23 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -129.54 134.92 48.01 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.525 168.862 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.583 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -130.09 151.64 50.4 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 126.414 1.886 . . . . 0.0 108.834 179.596 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.12 157.76 15.22 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.257 0.48 . . . . 0.0 110.708 175.536 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -43.04 -54.61 4.23 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.748 1.619 . . . . 0.0 113.544 -178.201 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -165.7 165.66 18.47 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.834 1.653 . . . . 0.0 110.137 -173.843 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.16 -35.72 0.08 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 129.687 3.195 . . . . 0.0 111.642 165.803 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -46.53 -69.2 0.14 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.307 1.843 . . . . 0.0 113.145 169.172 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.4 mt -71.57 -34.01 69.57 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.083 0.856 . . . . 0.0 110.771 -174.487 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.65 -45.91 90.61 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 118.673 -0.68 . . . . 0.0 111.923 175.612 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.03 -43.28 71.63 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 117.318 -1.325 . . . . 0.0 111.651 176.416 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.37 -47.86 80.53 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.785 1.175 . . . . 0.0 113.238 177.063 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.25 -39.62 74.92 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.763 -0.585 . . . . 0.0 111.136 178.472 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.69 -36.79 61.83 Favored Glycine 0 CA--C 1.531 1.059 0 C-N-CA 125.311 1.434 . . . . 0.0 114.565 -176.7 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -72.68 -5.96 41.15 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.651 1.226 . . . . 0.0 112.521 172.655 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 52.0 tp 75.01 107.62 0.07 Allowed 'General case' 0 C--N 1.345 0.392 0 C-N-CA 129.764 3.226 . . . . 0.0 112.459 166.349 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.81 32.67 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 125.81 1.644 . . . . 0.0 112.328 -169.756 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 79.93 -10.8 1.25 Allowed 'General case' 0 C--O 1.221 -0.433 0 O-C-N 120.387 -1.445 . . . . 0.0 113.824 122.123 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.427 HG13 ' O ' ' A' ' 92' ' ' VAL . 12.3 p -71.94 54.08 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 C-N-CA 130.218 3.407 . . . . 0.0 109.963 166.647 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 71.92 -10.87 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 126.632 1.973 . . . . 0.0 114.355 178.268 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.3 tt 117.47 103.67 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 131.291 3.836 . . . . 0.0 106.755 -169.355 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.81 76.72 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.173 0 C-N-CA 125.115 1.366 . . . . 0.0 114.383 174.269 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.1 t -82.08 145.4 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 125.686 1.594 . . . . 0.0 107.728 167.269 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -69.82 13.99 0.12 Allowed 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 178.137 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.82 34.48 0.12 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.966 1.306 . . . . 0.0 109.771 166.74 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -57.83 130.54 46.92 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 125.254 1.422 . . . . 0.0 109.245 -166.742 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -132.31 132.78 23.1 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.958 -160.693 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -53.39 150.71 25.56 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 125.142 3.894 . . . . 0.0 117.968 -163.499 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 41.5 t . . . . . 0 CA--C 1.551 1.016 0 C-N-CA 127.066 2.146 . . . . 0.0 112.727 177.171 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 pp . . . . . 0 N--CA 1.472 0.63 0 N-CA-C 116.827 2.158 . . . . 0.0 116.827 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.01 -30.21 62.33 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 121.048 1.749 . . . . 0.0 112.404 174.0 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -57.57 -51.23 70.34 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.369 0.986 . . . . 0.0 109.69 171.305 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -58.9 -63.36 1.32 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.827 0.851 . . . . 0.0 109.563 175.797 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -59.98 -40.84 97.49 Favored Glycine 0 C--O 1.219 -0.825 0 CA-C-O 117.64 -1.644 . . . . 0.0 112.831 -169.868 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -87.07 -12.31 47.59 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.212 2.006 . . . . 0.0 114.085 -179.428 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -86.95 -31.56 20.59 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.773 1.17 . . . . 0.0 111.467 168.103 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.6 mp -83.77 -19.12 35.64 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.616 0.766 . . . . 0.0 111.207 171.899 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.16 63.73 1.89 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.29 1.836 . . . . 0.0 110.597 167.713 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -144.22 137.39 13.96 Favored Pre-proline 0 CA--C 1.547 0.841 0 N-CA-C 104.19 -2.522 . . . . 0.0 104.19 167.831 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 21' ' ' PRO . . . . . 0.406 ' HG2' ' H ' ' B' ' 22' ' ' THR . 57.1 Cg_endo -52.13 -77.42 0.02 OUTLIER 'Trans proline' 0 CA--C 1.548 1.183 1 C-N-CA 125.816 4.344 . . . . 0.0 112.703 -175.853 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.406 ' H ' ' HG2' ' B' ' 21' ' ' PRO . 2.0 p -41.19 -49.89 3.56 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 129.605 3.162 . . . . 0.0 112.586 168.251 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 37.6 ttt180 -72.95 -34.83 66.77 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.12 0.968 . . . . 0.0 111.979 -168.076 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 46.8 t -63.09 -51.48 66.46 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.19 0.905 . . . . 0.0 109.802 167.595 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -57.99 -35.01 70.61 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.034 1.334 . . . . 0.0 112.364 178.729 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 26' ' ' ILE . . . . . 0.402 HD13 HD11 ' B' ' 44' ' ' LEU . 5.3 mm -56.1 -61.87 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 125.629 1.571 . . . . 0.0 108.644 169.085 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 82.1 mt -64.36 -40.2 95.37 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.585 0.754 . . . . 0.0 111.997 -169.366 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 8.6 p -70.96 -23.97 24.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 177.311 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 29' ' ' ALA . . . . . 0.544 ' HB1' ' CD2' ' B' ' 43' ' ' HIS . . . -92.38 -21.0 20.47 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 175.32 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.469 ' O ' HG13 ' B' ' 34' ' ' VAL . 11.6 mt -58.2 -46.37 85.95 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.112 -0.993 . . . . 0.0 110.021 168.664 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.7 mt -44.66 -36.62 3.19 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 129.355 3.062 . . . . 0.0 114.484 175.193 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -100.01 -18.79 16.86 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.276 1.831 . . . . 0.0 112.751 -177.963 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -108.32 -66.97 0.6 Allowed Glycine 0 C--N 1.341 0.861 0 C-N-CA 125.203 1.382 . . . . 0.0 115.033 -170.509 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 34' ' ' VAL . . . . . 0.469 HG13 ' O ' ' B' ' 30' ' ' LEU . 15.7 m 34.3 36.1 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 C-N-CA 127.069 2.147 . . . . 0.0 115.815 -169.182 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 72.7 m -85.02 -72.63 0.47 Allowed 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.066 0.947 . . . . 0.0 112.68 -176.587 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -148.29 153.08 40.41 Favored Pre-proline 0 N--CA 1.474 0.769 0 CA-C-O 117.767 -1.111 . . . . 0.0 112.306 -169.932 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -54.39 -31.31 67.44 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 123.127 2.551 . . . . 0.0 113.783 -178.063 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -84.46 -7.04 85.25 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-O 117.868 -1.518 . . . . 0.0 115.301 175.53 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -30.4 70.9 Favored 'General case' 0 C--N 1.347 0.498 0 CA-C-N 120.534 2.167 . . . . 0.0 112.224 -170.704 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.4 mt -67.09 -13.33 61.83 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 119.082 -0.485 . . . . 0.0 111.567 -175.444 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.63 -31.71 66.53 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.286 0.948 . . . . 0.0 112.358 171.473 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.84 -48.91 13.83 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.312 0.645 . . . . 0.0 111.422 171.533 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 43' ' ' HIS . . . . . 0.544 ' CD2' ' HB1' ' B' ' 29' ' ' ALA . 5.5 m-70 -55.05 -32.38 61.84 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.731 HD12 HG22 ' B' ' 51' ' ' VAL . 67.0 mt -104.16 -23.43 13.27 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.751 1.62 . . . . 0.0 112.095 -176.077 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.65 8.63 72.6 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 124.271 0.938 . . . . 0.0 113.402 -169.073 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 92.0 mt -111.1 148.95 31.56 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 125.48 1.512 . . . . 0.0 110.674 -170.554 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.3 t -59.57 150.79 26.18 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -177.862 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -21.77 64.72 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -174.993 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 9.4 m -73.7 -41.26 62.85 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 120.952 -1.093 . . . . 0.0 112.526 169.164 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -68.82 -39.72 79.89 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.599 0.76 . . . . 0.0 110.955 174.781 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 51' ' ' VAL . . . . . 0.731 HG22 HD12 ' B' ' 44' ' ' LEU . 43.7 t -54.3 -50.46 56.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.896 0.878 . . . . 0.0 109.725 167.09 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 68.6 m -60.56 -40.38 91.44 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -178.868 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -53.99 -50.56 66.29 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.265 1.026 . . . . 0.0 112.217 -178.788 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 73.1 m-70 -79.04 -10.91 59.96 Favored 'General case' 0 CA--C 1.552 1.025 0 O-C-N 120.847 -1.158 . . . . 0.0 114.044 175.865 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 81.2 mt -80.26 -28.84 38.35 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.592 1.542 . . . . 0.0 111.651 167.422 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 68.9 m -53.74 -46.1 70.76 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 117.754 -1.117 . . . . 0.0 113.064 -176.65 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 4.0 t -72.16 -44.5 62.98 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.803 1.183 . . . . 0.0 109.579 176.91 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 3.6 tp -50.82 -38.23 47.52 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.873 2.469 . . . . 0.0 114.572 -173.26 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 47.3 mtp180 -80.74 -9.93 59.77 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.318 1.847 . . . . 0.0 112.604 -179.785 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -105.68 -32.93 3.71 Favored Glycine 0 CA--C 1.539 1.592 0 C-N-CA 127.166 2.317 . . . . 0.0 113.825 169.212 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 86.9 m -55.72 -27.68 51.76 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 126.389 1.876 . . . . 0.0 112.052 169.387 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.95 25.17 58.47 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 126.089 1.804 . . . . 0.0 112.488 -173.398 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 91.4 mt -86.83 -25.32 24.61 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.19 1.495 . . . . 0.0 113.279 175.562 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.1 m -127.61 131.85 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 124.772 1.229 . . . . 0.0 112.544 179.074 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 49.6 t -121.0 136.48 57.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.493 1.517 . . . . 0.0 109.83 -179.863 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.06 155.73 28.67 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.13 1.372 . . . . 0.0 113.35 170.571 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 87.3 m -155.15 151.55 28.38 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.853 1.661 . . . . 0.0 107.435 178.728 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -76.84 150.58 36.08 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.792 0.723 . . . . 0.0 112.25 173.886 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -125.12 170.76 10.89 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 127.001 2.12 . . . . 0.0 112.377 178.972 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -67.46 78.86 0.17 Allowed Glycine 0 CA--C 1.528 0.846 0 C-N-CA 125.221 1.391 . . . . 0.0 112.209 177.16 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 93.62 17.43 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 129.418 3.087 . . . . 0.0 112.359 178.802 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -157.07 -179.67 8.43 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.806 1.242 . . . . 0.0 109.974 -176.727 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 27.2 m -117.68 158.61 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.122 0.969 . . . . 0.0 109.328 166.608 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -131.83 176.93 7.93 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 124.851 1.26 . . . . 0.0 110.653 -175.082 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -136.34 153.88 51.01 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 125.193 1.397 . . . . 0.0 109.236 170.607 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -157.3 154.91 29.81 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 124.278 1.031 . . . . 0.0 110.871 -172.742 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -50.71 129.47 22.87 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.02 1.328 . . . . 0.0 107.581 168.362 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.18 -38.89 74.28 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 -169.563 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -151.13 163.68 38.25 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 123.1 1.428 . . . . 0.0 111.775 174.892 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.53 -36.79 0.11 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 129.761 3.225 . . . . 0.0 111.603 165.867 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -47.75 -63.94 0.92 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.198 1.799 . . . . 0.0 112.468 169.835 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 9.4 mt -71.59 -38.74 70.85 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.201 0.91 . . . . 0.0 110.369 -177.828 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.73 -47.13 77.45 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.307 0.643 . . . . 0.0 112.198 177.538 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 4.8 ppt_? -71.58 -47.54 54.14 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 117.868 -1.063 . . . . 0.0 111.589 178.706 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.62 -44.23 72.95 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.484 1.038 . . . . 0.0 113.387 176.776 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.82 -40.05 66.13 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.451 -0.781 . . . . 0.0 111.804 177.003 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.34 -36.38 50.22 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 124.935 1.255 . . . . 0.0 114.348 -174.727 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -74.01 -5.38 41.04 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 118.632 1.216 . . . . 0.0 112.548 169.855 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 50.3 tp 72.27 112.56 0.06 Allowed 'General case' 0 C--N 1.343 0.303 0 C-N-CA 129.582 3.153 . . . . 0.0 112.751 166.891 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.6 t -70.93 23.8 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 127.272 2.229 . . . . 0.0 113.186 -175.38 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 84.78 -14.89 0.58 Allowed 'General case' 0 N--CA 1.472 0.656 0 O-C-N 119.726 -1.859 . . . . 0.0 114.314 121.697 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.425 HG13 ' O ' ' B' ' 92' ' ' VAL . 8.1 p -64.34 49.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 130.492 3.517 . . . . 0.0 112.058 167.741 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 63.38 13.41 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 126.682 1.993 . . . . 0.0 114.306 -176.388 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt 100.73 108.35 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 130.004 3.322 . . . . 0.0 107.686 -169.519 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.08 0 C-N-CA 125.226 1.41 . . . . 0.0 113.022 171.181 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.8 mt . . . . . 0 CA--C 1.542 0.663 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.23 9.94 4.11 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -178.472 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.42 -35.26 6.82 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.378 0.671 . . . . 0.0 111.781 167.339 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -61.05 -51.92 67.16 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.213 1.405 . . . . 0.0 110.254 176.921 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.67 -23.83 69.2 Favored Glycine 0 CA--C 1.534 1.255 0 O-C-N 121.136 -0.977 . . . . 0.0 113.058 173.489 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.18 -33.62 65.52 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 118.872 1.336 . . . . 0.0 110.761 172.714 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -79.99 -34.46 38.54 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.637 1.175 . . . . 0.0 113.542 177.846 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 mt -63.82 -41.88 97.76 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.705 0.802 . . . . 0.0 112.486 174.895 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -94.28 -10.01 34.2 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -173.474 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.429 ' CG ' ' HD2' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -51.76 147.22 12.14 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.006 1.722 . . . . 0.0 111.344 -178.845 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.429 ' HD2' ' CG ' ' A' ' 20' ' ' ASP . 55.8 Cg_endo -35.57 -79.13 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.709 1 C-N-CA 127.864 5.71 . . . . 0.0 113.112 -166.804 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.9 p -81.24 -22.26 38.89 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 116.42 -1.752 . . . . 0.0 113.23 178.385 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.4 mtm-85 -63.33 -45.6 90.55 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 121.531 1.968 . . . . 0.0 111.67 175.98 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 25.1 t -50.8 -48.63 59.51 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.611 1.096 . . . . 0.0 110.749 169.545 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.1 mtm-85 -62.41 -47.75 82.72 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.467 1.107 . . . . 0.0 113.521 176.997 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.1 mm -53.13 -47.11 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.613 1.565 . . . . 0.0 110.863 170.319 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.567 HD22 HD21 ' A' ' 77' ' ' LEU . 48.8 mt -70.15 -43.02 71.74 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 117.746 -1.121 . . . . 0.0 112.769 -177.711 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.4 p -73.0 -25.99 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 119.95 1.25 . . . . 0.0 111.195 179.21 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.49 -12.95 59.48 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.743 1.217 . . . . 0.0 113.014 169.473 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.496 ' O ' HG13 ' A' ' 34' ' ' VAL . 13.1 tp -82.42 -36.49 26.61 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 116.948 -1.501 . . . . 0.0 112.139 169.223 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -43.48 -58.17 2.73 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.005 2.122 . . . . 0.0 112.881 -175.463 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -98.22 9.28 43.33 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.662 1.585 . . . . 0.0 112.403 172.975 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -108.54 -33.89 2.79 Favored Glycine 0 C--N 1.342 0.865 0 CA-C-O 114.585 -3.342 . . . . 0.0 117.92 -168.344 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.496 HG13 ' O ' ' A' ' 30' ' ' LEU . 33.9 m -15.59 43.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.069 2 C-N-CA 132.251 4.22 . . . . 0.0 122.122 175.801 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.8 m -95.78 -60.39 1.66 Allowed 'General case' 0 C--N 1.327 -0.386 0 O-C-N 118.763 -2.461 . . . . 0.0 111.514 178.205 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -146.41 151.55 43.9 Favored Pre-proline 0 N--CA 1.476 0.845 0 N-CA-C 116.633 2.086 . . . . 0.0 116.633 -169.214 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -63.83 133.1 37.45 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 123.479 2.786 . . . . 0.0 110.744 178.321 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.5 -2.62 52.52 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-O 118.753 -1.026 . . . . 0.0 114.444 -176.882 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -58.52 -28.91 65.88 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.344 1.572 . . . . 0.0 112.882 179.272 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mp -69.25 -2.52 10.81 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 122.481 0.312 . . . . 0.0 111.499 -172.067 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.99 -38.16 90.05 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.13 0.572 . . . . 0.0 110.541 169.091 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.94 -36.06 64.63 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.441 0.697 . . . . 0.0 111.999 170.708 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -66.73 -36.52 82.67 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 177.301 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.1 mt -105.03 -20.72 13.44 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -172.563 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.79 11.22 83.49 Favored Glycine 0 CA--C 1.537 1.416 0 CA-C-N 119.46 1.027 . . . . 0.0 113.091 -168.451 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.5 mt -100.75 148.18 25.19 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.697 1.199 . . . . 0.0 111.46 -176.963 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.435 HG23 ' H ' ' A' ' 50' ' ' ASN . 4.2 t -61.15 144.04 54.38 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 122.16 0.981 . . . . 0.0 111.891 -172.84 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.78 -20.15 54.91 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.222 1.009 . . . . 0.0 113.589 179.468 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.5 p -70.78 -60.12 2.42 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.442 1.019 . . . . 0.0 109.414 167.083 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.435 ' H ' HG23 ' A' ' 47' ' ' THR . 18.5 t-20 -54.32 -42.08 69.76 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.71 1.604 . . . . 0.0 114.684 178.481 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 5.0 t -64.32 -41.21 91.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 O-C-N 119.876 -1.765 . . . . 0.0 111.813 171.898 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 55.0 m -62.45 -43.36 99.01 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 119.159 0.89 . . . . 0.0 112.071 173.612 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -55.74 -45.36 78.02 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 127.004 2.121 . . . . 0.0 112.261 175.678 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 23.6 m170 -64.33 -40.51 96.04 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.149 -0.969 . . . . 0.0 112.863 171.693 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.6 mt -67.36 -25.32 65.92 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 118.691 0.678 . . . . 0.0 112.349 178.068 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.3 m -62.08 -44.76 95.97 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.213 1.37 . . . . 0.0 114.364 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 42.8 t -60.37 -54.0 50.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.975 1.31 . . . . 0.0 110.482 169.508 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.437 ' HG ' HD21 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -51.22 -42.59 61.06 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 128.535 2.734 . . . . 0.0 113.677 -177.668 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 9.1 mtm-85 -83.26 -4.4 58.39 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.538 1.535 . . . . 0.0 113.143 178.802 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -110.05 -26.31 5.0 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 126.236 1.874 . . . . 0.0 114.107 174.092 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 2.6 m -74.51 -1.46 21.44 Favored 'General case' 0 CA--C 1.564 1.504 0 C-N-CA 129.928 3.291 . . . . 0.0 111.724 168.86 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.82 14.45 37.37 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 126.184 1.849 . . . . 0.0 113.571 -175.122 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.9 mt -69.07 -30.23 68.51 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.458 -1.025 . . . . 0.0 111.676 172.777 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.8 t -134.43 132.44 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.902 0.881 . . . . 0.0 112.814 -167.472 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 89.0 t -126.61 141.13 46.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 126.058 1.743 . . . . 0.0 111.098 -168.074 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -93.68 148.7 21.86 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.202 1.401 . . . . 0.0 113.045 173.99 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.8 m -169.61 152.77 4.78 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.649 1.98 . . . . 0.0 107.119 -175.713 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -79.91 141.42 36.1 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 119.853 1.206 . . . . 0.0 112.895 174.788 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.263 0.0 OUTLIER -89.47 -17.94 27.7 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 122.603 0.361 . . . . 0.0 111.444 166.588 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 123.0 -30.26 5.1 Favored Glycine 0 N--CA 1.474 1.208 0 C-N-CA 126.592 2.044 . . . . 0.0 114.24 169.444 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.38 -15.96 14.88 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 128.226 2.611 . . . . 0.0 112.08 172.919 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -158.6 167.0 30.75 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 129.397 3.079 . . . . 0.0 109.469 -176.256 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 6.0 p -91.96 150.62 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.221 1.009 . . . . 0.0 109.908 168.543 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 12.3 ptt85 -126.49 163.93 22.28 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.95 0.881 . . . . 0.0 111.405 -176.422 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -111.28 156.41 21.55 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 114.294 -1.321 . . . . 0.0 107.584 164.519 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.474 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -163.19 151.22 13.57 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.143 0.977 . . . . 0.0 109.902 -176.413 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.567 HD21 HD22 ' A' ' 27' ' ' LEU . 14.5 mt -57.44 152.14 15.11 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 119.009 0.822 . . . . 0.0 109.02 167.314 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.14 -33.11 73.87 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -170.065 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -169.85 163.21 9.66 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.396 1.478 . . . . 0.0 112.684 -174.243 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 98.3 p -42.69 -33.81 0.79 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 128.491 2.717 . . . . 0.0 114.34 166.931 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -52.98 -52.09 59.42 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.864 1.666 . . . . 0.0 112.25 170.494 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 35.2 mt -73.0 -39.66 65.85 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 118.934 -0.555 . . . . 0.0 109.794 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.46 -44.52 72.61 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.441 1.096 . . . . 0.0 113.295 178.905 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -65.71 -49.8 67.18 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 120.007 1.276 . . . . 0.0 112.615 178.865 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.81 -44.99 83.98 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.46 1.027 . . . . 0.0 112.471 -179.46 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -64.84 -37.88 89.09 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.879 0.872 . . . . 0.0 110.714 176.605 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.9 -22.06 64.11 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 126.118 1.818 . . . . 0.0 114.102 176.996 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -115.75 23.5 12.25 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.129 1.372 . . . . 0.0 112.659 170.098 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.536 ' O ' HG13 ' A' ' 90' ' ' VAL . 30.6 tp 76.53 -38.85 0.33 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 128.969 2.908 . . . . 0.0 112.92 171.205 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.536 HG13 ' O ' ' A' ' 89' ' ' LEU . 2.6 m 160.96 -19.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.262 1 C-N-CA 132.312 4.245 . . . . 0.0 111.207 -170.389 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 93.59 -8.18 0.14 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 129.486 3.115 . . . . 0.0 113.533 175.96 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.1 p -66.85 41.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 C-N-CA 128.105 2.562 . . . . 0.0 116.646 -172.339 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER 71.09 13.5 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 C-N-CA 126.56 1.944 . . . . 0.0 112.371 174.138 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 88.91 95.13 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 130.111 3.364 . . . . 0.0 108.883 179.521 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.4 139.8 49.88 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.155 179.156 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.4 m -85.34 152.87 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 122.378 1.085 . . . . 0.0 111.492 179.239 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -79.84 12.35 2.72 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.472 1.509 . . . . 0.0 114.925 -168.749 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.9 m -104.29 47.35 0.88 Allowed 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.587 1.555 . . . . 0.0 109.863 -176.243 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -49.93 88.57 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 129.123 2.969 . . . . 0.0 113.14 -167.734 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -106.96 152.88 41.11 Favored Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 113.998 1.111 . . . . 0.0 113.998 -164.985 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -88.58 117.94 0.98 Allowed 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 122.087 1.858 . . . . 0.0 113.746 -175.24 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . 0.558 3.3 t . . . . . 0 N--CA 1.438 -1.045 0 CA-C-N 111.344 -2.662 . . . . 0.0 113.854 -161.302 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 87.8 mt . . . . . 0 CA--C 1.536 0.43 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.28 -4.24 13.59 Favored 'General case' 0 CA--C 1.549 0.904 0 O-C-N 120.71 -1.244 . . . . 0.0 114.104 172.525 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.74 -43.74 13.11 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 120.597 -1.314 . . . . 0.0 109.038 163.078 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.12 -49.1 73.51 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.148 1.779 . . . . 0.0 111.21 -174.539 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.56 -7.27 46.34 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 123.866 0.746 . . . . 0.0 114.443 172.618 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.38 -45.22 9.63 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.158 1.383 . . . . 0.0 108.75 168.143 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.16 -42.35 76.03 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.187 1.795 . . . . 0.0 114.446 -176.867 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -39.54 94.49 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.147 0.979 . . . . 0.0 111.29 178.59 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -98.37 -2.99 37.97 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.929 1.291 . . . . 0.0 114.449 -173.415 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 20' ' ' ASP . . . . . 0.481 ' CG ' ' HD2' ' B' ' 21' ' ' PRO . 0.3 OUTLIER -55.12 147.72 33.45 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 125.623 1.569 . . . . 0.0 112.525 177.882 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 21' ' ' PRO . . . . . 0.481 ' HD2' ' CG ' ' B' ' 20' ' ' ASP . 41.0 Cg_endo -37.66 -69.89 0.07 OUTLIER 'Trans proline' 0 C--N 1.354 0.824 1 C-N-CA 127.416 5.411 . . . . 0.0 113.407 -167.629 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.407 ' H ' ' HG2' ' B' ' 21' ' ' PRO . 2.2 p -90.65 -20.7 22.22 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 125.863 1.665 . . . . 0.0 112.95 179.731 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 9.3 mtm-85 -66.34 -42.85 87.56 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 121.493 1.951 . . . . 0.0 111.848 177.266 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 40.5 t -54.61 -49.67 69.91 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.36 0.982 . . . . 0.0 110.97 169.88 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -58.05 -54.23 49.34 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.157 0.983 . . . . 0.0 112.65 177.178 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 4.4 mm -45.76 -54.02 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 126.221 1.808 . . . . 0.0 111.175 169.87 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.592 HD22 HD21 ' B' ' 77' ' ' LEU . 42.5 mt -68.3 -37.44 80.61 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 117.806 -1.093 . . . . 0.0 113.434 -173.72 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.1 p -76.2 -27.4 17.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 CA-C-N 119.731 1.151 . . . . 0.0 111.434 176.961 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.97 -23.06 52.34 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.107 0.963 . . . . 0.0 112.858 173.075 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.435 ' O ' HG13 ' B' ' 34' ' ' VAL . 5.5 tp -73.5 -33.51 64.83 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 119.807 1.185 . . . . 0.0 113.76 171.187 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -45.52 -54.51 7.4 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.03 2.132 . . . . 0.0 113.299 -168.781 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -97.2 -11.42 24.26 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.415 1.486 . . . . 0.0 112.138 169.507 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -97.61 2.51 60.61 Favored Glycine 0 C--N 1.342 0.889 0 CA-C-O 116.64 -2.2 . . . . 0.0 118.235 -167.907 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 34' ' ' VAL . . . . . 0.435 HG13 ' O ' ' B' ' 30' ' ' LEU . 29.7 m -38.49 40.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.059 1 C-N-CA 131.81 4.044 . . . . 0.0 119.014 167.537 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 51.2 m -83.78 -74.5 0.37 Allowed 'General case' 0 C--O 1.223 -0.318 0 O-C-N 119.713 -1.867 . . . . 0.0 111.309 179.173 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.51 163.39 50.21 Favored Pre-proline 0 CA--C 1.547 0.829 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -169.889 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -63.1 130.18 28.12 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.158 1.906 . . . . 0.0 110.104 178.881 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.35 5.62 67.59 Favored Glycine 0 CA--C 1.538 1.49 0 CA-C-O 118.133 -1.371 . . . . 0.0 115.708 -178.304 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -25.2 64.43 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 120.124 1.962 . . . . 0.0 113.24 -177.457 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.8 mt -52.96 -20.1 3.13 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 125.946 1.698 . . . . 0.0 112.01 176.712 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.36 -30.44 70.53 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.312 0.645 . . . . 0.0 112.532 177.738 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.99 -50.82 11.38 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.39 0.676 . . . . 0.0 110.791 169.43 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -55.37 -38.38 68.76 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 -177.798 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.2 mt -96.83 -19.65 18.73 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.707 1.603 . . . . 0.0 112.756 -177.125 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.07 11.66 67.32 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-N 119.205 0.911 . . . . 0.0 113.2 -168.997 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 97.0 mt -102.13 141.11 35.5 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.115 1.366 . . . . 0.0 110.973 -174.276 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.401 HG23 ' H ' ' B' ' 50' ' ' ASN . 4.0 t -57.69 143.09 42.94 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.158 0.98 . . . . 0.0 112.186 -171.23 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.94 -19.13 39.96 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.755 1.222 . . . . 0.0 113.634 -179.463 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 7.5 p -72.29 -62.8 1.31 Allowed 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.656 1.116 . . . . 0.0 109.255 166.904 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 50' ' ' ASN . . . . . 0.401 ' H ' HG23 ' B' ' 47' ' ' THR . 10.1 t-20 -46.99 -46.84 21.95 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.433 1.493 . . . . 0.0 113.658 176.091 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.87 -40.52 89.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 O-C-N 120.474 -1.391 . . . . 0.0 112.661 175.507 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.0 m -66.74 -37.81 85.38 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 118.588 0.631 . . . . 0.0 111.645 176.156 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 9.5 m-20 -58.96 -45.03 91.51 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.0 1.72 . . . . 0.0 112.19 173.322 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -64.63 -40.93 96.33 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 120.403 -1.435 . . . . 0.0 112.967 172.129 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 49.6 mt -67.3 -31.32 71.53 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 179.291 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 37.6 m -61.22 -28.11 68.92 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -178.569 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 47.8 t -71.36 -51.31 24.89 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.075 0.95 . . . . 0.0 110.747 169.379 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 58' ' ' LEU . . . . . 0.412 ' HB3' HG22 ' B' ' 64' ' ' VAL . 4.5 mp -63.43 -40.3 96.81 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.389 2.275 . . . . 0.0 112.746 -171.957 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 60.7 mtm-85 -75.06 -5.7 45.53 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.593 1.157 . . . . 0.0 112.965 174.321 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -104.53 -38.07 2.68 Favored Glycine 0 N--CA 1.472 1.07 0 C-N-CA 124.718 1.151 . . . . 0.0 112.146 171.809 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 7.3 m -61.51 -6.94 2.69 Favored 'General case' 0 CA--C 1.56 1.353 0 C-N-CA 128.349 2.66 . . . . 0.0 113.409 169.471 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.02 13.66 62.21 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 125.217 1.389 . . . . 0.0 113.716 -175.561 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 83.6 mt -70.94 -26.12 63.04 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.593 1.196 . . . . 0.0 112.632 178.003 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.412 HG22 ' HB3' ' B' ' 58' ' ' LEU . 2.6 m -141.41 142.8 28.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.353 1.461 . . . . 0.0 111.558 -174.595 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 68.9 t -122.83 140.19 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 127.433 2.293 . . . . 0.0 109.253 -174.335 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -92.97 146.5 23.57 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.343 1.057 . . . . 0.0 112.425 170.126 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 2.4 m -167.47 168.42 12.97 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.079 2.151 . . . . 0.0 107.534 -172.888 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.44 ' HA ' ' HA ' ' B' ' 73' ' ' VAL . 13.0 m-85 -81.19 155.35 26.2 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 174.746 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.04 -26.58 14.19 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.629 0.772 . . . . 0.0 109.144 162.28 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 141.19 -31.74 2.14 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 127.575 2.512 . . . . 0.0 113.738 171.412 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.58 -18.9 11.82 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 129.518 3.127 . . . . 0.0 112.503 178.604 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -150.72 167.71 26.55 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 129.696 3.198 . . . . 0.0 109.026 -179.576 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 73' ' ' VAL . . . . . 0.44 ' HA ' ' HA ' ' B' ' 68' ' ' TYR . 14.3 m -85.1 165.31 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 O-C-N 121.666 -0.646 . . . . 0.0 111.087 167.544 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 21.6 ptt85 -138.11 167.91 20.82 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 127.07 2.148 . . . . 0.0 109.872 -179.438 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -119.02 133.03 56.07 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.738 1.215 . . . . 0.0 108.326 168.167 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 76' ' ' ALA . . . . . 0.432 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -136.25 151.25 49.47 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.479 1.112 . . . . 0.0 109.82 179.097 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.592 HD21 HD22 ' B' ' 27' ' ' LEU . 13.0 mt -55.5 149.0 14.32 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 168.735 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.43 -36.59 82.89 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -169.903 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -162.34 163.37 27.95 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.624 1.57 . . . . 0.0 112.23 178.366 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 95.6 p -44.22 -32.47 1.27 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.109 2.564 . . . . 0.0 113.546 167.643 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -52.89 -49.71 65.34 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 125.245 1.418 . . . . 0.0 112.507 170.512 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 21.4 mt -72.47 -46.94 52.48 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.964 0.802 . . . . 0.0 109.636 179.11 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.17 -40.2 64.18 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 117.776 -1.107 . . . . 0.0 113.738 -177.041 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -69.48 -47.35 64.18 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 120.408 1.458 . . . . 0.0 113.385 178.248 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.1 -43.26 95.89 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 118.928 0.785 . . . . 0.0 111.192 -179.267 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.54 -52.3 64.18 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.776 1.63 . . . . 0.0 110.374 170.919 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.94 -14.03 58.1 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.812 1.196 . . . . 0.0 114.567 -176.048 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . 0.257 20.7 pt-20 -114.91 18.48 16.42 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 169.876 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 21.4 tp 63.66 2.12 1.2 Allowed 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 128.522 2.729 . . . . 0.0 115.361 167.269 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 1.7 t 74.31 33.47 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 126.586 1.954 . . . . 0.0 110.37 -171.511 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 91' ' ' GLN . . . . . 0.405 ' C ' ' H ' ' B' ' 93' ' ' VAL . 0.8 OUTLIER 81.68 -14.07 0.83 Allowed 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 115.241 1.571 . . . . 0.0 115.241 118.417 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 13.1 p -67.46 39.09 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 129.558 3.143 . . . . 0.0 113.415 174.103 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 93' ' ' VAL . . . . . 0.405 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.2 OUTLIER 72.44 26.67 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 128.063 2.545 . . . . 0.0 113.182 177.001 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 84.36 90.15 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.77 2.028 . . . . 0.0 109.368 -177.724 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.613 0 CA-C-N 114.521 -1.218 . . . . 0.0 113.421 178.517 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.684 0 CA-C-O 120.376 0.131 . . . . 0.0 111.317 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.79 -18.22 60.5 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.281 1.832 . . . . 0.0 113.946 179.504 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.31 -57.23 3.46 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.464 1.105 . . . . 0.0 109.195 167.402 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -55.25 -63.53 1.13 Allowed 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 126.645 1.978 . . . . 0.0 110.331 -174.225 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -60.81 -36.21 91.5 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.641 -0.583 . . . . 0.0 111.641 -172.281 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 16.3 ttt85 -67.33 -50.97 57.88 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.839 0.856 . . . . 0.0 111.226 179.761 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.85 -27.02 67.79 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 176.641 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.4 mp -90.98 -12.47 35.81 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.447 1.099 . . . . 0.0 113.567 174.282 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.56 -20.15 40.52 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.7 1.2 . . . . 0.0 114.058 169.888 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -72.63 140.41 81.57 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 126.835 2.054 . . . . 0.0 109.424 174.261 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -53.03 -84.89 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.647 1 C-N-CA 126.696 4.931 . . . . 0.0 113.738 -166.621 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 52.1 m -70.3 -15.43 62.89 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 124.551 1.141 . . . . 0.0 111.134 -179.701 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -68.63 -40.2 80.42 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 120.378 -1.452 . . . . 0.0 113.312 -177.854 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 13.2 t -59.28 -40.21 85.38 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 121.806 0.812 . . . . 0.0 110.806 169.432 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.484 ' HB3' HD22 ' A' ' 44' ' ' LEU . 12.4 mmp_? -66.64 -41.27 88.54 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 172.879 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.424 HD11 ' HA ' ' A' ' 51' ' ' VAL . 5.1 mm -50.63 -44.38 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 120.077 -1.639 . . . . 0.0 111.412 171.328 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.26 -24.95 67.46 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 175.28 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -78.66 -29.51 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 124.77 1.228 . . . . 0.0 112.729 171.25 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.89 -32.46 63.6 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.494 0.717 . . . . 0.0 112.717 178.855 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.471 HD23 HG11 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -85.92 -10.42 55.26 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 173.226 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.07 -23.52 63.83 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-O 119.505 -0.283 . . . . 0.0 111.401 165.622 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -124.19 -59.52 1.48 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 127.768 2.427 . . . . 0.0 114.564 -171.92 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.05 -74.77 0.63 Allowed Glycine 0 N--CA 1.468 0.818 0 C-N-CA 125.354 1.455 . . . . 0.0 113.226 -165.86 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.9 m 45.88 33.66 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 C-N-CA 125.851 1.66 . . . . 0.0 113.815 -179.001 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.2 m -82.61 -51.63 7.57 Favored 'General case' 0 C--O 1.226 -0.157 0 O-C-N 120.932 -1.105 . . . . 0.0 112.046 -175.56 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 50.3 p90 -165.69 157.2 12.42 Favored Pre-proline 0 N--CA 1.477 0.894 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -169.78 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -61.73 104.43 0.32 Allowed 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 123.868 3.045 . . . . 0.0 110.128 173.937 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 113.86 -11.5 22.87 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-O 118.021 -1.433 . . . . 0.0 114.651 -175.01 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.72 -34.08 69.11 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.651 2.226 . . . . 0.0 111.349 175.079 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.688 HD12 ' H ' ' A' ' 40' ' ' LEU . 0.5 OUTLIER -62.8 -21.06 65.61 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 126.22 1.808 . . . . 0.0 111.985 -178.317 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.19 -30.02 69.02 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.431 0.692 . . . . 0.0 111.786 -179.581 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.37 -44.85 61.97 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.527 0.331 . . . . 0.0 110.344 169.87 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -62.59 -35.53 79.82 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -179.174 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.484 HD22 ' HB3' ' A' ' 25' ' ' ARG . 26.0 mt -103.27 -16.38 15.69 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -174.363 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.56 -2.08 54.99 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-O 118.072 -1.404 . . . . 0.0 114.341 -175.409 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 mp -105.6 148.43 27.32 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.561 1.68 . . . . 0.0 110.947 177.23 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.444 HG23 ' H ' ' A' ' 50' ' ' ASN . 13.5 t -54.83 151.24 8.77 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.356 1.063 . . . . 0.0 113.005 -173.252 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -50.13 -23.25 2.04 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.054 1.741 . . . . 0.0 113.839 169.498 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 14.7 m -69.22 -56.99 5.96 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.461 1.028 . . . . 0.0 111.85 170.395 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.444 ' H ' HG23 ' A' ' 47' ' ' THR . 16.0 t-20 -61.9 -42.85 99.56 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.461 1.028 . . . . 0.0 112.074 176.113 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.424 ' HA ' HD11 ' A' ' 26' ' ' ILE . 2.5 t -53.26 -48.16 55.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 123.834 0.854 . . . . 0.0 111.166 172.01 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 51.1 m -66.26 -35.96 81.75 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 177.559 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -60.4 -52.46 65.13 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.006 0.922 . . . . 0.0 110.097 176.579 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -68.36 -27.38 66.2 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 120.332 -1.48 . . . . 0.0 113.777 176.648 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 36.4 mt -70.42 -20.86 62.89 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 120.378 1.444 . . . . 0.0 113.311 167.862 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.2 t -63.19 -51.81 64.86 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 120.189 1.359 . . . . 0.0 112.973 -169.175 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 42.0 t -54.74 -51.25 66.25 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 123.956 1.836 . . . . 0.0 110.018 174.822 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.411 ' HB3' ' CG2' ' A' ' 64' ' ' VAL . 1.0 OUTLIER -48.36 -41.48 28.8 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 130.797 3.639 . . . . 0.0 113.628 -177.081 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 80.1 mtm-85 -78.86 -24.14 44.52 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 179.423 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.12 -54.69 2.1 Favored Glycine 0 N--CA 1.471 0.974 0 CA-C-N 119.181 0.9 . . . . 0.0 111.271 177.78 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 73.0 m -67.29 -3.69 8.69 Favored 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 127.119 2.168 . . . . 0.0 112.135 -178.853 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 86.01 10.57 74.99 Favored Glycine 0 C--N 1.34 0.792 0 C-N-CA 127.293 2.378 . . . . 0.0 116.304 164.791 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.8 mt -70.56 -22.75 62.56 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 119.6 1.7 . . . . 0.0 113.127 178.024 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.471 HG11 HD23 ' A' ' 30' ' ' LEU . 2.8 m -133.53 156.13 41.2 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 126.952 2.101 . . . . 0.0 113.088 171.454 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.3 t -133.47 153.44 37.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 127.744 2.418 . . . . 0.0 109.748 -179.57 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.52 145.65 26.02 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.822 1.649 . . . . 0.0 112.512 175.224 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.466 ' HB ' ' HG2' ' A' ' 74' ' ' ARG . 9.6 m -140.86 144.66 35.43 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.677 1.191 . . . . 0.0 109.285 -177.836 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -80.75 115.86 20.46 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.985 0.421 . . . . 0.0 110.803 167.89 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -88.54 166.08 14.41 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.25 1.42 . . . . 0.0 110.531 168.854 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -66.69 15.28 0.32 Allowed Glycine 0 N--CA 1.481 1.677 0 N-CA-C 117.035 1.574 . . . . 0.0 117.035 -169.59 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.61 -1.13 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.831 2.053 . . . . 0.0 114.185 178.229 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -168.55 164.8 12.49 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 126.172 1.789 . . . . 0.0 108.783 -168.959 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 34.5 m -94.68 156.42 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 CA-C-N 119.856 1.207 . . . . 0.0 110.626 168.834 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.466 ' HG2' ' HB ' ' A' ' 67' ' ' THR . 9.8 ptt180 -127.26 178.34 6.11 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.379 1.071 . . . . 0.0 112.65 -179.424 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -124.7 128.82 49.4 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.367 1.467 . . . . 0.0 108.384 165.236 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.02 157.43 41.73 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.291 1.037 . . . . 0.0 109.946 173.83 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.474 ' HB3' ' CD1' ' A' ' 82' ' ' LEU . 0.3 OUTLIER -66.61 153.6 42.65 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.339 0.518 . . . . 0.0 109.813 170.968 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.02 -36.18 79.52 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -168.584 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -158.71 158.81 34.42 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 123.378 1.561 . . . . 0.0 113.244 176.641 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -35.21 -39.23 0.11 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 130.25 3.42 . . . . 0.0 112.701 165.724 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -44.29 -66.12 0.43 Allowed 'General case' 0 C--N 1.342 0.275 0 C-N-CA 127.862 2.465 . . . . 0.0 112.647 169.519 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.474 ' CD1' ' HB3' ' A' ' 77' ' ' LEU . 1.2 pp -79.39 -25.39 42.15 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 118.576 -0.726 . . . . 0.0 112.626 -172.502 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.48 -45.77 89.23 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 122.71 0.404 . . . . 0.0 110.428 167.855 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 24.7 ttp85 -62.87 -54.0 45.54 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.618 1.167 . . . . 0.0 111.968 178.063 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.48 -35.97 79.14 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -175.707 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.25 -42.02 66.12 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.567 -0.708 . . . . 0.0 111.009 172.894 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.05 -43.88 98.16 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.824 1.678 . . . . 0.0 114.585 -178.409 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -76.06 -2.02 28.75 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.556 1.142 . . . . 0.0 113.482 174.263 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 34.2 tp 76.08 124.8 0.04 OUTLIER 'General case' 0 C--N 1.345 0.378 0 C-N-CA 130.136 3.374 . . . . 0.0 110.914 168.473 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 46.4 t -75.62 21.69 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 CA-C-O 123.465 1.602 . . . . 0.0 112.233 -169.521 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 84.99 -12.63 0.71 Allowed 'General case' 0 C--O 1.219 -0.534 0 O-C-N 120.038 -1.664 . . . . 0.0 111.467 130.662 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 12.7 p -68.35 46.81 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 C-N-CA 129.75 3.22 . . . . 0.0 111.14 164.672 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 69.71 -42.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 C-N-CA 130.486 3.514 . . . . 0.0 112.806 -169.893 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.1 tt 168.14 104.69 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 130.674 3.59 . . . . 0.0 106.03 -169.486 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.98 82.57 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.122 0 O-C-N 121.285 -0.885 . . . . 0.0 112.147 169.163 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 18.0 m -45.21 163.41 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 130.302 3.441 . . . . 0.0 116.788 -178.482 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -90.62 73.12 6.79 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.311 1.444 . . . . 0.0 109.263 166.444 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . 0.261 0.3 OUTLIER 172.8 138.83 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 128.477 2.711 . . . . 0.0 112.836 168.454 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -88.34 26.56 1.4 Allowed 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 130.526 3.53 . . . . 0.0 113.34 -171.244 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -33.43 134.82 0.32 Allowed Pre-proline 0 N--CA 1.483 1.176 0 C-N-CA 126.529 1.932 . . . . 0.0 112.821 -174.801 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -60.24 149.14 87.08 Favored 'Trans proline' 0 C--N 1.355 0.9 1 C-N-CA 126.12 4.546 . . . . 0.0 118.997 -164.94 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.809 0 C-N-CA 125.286 1.434 . . . . 0.0 109.551 170.135 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 pt? . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.26 -17.06 63.1 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.451 1.501 . . . . 0.0 112.967 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.43 -55.33 4.21 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.928 0.891 . . . . 0.0 110.216 167.439 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -54.93 -61.72 2.13 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.47 1.508 . . . . 0.0 110.716 -176.136 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.61 -38.63 95.93 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 111.781 -0.528 . . . . 0.0 111.781 -170.68 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 14.2 ttm105 -60.49 -48.51 81.46 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.704 1.602 . . . . 0.0 111.108 176.547 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.16 -29.94 69.78 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 177.51 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.0 mp -88.84 -8.0 55.11 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 113.858 1.058 . . . . 0.0 113.858 175.614 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -88.22 -15.64 35.39 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.637 1.575 . . . . 0.0 114.362 172.803 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -78.0 146.0 70.81 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 126.301 1.84 . . . . 0.0 110.825 174.33 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -59.13 -82.03 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.67 1 C-N-CA 126.474 4.783 . . . . 0.0 112.55 -168.974 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 5.7 m -59.42 -29.58 67.86 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.155 0.982 . . . . 0.0 111.114 176.48 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.407 ' HE ' ' HA ' ' B' ' 54' ' ' HIS . 11.0 ttm180 -66.74 -41.03 88.5 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -171.444 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 5.3 t -57.78 -47.24 83.12 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-O 122.238 1.018 . . . . 0.0 110.152 169.565 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 25' ' ' ARG . . . . . 0.436 ' HB3' HD22 ' B' ' 44' ' ' LEU . 11.2 mmp_? -63.05 -36.43 83.55 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.561 1.689 . . . . 0.0 115.561 175.911 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 4.8 mm -49.64 -41.4 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 120.319 -1.488 . . . . 0.0 111.91 173.283 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 83.0 mt -72.67 -29.62 63.57 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 112.808 0.669 . . . . 0.0 112.808 176.434 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 28' ' ' VAL . . . . . 0.426 HG23 HD22 ' B' ' 86' ' ' LEU . 0.3 OUTLIER -78.19 -25.59 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 O-C-N 120.585 -1.322 . . . . 0.0 112.096 176.46 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.77 -57.61 4.9 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.495 1.518 . . . . 0.0 108.822 168.337 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.411 HD12 HG11 ' B' ' 64' ' ' VAL . 10.4 mt -61.24 -23.38 65.6 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 117.163 2.282 . . . . 0.0 117.163 -176.126 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 31' ' ' LEU . . . . . 0.593 ' HA ' HD11 ' B' ' 77' ' ' LEU . 0.3 OUTLIER -42.5 -32.74 0.58 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 125.951 1.701 . . . . 0.0 112.109 168.427 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -120.05 -30.24 4.73 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 128.278 2.631 . . . . 0.0 112.324 168.563 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.8 21.55 1.58 Allowed Glycine 0 N--CA 1.465 0.633 0 C-N-CA 128.819 3.104 . . . . 0.0 115.39 -164.66 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 34' ' ' VAL . . . . . 0.575 HG12 ' HA ' ' B' ' 76' ' ' ALA . 13.3 m -64.87 29.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 C-N-CA 127.371 2.268 . . . . 0.0 114.613 173.818 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -85.17 -64.16 1.2 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.382 1.073 . . . . 0.0 111.457 -176.753 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 55.4 p90 -165.84 154.71 10.47 Favored Pre-proline 0 CA--C 1.545 0.751 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 -170.007 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -58.45 118.74 5.68 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 123.207 2.605 . . . . 0.0 109.894 175.971 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 94.22 -8.94 72.55 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-O 117.619 -1.656 . . . . 0.0 114.899 -174.64 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.67 -36.73 69.92 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 120.918 2.359 . . . . 0.0 110.545 172.855 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.694 ' H ' HD12 ' B' ' 40' ' ' LEU . 0.4 OUTLIER -61.6 -19.09 61.84 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 126.14 1.776 . . . . 0.0 112.361 -175.688 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.87 -31.27 71.76 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.145 0.578 . . . . 0.0 111.826 176.447 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.37 -43.81 59.9 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.661 0.384 . . . . 0.0 110.824 170.585 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -63.44 -33.41 75.51 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 44' ' ' LEU . . . . . 0.436 HD22 ' HB3' ' B' ' 25' ' ' ARG . 36.1 mt -104.35 -18.37 14.46 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.558 1.143 . . . . 0.0 113.725 -174.761 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.94 -0.72 61.48 Favored Glycine 0 CA--C 1.526 0.747 0 CA-C-O 118.156 -1.358 . . . . 0.0 113.756 -174.216 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 8.3 mp -107.2 143.32 35.59 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.031 1.415 . . . . 0.0 110.834 177.213 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.443 HG23 ' H ' ' B' ' 50' ' ' ASN . 9.8 t -51.35 149.97 3.78 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 126.189 1.796 . . . . 0.0 113.461 -173.295 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -49.12 -22.33 0.93 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.397 1.879 . . . . 0.0 113.458 169.372 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.4 m -67.22 -63.64 1.02 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.59 1.156 . . . . 0.0 112.374 169.516 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 50' ' ' ASN . . . . . 0.443 ' H ' HG23 ' B' ' 47' ' ' THR . 28.4 t-20 -65.04 -36.65 85.03 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.75 -1.219 . . . . 0.0 112.404 178.211 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.3 t -54.58 -48.79 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 122.963 0.505 . . . . 0.0 110.422 168.71 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.9 m -66.61 -38.81 87.76 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 117.809 -1.091 . . . . 0.0 113.926 177.508 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -54.36 -54.52 39.37 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.107 0.867 . . . . 0.0 109.692 174.57 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 54' ' ' HIS . . . . . 0.407 ' HA ' ' HE ' ' B' ' 23' ' ' ARG . 89.1 m-70 -70.9 -25.18 62.66 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.792 -1.193 . . . . 0.0 113.439 -178.872 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 32.0 mt -68.61 -25.52 64.89 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.436 1.471 . . . . 0.0 112.954 167.424 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.0 t -58.99 -55.79 30.65 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 119.983 1.265 . . . . 0.0 112.976 -169.44 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 40.5 t -53.46 -52.64 58.84 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 122.387 1.089 . . . . 0.0 109.476 172.655 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.4 tp -47.63 -38.16 14.14 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 128.293 2.637 . . . . 0.0 113.886 -174.291 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 25.2 mtm-85 -83.99 -32.62 24.88 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 119.684 1.129 . . . . 0.0 113.73 -179.211 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -83.3 -45.88 6.37 Favored Glycine 0 N--CA 1.467 0.755 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 -179.82 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 80.3 m -74.5 5.91 4.26 Favored 'General case' 0 CA--C 1.563 1.46 0 C-N-CA 127.484 2.313 . . . . 0.0 111.628 177.746 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.56 -6.46 83.38 Favored Glycine 0 C--N 1.344 1.01 0 C-N-CA 128.301 2.858 . . . . 0.0 119.078 165.594 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 59.9 mt -66.99 -26.93 67.05 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 119.366 1.583 . . . . 0.0 113.785 -172.713 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.411 HG11 HD12 ' B' ' 30' ' ' LEU . 11.1 m -132.01 161.09 41.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 126.767 2.027 . . . . 0.0 113.238 177.26 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 76.4 t -139.93 146.73 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 128.232 2.613 . . . . 0.0 109.877 -169.202 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -96.37 138.08 34.49 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.994 1.318 . . . . 0.0 111.605 170.493 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 9.5 m -146.88 147.19 30.56 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.097 1.359 . . . . 0.0 108.522 -174.465 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -77.11 138.03 39.28 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 175.778 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -112.17 164.71 12.88 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.385 1.874 . . . . 0.0 111.436 169.181 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.9 14.16 0.3 Allowed Glycine 0 N--CA 1.48 1.627 0 N-CA-C 117.271 1.669 . . . . 0.0 117.271 -168.952 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.92 -0.77 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.95 2.1 . . . . 0.0 113.849 178.907 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -168.79 167.08 11.3 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 126.561 1.945 . . . . 0.0 108.949 -168.225 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 35.2 m -93.74 159.34 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 119.818 1.19 . . . . 0.0 110.605 168.246 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 5.2 ptt180 -121.9 171.4 8.95 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 122.363 1.078 . . . . 0.0 112.508 178.154 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -119.94 112.62 19.41 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.469 -2.049 . . . . 0.0 105.469 165.227 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 76' ' ' ALA . . . . . 0.575 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -110.14 167.58 10.07 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.599 1.16 . . . . 0.0 110.147 174.458 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.593 HD11 ' HA ' ' B' ' 31' ' ' LEU . 0.0 OUTLIER -85.82 150.9 24.23 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 169.678 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.21 -50.47 69.31 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -168.411 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -153.34 160.35 42.66 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 123.275 1.512 . . . . 0.0 112.921 -178.822 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -35.34 -40.5 0.15 Allowed 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 129.657 3.183 . . . . 0.0 111.671 165.521 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -42.75 -68.22 0.21 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.469 2.308 . . . . 0.0 112.397 169.184 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 2.3 pp -79.04 -22.98 44.61 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -172.418 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.22 -44.51 91.69 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 122.892 0.477 . . . . 0.0 110.606 166.937 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 28.6 ttp85 -64.44 -51.61 62.23 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.132 1.773 . . . . 0.0 112.6 178.835 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.31 -41.61 80.23 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.983 0.81 . . . . 0.0 112.691 -179.857 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.426 HD22 HG23 ' B' ' 28' ' ' VAL . 0.3 OUTLIER -70.6 -41.53 72.17 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 118.79 -0.624 . . . . 0.0 111.038 176.263 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.87 -44.65 95.8 Favored Glycine 0 CA--C 1.533 1.189 0 C-N-CA 125.42 1.486 . . . . 0.0 114.389 179.571 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -76.93 -2.3 33.0 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.82 1.248 . . . . 0.0 113.129 172.982 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 44.7 tp 70.65 112.09 0.05 Allowed 'General case' 0 C--N 1.341 0.224 0 C-N-CA 129.679 3.192 . . . . 0.0 111.992 168.409 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.4 t -69.97 26.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 C-N-CA 127.198 2.199 . . . . 0.0 113.232 -176.167 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 89.02 -14.24 0.35 Allowed 'General case' 0 N--CA 1.468 0.47 0 O-C-N 119.623 -1.923 . . . . 0.0 113.226 119.046 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 11.5 p -63.95 39.69 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 130.306 3.443 . . . . 0.0 113.633 169.321 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 63.41 24.53 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 127.244 2.218 . . . . 0.0 112.823 -175.742 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 98.49 112.48 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 129.928 3.291 . . . . 0.0 107.947 -173.443 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.08 0 C-N-CA 123.866 0.866 . . . . 0.0 111.057 168.139 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 pp . . . . . 0 N--CA 1.473 0.707 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.84 -58.14 6.98 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 118.755 0.707 . . . . 0.0 111.724 175.639 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -62.28 -30.37 71.09 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 121.415 -0.803 . . . . 0.0 111.993 179.222 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.532 HD21 HD21 ' A' ' 63' ' ' LEU . 3.0 tm? -61.71 -43.41 98.91 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.798 1.639 . . . . 0.0 111.381 170.019 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -59.75 -29.25 66.93 Favored Glycine 0 N--CA 1.474 1.21 0 CA-C-N 119.548 1.067 . . . . 0.0 113.184 175.264 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.19 -27.37 64.45 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.085 0.954 . . . . 0.0 112.116 173.333 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.01 -26.13 62.1 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 120.104 1.32 . . . . 0.0 111.643 172.753 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.4 mp -83.21 -28.61 29.14 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.005 0.522 . . . . 0.0 111.389 172.71 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.7 -10.61 57.34 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 117.021 2.23 . . . . 0.0 117.021 -179.278 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.67 156.83 21.76 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 128.048 2.539 . . . . 0.0 114.098 -173.602 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.53 ' HG2' ' H ' ' A' ' 22' ' ' THR . 58.3 Cg_endo -53.65 -76.65 0.02 OUTLIER 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 124.532 3.488 . . . . 0.0 111.345 169.554 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.53 ' H ' ' HG2' ' A' ' 21' ' ' PRO . 57.9 m -87.37 -28.01 22.45 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 116.145 -1.883 . . . . 0.0 112.36 -172.528 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.3 mtt85 -64.15 -39.55 94.25 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 122.666 2.484 . . . . 0.0 111.589 172.668 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 15.2 t -57.66 -40.57 79.63 Favored 'General case' 0 CA--C 1.552 1.019 0 CA-C-N 121.466 1.939 . . . . 0.0 111.944 170.618 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -60.91 -55.82 28.49 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 121.129 -0.982 . . . . 0.0 112.081 173.688 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.4 mm -52.84 -42.82 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.96 1.704 . . . . 0.0 110.767 176.265 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 49.5 mt -68.21 -43.15 78.65 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.822 0.849 . . . . 0.0 112.869 178.714 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.2 p -68.37 -26.43 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 119.977 1.262 . . . . 0.0 111.806 177.471 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.66 1.67 9.73 Favored 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 127.242 2.217 . . . . 0.0 115.023 170.444 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.454 HD11 HG13 ' A' ' 64' ' ' VAL . 95.2 mt -99.23 -25.36 14.53 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.413 -1.429 . . . . 0.0 114.768 173.439 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.4 mt -59.4 -24.02 63.09 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.629 -1.169 . . . . 0.0 111.873 171.638 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 45.7 p-10 -132.25 -28.16 1.73 Allowed 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 116.036 1.865 . . . . 0.0 116.036 -175.179 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.86 -69.35 1.41 Allowed Glycine 0 C--N 1.343 0.945 0 CA-C-N 119.436 1.017 . . . . 0.0 113.221 -168.874 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 33.4 m 33.42 23.57 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 129.746 3.218 . . . . 0.0 119.14 174.88 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 69.2 m -86.08 -76.47 0.34 Allowed 'General case' 0 C--N 1.331 -0.204 0 O-C-N 121.01 -1.056 . . . . 0.0 109.764 177.608 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -137.04 157.1 75.24 Favored Pre-proline 0 N--CA 1.479 0.977 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -168.606 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -56.47 127.29 25.33 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.17 2.58 . . . . 0.0 110.535 173.327 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.05 -2.74 59.86 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-O 118.218 -1.324 . . . . 0.0 115.443 -178.292 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.79 -25.76 68.39 Favored 'General case' 0 N--CA 1.484 1.225 0 CA-C-N 120.46 2.13 . . . . 0.0 112.689 178.325 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.1 -12.27 3.31 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.507 1.123 . . . . 0.0 111.519 178.117 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.36 -38.56 91.62 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.988 1.315 . . . . 0.0 113.381 173.335 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.79 -37.98 70.33 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.586 0.63 . . . . 0.0 111.091 173.391 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -67.86 -47.73 68.09 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.209 1.004 . . . . 0.0 113.213 -178.987 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.2 mt -86.09 -11.92 51.46 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.539 1.136 . . . . 0.0 113.102 -178.659 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.31 -2.62 13.9 Favored Glycine 0 CA--C 1.537 1.444 0 C-N-CA 124.129 0.871 . . . . 0.0 113.728 -169.58 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.0 mt -81.9 153.52 26.29 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.618 1.167 . . . . 0.0 110.942 -176.712 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 50' ' ' ASN . 4.3 t -61.23 142.38 56.84 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.362 -0.836 . . . . 0.0 110.62 171.499 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.9 ptp180 -56.78 -23.79 45.82 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 118.685 -0.674 . . . . 0.0 112.667 178.366 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.0 m -66.04 -48.03 72.41 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.27 1.028 . . . . 0.0 113.258 170.862 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.407 ' H ' HG23 ' A' ' 47' ' ' THR . 43.6 t-20 -65.71 -41.21 92.58 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.041 1.336 . . . . 0.0 110.672 176.868 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 19.4 t -55.28 -49.9 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 123.654 0.781 . . . . 0.0 111.025 168.977 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 27.2 p -66.43 -36.15 82.1 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 120.31 1.414 . . . . 0.0 114.51 175.496 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -64.4 -45.28 88.3 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.31 1.444 . . . . 0.0 110.643 179.227 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -72.72 -35.35 67.55 Favored 'General case' 0 CA--C 1.558 1.281 0 CA-C-O 117.264 -1.35 . . . . 0.0 113.111 171.282 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.3 mt -63.11 -33.0 74.51 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 121.777 2.08 . . . . 0.0 113.719 173.259 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.3 m -55.42 -52.28 64.11 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.194 0.906 . . . . 0.0 113.405 -169.838 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 50.9 t -63.38 -40.29 96.86 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 122.933 0.493 . . . . 0.0 111.201 172.545 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.8 tp -58.86 -28.26 65.93 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.765 2.026 . . . . 0.0 112.908 -172.348 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 26.9 mtm180 -71.48 -38.9 71.18 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.9 0.88 . . . . 0.0 112.359 171.29 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -78.74 -36.12 29.98 Favored Glycine 0 N--CA 1.468 0.781 0 C-N-CA 125.883 1.706 . . . . 0.0 111.635 -176.721 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 36.3 m -61.86 -12.79 19.37 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 128.149 2.58 . . . . 0.0 112.865 167.28 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 81.87 -10.02 53.97 Favored Glycine 0 C--N 1.342 0.904 0 C-N-CA 126.957 2.218 . . . . 0.0 113.404 -179.033 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.532 HD21 HD21 ' A' ' 14' ' ' LEU . 85.0 mt -63.73 -33.03 74.73 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 127.496 2.318 . . . . 0.0 113.936 -169.902 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.454 HG13 HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -113.22 133.3 59.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.599 1.56 . . . . 0.0 109.101 166.833 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.8 t -121.79 133.06 69.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 124.971 1.308 . . . . 0.0 109.574 172.324 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.03 142.56 50.91 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 114.746 -1.115 . . . . 0.0 111.979 170.121 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.1 m -162.92 158.96 23.09 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.098 1.759 . . . . 0.0 106.944 -174.303 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -91.46 145.61 24.48 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.73 1.15 . . . . 0.0 113.206 178.302 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -111.39 -166.79 1.11 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.284 1.834 . . . . 0.0 109.85 168.79 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -72.02 -8.1 68.32 Favored Glycine 0 CA--C 1.537 1.417 0 O-C-N 120.498 -1.376 . . . . 0.0 116.457 -169.39 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.03 -31.28 0.77 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.326 1.85 . . . . 0.0 113.091 177.667 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.25 -175.79 4.97 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.942 1.246 . . . . 0.0 112.929 -172.642 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 8.1 p -79.81 146.96 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 123.842 0.857 . . . . 0.0 110.792 168.858 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -128.79 162.7 26.83 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 127.657 2.383 . . . . 0.0 111.091 -179.202 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -110.59 120.42 42.35 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.409 1.084 . . . . 0.0 108.919 168.262 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -121.46 168.62 11.49 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.881 1.272 . . . . 0.0 110.461 174.985 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 17.6 mt -58.64 155.44 12.54 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 172.642 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -48.04 -40.7 23.69 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.155 1.782 . . . . 0.0 114.342 -178.457 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -174.52 169.42 3.69 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.578 1.951 . . . . 0.0 110.982 -174.387 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 88.0 p -46.57 -34.75 5.18 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 127.372 2.269 . . . . 0.0 113.605 169.271 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 62.1 m-70 -54.23 -53.47 53.16 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 125.525 1.53 . . . . 0.0 112.221 176.203 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 28.2 mt -73.15 -37.1 66.73 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 118.219 -0.895 . . . . 0.0 110.61 -179.968 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.2 -50.76 64.03 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 118.913 0.779 . . . . 0.0 111.495 179.089 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -75.64 -32.23 60.15 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.49 1.041 . . . . 0.0 113.611 -179.274 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.18 -44.72 83.2 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.764 1.166 . . . . 0.0 112.576 176.298 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.01 -38.43 75.93 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.931 0.892 . . . . 0.0 110.694 174.63 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.16 -35.43 91.96 Favored Glycine 0 CA--C 1.529 0.907 0 O-C-N 121.418 -0.801 . . . . 0.0 112.225 176.884 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -83.15 9.57 10.21 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.865 1.266 . . . . 0.0 114.093 170.148 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.7 tp 66.52 -18.48 0.11 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 130.785 3.634 . . . . 0.0 117.525 164.041 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.27 34.3 m 118.71 20.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.138 1 C-N-CA 134.938 5.295 . . . . 0.0 112.152 178.219 . . . . . . . . 3 2 . 1 . 026 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.441 ' HB3' ' CG ' ' B' ' 81' ' ' HIS . 25.4 mm-40 79.63 -33.43 0.14 Allowed 'General case' 0 CA--C 1.539 0.524 0 O-C-N 120.176 -1.578 . . . . 0.0 114.127 162.945 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.8 p -57.34 16.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 C-N-CA 129.835 3.254 . . . . 0.0 117.572 -175.206 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.4 t 69.54 27.37 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 C-N-CA 125.218 1.407 . . . . 0.0 111.446 169.036 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.6 tp 80.13 96.94 0.06 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 129.53 3.132 . . . . 0.0 111.855 -173.805 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -87.69 114.76 24.61 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 120.887 -1.133 . . . . 0.0 109.045 170.021 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.3 m -141.82 142.99 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 127.528 2.331 . . . . 0.0 108.891 170.397 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.79 127.45 32.27 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.729 1.612 . . . . 0.0 109.688 170.818 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 2.7 m -179.88 -57.96 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 126.867 2.067 . . . . 0.0 109.138 -168.824 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.1 t0 176.19 56.44 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 131.235 3.814 . . . . 0.0 108.065 175.322 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -111.12 -163.2 0.05 OUTLIER Pre-proline 0 CA--C 1.555 1.139 0 C-N-CA 127.912 2.485 . . . . 0.0 110.543 -168.282 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -73.56 -159.57 0.08 OUTLIER 'Trans proline' 0 CA--C 1.55 1.282 0 CA-C-N 122.664 1.987 . . . . 0.0 112.928 177.021 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . 0.449 0.5 OUTLIER . . . . . 0 CA--C 1.55 0.959 0 C-N-CA 130.84 3.656 . . . . 0.0 117.402 -169.451 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 pp . . . . . 0 N--CA 1.472 0.659 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.23 -43.27 95.47 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.61 0.641 . . . . 0.0 111.506 177.299 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 25.6 ttp85 -64.95 -20.26 66.38 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.471 -1.393 . . . . 0.0 112.532 174.885 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.2 -38.22 85.79 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.802 1.637 . . . . 0.0 111.078 169.016 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -60.82 -25.52 63.92 Favored Glycine 0 CA--C 1.533 1.178 0 O-C-N 121.005 -1.059 . . . . 0.0 112.989 174.534 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 29.0 ttt-85 -69.35 -44.66 71.14 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 118.871 1.336 . . . . 0.0 110.364 170.817 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.54 -22.05 66.16 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 118.268 -0.873 . . . . 0.0 112.549 -177.014 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mp -91.34 -19.46 22.91 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.231 0.923 . . . . 0.0 113.308 168.384 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.0 -24.29 38.07 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 174.274 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -55.53 136.63 70.35 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 125.686 1.594 . . . . 0.0 109.597 178.849 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -49.26 -81.34 0.02 OUTLIER 'Trans proline' 0 CA--C 1.535 0.532 1 C-N-CA 126.611 4.874 . . . . 0.0 112.712 -167.695 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 13.4 m -62.86 -27.75 69.55 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 125.226 1.41 . . . . 0.0 111.415 -179.855 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -67.84 -43.5 79.38 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 120.495 1.498 . . . . 0.0 111.244 178.903 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 2.7 t -58.6 -14.1 7.38 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.51 1.05 . . . . 0.0 113.069 168.531 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -93.28 -55.33 3.35 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 120.265 -1.522 . . . . 0.0 112.053 171.641 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mt -38.87 -56.56 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 125.223 1.409 . . . . 0.0 110.464 170.899 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.52 ' HA ' HD12 ' B' ' 30' ' ' LEU . 96.9 mt -62.92 -30.56 71.65 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -170.545 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.6 p -88.12 -10.71 10.77 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 124.546 1.139 . . . . 0.0 112.337 178.012 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.71 -6.42 25.07 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 128.28 2.632 . . . . 0.0 112.907 176.503 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.545 HD11 ' CG1' ' B' ' 64' ' ' VAL . 52.7 mt -77.72 -54.27 6.56 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 119.639 -1.913 . . . . 0.0 110.177 168.84 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -35.31 -48.32 0.46 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 131.614 3.966 . . . . 0.0 114.303 179.551 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -102.8 -21.5 14.03 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.959 2.104 . . . . 0.0 113.224 -179.317 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -83.99 -70.1 1.36 Allowed Glycine 0 C--N 1.336 0.542 0 C-N-CA 125.826 1.679 . . . . 0.0 110.562 -170.726 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 11.0 m 32.46 26.81 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 N-CA-C 117.551 2.426 . . . . 0.0 117.551 -170.9 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 54.1 m -81.36 -89.56 0.07 Allowed 'General case' 0 C--O 1.221 -0.427 0 O-C-N 120.846 -1.159 . . . . 0.0 111.634 -178.661 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 36' ' ' TYR . . . . . 0.455 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 27.6 m-85 -135.16 156.52 78.12 Favored Pre-proline 0 N--CA 1.472 0.653 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -169.166 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -57.24 125.4 18.76 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.266 1.978 . . . . 0.0 109.359 171.554 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.14 -6.83 80.45 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 117.313 -1.826 . . . . 0.0 114.935 -174.091 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 39' ' ' GLN . . . . . 0.455 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 2.5 pp0? -59.36 -38.16 79.73 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 120.764 2.282 . . . . 0.0 111.235 172.273 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 15.0 mt -53.71 -23.05 10.42 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.224 1.41 . . . . 0.0 112.454 179.384 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.88 -28.15 69.3 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 176.966 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.03 -55.26 5.77 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.774 0.83 . . . . 0.0 110.6 171.312 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -49.67 -40.42 39.82 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 177.426 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.4 mt -95.6 -15.3 22.87 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.03 0.932 . . . . 0.0 113.245 -175.999 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.95 -5.13 4.93 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 124.542 1.068 . . . . 0.0 114.188 -170.123 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 87.8 mt -89.58 136.08 33.24 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 125.279 1.431 . . . . 0.0 109.678 -177.903 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.0 t -61.23 150.54 34.28 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.294 -0.879 . . . . 0.0 112.316 -173.631 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -57.5 -32.01 66.59 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -169.863 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.7 m -64.29 -52.34 59.02 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.017 0.927 . . . . 0.0 112.551 173.822 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -64.24 -40.92 97.01 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.8 1.24 . . . . 0.0 111.827 179.127 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 78.6 t -61.34 -44.7 98.94 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 121.505 -0.747 . . . . 0.0 111.143 169.504 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 81.1 p -64.04 -31.51 72.73 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.0 1.273 . . . . 0.0 113.913 176.88 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -57.27 -40.64 78.12 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 122.345 1.069 . . . . 0.0 110.854 174.316 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -73.85 -34.67 64.6 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 116.925 -1.512 . . . . 0.0 114.121 170.135 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 90.7 mt -61.24 -32.83 72.63 Favored 'General case' 0 N--CA 1.483 1.175 0 CA-C-N 121.793 2.088 . . . . 0.0 113.443 173.274 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 70.4 m -52.53 -44.82 66.01 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -174.159 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.1 t -75.73 -36.67 59.87 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.548 0.613 . . . . 0.0 110.788 175.733 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 10.1 tp -62.51 -28.33 69.76 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 127.16 2.184 . . . . 0.0 113.737 -168.148 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 28.2 mtm105 -71.92 -40.72 68.58 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.007 0.523 . . . . 0.0 110.602 171.815 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.82 -39.95 85.32 Favored Glycine 0 C--O 1.222 -0.654 0 CA-C-O 118.439 -1.2 . . . . 0.0 111.147 178.5 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 96.6 m -58.31 -12.91 4.18 Favored 'General case' 0 CA--C 1.565 1.556 0 C-N-CA 127.255 2.222 . . . . 0.0 112.323 168.541 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 82.29 -9.82 56.55 Favored Glycine 0 C--N 1.344 1.02 0 C-N-CA 127.033 2.254 . . . . 0.0 113.412 -179.834 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 19.8 mt -71.08 -31.52 67.92 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.196 1.398 . . . . 0.0 114.643 -167.862 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.545 ' CG1' HD11 ' B' ' 30' ' ' LEU . 0.1 OUTLIER -109.62 139.65 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.688 1.595 . . . . 0.0 111.125 169.874 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 71.6 t -132.66 133.7 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 C-N-CA 125.764 1.626 . . . . 0.0 109.241 -176.272 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.72 135.34 35.5 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.482 0.713 . . . . 0.0 110.126 168.965 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 2.1 m -162.49 163.5 27.47 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.764 1.625 . . . . 0.0 107.046 -171.31 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -91.73 151.77 20.48 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 120.89 -1.131 . . . . 0.0 113.673 178.518 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -119.22 -171.56 2.14 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.513 1.925 . . . . 0.0 108.834 166.396 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -69.99 -10.28 64.72 Favored Glycine 0 CA--C 1.536 1.378 0 N-CA-C 116.932 1.533 . . . . 0.0 116.932 -168.69 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 24.6 mtm180 -138.27 -21.94 1.04 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.153 1.781 . . . . 0.0 113.571 -177.4 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -154.83 -175.39 5.4 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.665 1.575 . . . . 0.0 112.755 -179.478 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 9.2 p -83.34 146.61 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.312 1.045 . . . . 0.0 110.453 169.073 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -134.72 162.48 32.22 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 126.436 1.894 . . . . 0.0 111.566 -170.962 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -106.59 127.0 52.98 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 165.723 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -128.62 172.11 11.51 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.385 1.874 . . . . 0.0 109.924 176.218 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 29.4 mt -76.03 158.96 31.3 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.116 0.566 . . . . 0.0 112.399 177.912 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -46.2 -34.92 4.68 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.712 2.005 . . . . 0.0 116.071 177.955 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 11.6 t70 171.59 158.63 0.09 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 128.922 2.889 . . . . 0.0 110.453 -169.988 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 91.9 p -40.98 -36.14 0.62 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 128.749 2.82 . . . . 0.0 113.501 168.57 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 81' ' ' HIS . . . . . 0.441 ' CG ' ' HB3' ' A' ' 91' ' ' GLN . 5.2 m-70 -49.47 -53.05 25.18 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 125.674 1.59 . . . . 0.0 113.039 173.854 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 14.2 mt -74.22 -40.11 62.66 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.075 0.852 . . . . 0.0 110.43 -179.395 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.01 -45.76 75.14 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.088 0.555 . . . . 0.0 110.99 179.376 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -77.01 -35.6 56.94 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 117.049 -1.453 . . . . 0.0 114.193 176.088 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -69.31 -33.45 73.18 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 121.143 1.792 . . . . 0.0 112.822 178.778 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.44 -44.5 51.46 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.587 0.755 . . . . 0.0 110.683 169.868 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.96 -32.67 73.58 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 123.972 0.796 . . . . 0.0 113.178 -176.022 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -71.68 -8.79 56.34 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.289 1.436 . . . . 0.0 112.548 169.421 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 4.8 tp 66.95 11.01 8.1 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 128.453 2.701 . . . . 0.0 115.338 167.994 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER 75.28 -9.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 C-N-CA 129.973 3.309 . . . . 0.0 111.907 168.093 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 91' ' ' GLN . . . . . 0.486 ' C ' ' H ' ' B' ' 93' ' ' VAL 0.482 5.2 pt20 73.93 12.46 4.31 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 115.306 1.595 . . . . 0.0 115.306 141.726 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.511 HG13 ' HB2' ' B' ' 95' ' ' ALA . 4.9 p -68.38 42.68 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 130.112 3.365 . . . . 0.0 109.368 163.141 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 93' ' ' VAL . . . . . 0.486 ' H ' ' C ' ' B' ' 91' ' ' GLN . 1.5 t 59.22 45.57 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 C-N-CA 127.741 2.416 . . . . 0.0 111.633 178.296 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 32.6 tp 60.26 60.37 2.07 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 122.096 0.951 . . . . 0.0 110.242 -179.92 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 95' ' ' ALA . . . . . 0.511 ' HB2' HG13 ' B' ' 92' ' ' VAL . . . . . . . . 0 CA--C 1.548 0.877 0 O-C-N 121.156 -0.965 . . . . 0.0 110.658 179.682 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 pt? . . . . . 0 N--CA 1.476 0.864 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.47 -54.23 35.77 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.879 0.871 . . . . 0.0 110.532 178.591 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -34.57 76.78 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.335 0.97 . . . . 0.0 112.586 176.631 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.474 ' HG ' HG11 ' B' ' 92' ' ' VAL . 3.2 tm? -68.77 -56.5 7.84 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.306 0.957 . . . . 0.0 111.066 -179.179 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.86 -29.84 75.91 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-O 119.128 -0.818 . . . . 0.0 111.141 -179.783 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -65.36 -48.4 73.08 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 118.344 1.072 . . . . 0.0 110.649 169.878 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.1 -24.97 67.44 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 119.869 1.213 . . . . 0.0 112.977 -179.647 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 mp -94.14 -4.34 49.39 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 171.477 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -99.68 -15.37 18.55 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 126.489 1.916 . . . . 0.0 114.192 168.511 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.406 ' CG ' HH21 ' A' ' 23' ' ' ARG . 0.7 OUTLIER -62.66 152.18 82.17 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 127.257 2.223 . . . . 0.0 112.671 174.221 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.35 -101.1 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 0.978 1 C-N-CA 127.533 5.489 . . . . 0.0 112.317 -169.681 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -44.92 -35.43 2.84 Favored 'General case' 0 C--O 1.22 -0.494 0 C-N-CA 126.516 1.926 . . . . 0.0 111.346 168.807 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.499 ' HG2' HD13 ' A' ' 58' ' ' LEU . 11.9 ttm-85 -64.41 -50.54 67.22 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 120.277 1.399 . . . . 0.0 113.952 -179.462 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.23 -42.51 99.37 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 120.069 1.304 . . . . 0.0 110.063 174.384 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 18.6 mmt-85 -54.48 -44.05 72.3 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 174.679 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.5 mm -50.22 -54.15 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.236 0.614 . . . . 0.0 109.792 170.772 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 86.7 mt -59.91 -48.11 83.05 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.472 -0.775 . . . . 0.0 112.173 -177.239 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.7 m -65.55 -36.05 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 CA-C-N 118.776 0.716 . . . . 0.0 111.092 -176.716 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.02 -26.7 33.58 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.513 0.561 . . . . 0.0 112.513 -178.773 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.418 ' O ' HG13 ' A' ' 34' ' ' VAL . 19.9 tp -68.79 -37.27 79.17 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 117.182 -1.389 . . . . 0.0 112.051 174.323 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.39 -50.83 12.0 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.182 2.193 . . . . 0.0 112.893 -173.135 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -104.05 8.72 36.6 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 126.454 1.902 . . . . 0.0 112.118 178.695 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -92.98 -73.85 1.25 Allowed Glycine 0 C--N 1.341 0.86 0 C-N-CA 127.365 2.412 . . . . 0.0 111.504 172.256 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.574 HG12 ' HA ' ' A' ' 76' ' ' ALA . 23.7 m 24.54 49.54 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 C-N-CA 128.399 2.68 . . . . 0.0 115.918 -172.792 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 80.3 m -96.61 -66.94 0.87 Allowed 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 125.523 1.529 . . . . 0.0 112.661 177.304 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -146.0 159.02 47.7 Favored Pre-proline 0 N--CA 1.486 1.364 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -168.382 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -55.45 126.27 21.92 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.214 2.609 . . . . 0.0 111.061 173.528 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.56 8.35 62.91 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 117.918 -1.49 . . . . 0.0 115.046 179.966 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.07 -24.74 26.71 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.353 2.076 . . . . 0.0 112.883 177.085 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.3 mt -63.2 -15.87 58.32 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 125.894 1.677 . . . . 0.0 111.643 -176.662 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.27 -29.75 70.04 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 170.308 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.0 -49.04 16.31 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.489 0.586 . . . . 0.0 110.711 169.959 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -59.05 -36.49 75.13 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -179.023 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 17.5 mt -101.45 -14.12 17.66 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.279 1.432 . . . . 0.0 112.468 -175.839 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.4 -1.83 12.19 Favored Glycine 0 CA--C 1.536 1.359 0 CA-C-N 119.416 1.007 . . . . 0.0 114.497 -171.981 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -85.54 150.97 24.29 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.879 1.272 . . . . 0.0 110.738 178.21 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.4 p -64.58 159.38 21.93 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.637 -1.289 . . . . 0.0 111.87 -177.506 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 23.7 ttm180 -53.24 -34.43 57.11 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.27 0.628 . . . . 0.0 111.385 175.186 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.2 m -66.28 -55.47 15.91 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.01 0.823 . . . . 0.0 111.378 172.988 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -57.73 -33.53 68.55 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.944 0.793 . . . . 0.0 112.902 179.323 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.8 t -72.26 -49.46 42.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.905 1.282 . . . . 0.0 112.329 172.54 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 39.5 m -64.52 -30.4 71.43 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.987 0.812 . . . . 0.0 112.297 -178.107 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -50.95 -35.57 34.14 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.252 1.421 . . . . 0.0 113.529 170.529 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -90.06 -29.45 18.36 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 117.534 -1.222 . . . . 0.0 113.997 174.214 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 66.8 mt -66.58 -27.77 67.98 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.142 1.337 . . . . 0.0 112.388 176.047 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.1 t -50.5 -51.2 49.58 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.168 0.587 . . . . 0.0 111.887 173.505 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 15.6 t -68.85 -45.72 70.33 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.79 1.236 . . . . 0.0 111.511 170.415 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.499 HD13 ' HG2' ' A' ' 23' ' ' ARG . 6.7 tp -62.53 -32.64 73.62 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -169.021 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 25.5 mtp-105 -75.8 -37.69 58.92 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.758 0.708 . . . . 0.0 112.535 168.945 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.5 -45.56 84.35 Favored Glycine 0 N--CA 1.469 0.873 0 C-N-CA 124.024 0.821 . . . . 0.0 112.646 -178.484 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.8 m -66.53 -5.59 11.88 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 126.472 1.909 . . . . 0.0 112.336 168.151 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.54 -7.57 57.41 Favored Glycine 0 C--N 1.338 0.675 0 C-N-CA 125.712 1.625 . . . . 0.0 115.315 175.989 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 37.5 mt -65.56 -25.67 67.53 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.934 1.294 . . . . 0.0 113.168 -169.128 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.6 m -119.63 139.29 47.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.14 1.376 . . . . 0.0 112.448 167.249 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 24.6 t -130.08 145.73 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 127.046 2.138 . . . . 0.0 109.681 -177.214 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.61 146.85 28.06 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 175.68 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.4 165.42 28.55 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.42 1.488 . . . . 0.0 110.188 172.544 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -89.55 138.04 31.81 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 118.393 -0.813 . . . . 0.0 109.496 165.259 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -95.76 -32.8 12.54 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.273 0.942 . . . . 0.0 112.166 167.277 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 146.77 -32.95 1.42 Allowed Glycine 0 N--CA 1.477 1.37 0 C-N-CA 125.873 1.702 . . . . 0.0 114.549 169.43 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 49.5 ttm-85 -89.17 -34.13 16.8 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 128.075 2.55 . . . . 0.0 111.652 170.523 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.54 179.86 8.78 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 128.084 2.553 . . . . 0.0 109.797 -172.582 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 15.9 m -85.98 161.43 2.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.456 166.723 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.0 ptt180 -138.38 156.17 47.85 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.044 1.737 . . . . 0.0 109.411 -178.619 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -90.88 148.68 22.31 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 164.395 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.574 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -148.49 164.73 33.29 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 123.682 0.793 . . . . 0.0 109.154 172.816 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -58.87 156.81 10.72 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 122.632 0.373 . . . . 0.0 111.859 169.92 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.73 -30.23 31.34 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -175.023 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.3 t0 174.98 167.36 0.28 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 129.976 3.311 . . . . 0.0 109.426 179.608 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 20.2 m -51.37 -22.94 3.25 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.283 1.833 . . . . 0.0 113.182 169.166 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.43 -58.39 8.21 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.343 1.057 . . . . 0.0 111.748 170.776 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 22.7 mt -65.35 -32.71 74.5 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.408 1.458 . . . . 0.0 110.841 176.034 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.12 -29.05 69.54 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.862 0.755 . . . . 0.0 111.073 -177.046 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -70.46 -53.91 14.44 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.731 1.212 . . . . 0.0 112.532 171.281 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.38 -40.01 96.08 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 120.622 1.555 . . . . 0.0 112.582 -178.858 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.34 -40.52 97.52 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.899 2.08 . . . . 0.0 113.165 169.89 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.85 -45.01 5.56 Favored Glycine 0 N--CA 1.476 1.343 0 C-N-CA 127.236 2.35 . . . . 0.0 114.701 -168.943 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 41.5 tp10 -62.3 -25.6 67.95 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.144 0.972 . . . . 0.0 108.617 165.204 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 20.6 tp 73.4 170.25 0.31 Allowed 'General case' 0 C--N 1.344 0.349 0 C-N-CA 130.162 3.385 . . . . 0.0 109.422 175.261 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.1 m -58.27 -5.39 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 O-C-N 120.24 -1.538 . . . . 0.0 113.573 168.125 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.452 ' C ' ' H ' ' A' ' 93' ' ' VAL . 19.7 mm-40 76.81 -24.87 0.21 Allowed 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 127.038 2.135 . . . . 0.0 111.844 165.409 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 2.3 p -62.89 29.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 128.595 2.758 . . . . 0.0 114.844 172.216 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.452 ' H ' ' C ' ' A' ' 91' ' ' GLN . 2.4 t 79.36 -22.08 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 130.217 3.407 . . . . 0.0 112.935 168.401 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.6 tp 132.16 99.8 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.771 1 C-N-CA 132.928 4.491 . . . . 0.0 107.674 -176.503 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.05 139.02 58.16 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 174.792 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 35.1 t -72.52 146.2 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 C-N-CA 124.658 1.183 . . . . 0.0 113.713 -169.024 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -77.21 51.24 0.82 Allowed 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 126.07 1.748 . . . . 0.0 113.291 173.203 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.6 p -122.19 151.45 40.99 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 125.748 1.619 . . . . 0.0 113.434 -176.025 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -88.35 115.17 25.66 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 165.791 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -140.43 140.14 22.19 Favored Pre-proline 0 CA--C 1.536 0.429 0 C-N-CA 124.121 0.968 . . . . 0.0 109.738 171.114 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -72.55 145.47 42.18 Favored 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 123.728 2.952 . . . . 0.0 113.77 -168.288 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 14.3 t . . . . . 0 CA--C 1.553 1.079 0 C-N-CA 125.376 1.47 . . . . 0.0 111.308 171.08 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 pt? . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.61 -23.36 66.8 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 119.645 1.111 . . . . 0.0 113.285 178.841 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 13' ' ' ARG . . . . . 0.472 HH21 ' CB ' ' B' ' 61' ' ' CYS . 3.4 tpt85 -82.25 -58.3 3.01 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.879 1.671 . . . . 0.0 110.759 169.004 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -64.75 -50.86 65.2 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 128.226 2.61 . . . . 0.0 112.655 -173.141 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.9 -39.08 97.59 Favored Glycine 0 CA--C 1.526 0.721 0 O-C-N 121.216 -0.927 . . . . 0.0 111.512 177.384 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.406 ' HA ' ' HB3' ' B' ' 19' ' ' ALA . 65.5 ttt180 -65.57 -34.54 78.47 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.64 0.776 . . . . 0.0 111.812 174.426 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.15 -24.97 65.16 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.473 1.033 . . . . 0.0 112.651 173.43 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.0 mp -101.7 -9.27 21.03 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.862 0.865 . . . . 0.0 113.088 174.571 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 19' ' ' ALA . . . . . 0.406 ' HB3' ' HA ' ' B' ' 16' ' ' ARG . . . -85.19 -19.86 31.08 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.756 1.623 . . . . 0.0 113.242 167.233 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -54.08 151.17 13.24 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 127.381 2.272 . . . . 0.0 113.571 173.055 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -66.92 -100.84 0.0 OUTLIER 'Trans proline' 0 CA--C 1.547 1.161 1 C-N-CA 127.194 5.262 . . . . 0.0 112.663 -171.91 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -47.46 -28.01 1.97 Allowed 'General case' 0 C--N 1.342 0.241 0 C-N-CA 126.467 1.907 . . . . 0.0 112.936 169.973 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.671 HH21 ' CB ' ' B' ' 57' ' ' CYS . 0.2 OUTLIER -68.93 -47.93 64.5 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 119.65 1.113 . . . . 0.0 113.66 177.85 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 43.3 t -60.41 -42.18 95.43 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.866 1.212 . . . . 0.0 110.728 172.757 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 19.3 mmt-85 -58.03 -43.14 86.59 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 174.437 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.1 mt -47.37 -57.7 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 CA-C-N 118.782 0.719 . . . . 0.0 109.185 169.155 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.758 HD22 HD21 ' B' ' 77' ' ' LEU . 63.6 mt -62.22 -44.72 95.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 117.365 -1.303 . . . . 0.0 112.608 -171.167 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.7 m -61.49 -33.3 56.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 CA-C-N 120.391 1.451 . . . . 0.0 111.698 176.34 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.01 -17.22 47.57 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.929 0.891 . . . . 0.0 113.37 177.617 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 tp -72.55 -42.12 65.02 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 117.366 -1.302 . . . . 0.0 111.446 169.115 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.03 -51.09 25.55 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.829 2.052 . . . . 0.0 112.475 -173.229 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -99.51 10.79 40.73 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.546 1.938 . . . . 0.0 112.581 -178.338 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -119.07 -80.44 0.68 Allowed Glycine 0 C--N 1.34 0.796 0 C-N-CA 126.46 1.981 . . . . 0.0 112.821 -173.388 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 9.1 m 35.58 37.68 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 126.559 1.944 . . . . 0.0 115.169 -169.995 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -82.33 -71.94 0.46 Allowed 'General case' 0 C--O 1.223 -0.327 0 O-C-N 120.842 -1.161 . . . . 0.0 112.357 -171.756 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -136.01 -176.18 0.55 Allowed Pre-proline 0 CA--C 1.553 1.096 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -168.547 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -79.51 95.92 1.05 Allowed 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 121.734 1.623 . . . . 0.0 108.964 -174.386 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 80.54 29.59 43.4 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-O 119.177 -0.79 . . . . 0.0 113.92 -177.648 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -60.73 -22.47 64.03 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.317 1.559 . . . . 0.0 112.0 169.889 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 8.1 mt -48.34 -20.87 0.44 Allowed 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 127.368 2.267 . . . . 0.0 113.455 171.018 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.28 -28.89 70.03 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.961 0.801 . . . . 0.0 112.055 176.958 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.01 -50.74 12.45 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.324 0.65 . . . . 0.0 110.55 168.904 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -56.91 -37.5 71.53 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -177.248 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.6 mt -97.58 -13.74 21.43 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.334 1.453 . . . . 0.0 112.28 -177.497 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.19 -6.58 4.0 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.691 1.139 . . . . 0.0 114.532 -171.349 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -84.12 147.65 27.23 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.91 1.355 . . . . 0.0 110.042 -179.532 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.7 p -59.93 155.29 16.9 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 121.677 -0.639 . . . . 0.0 111.311 -177.881 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -53.15 -35.77 60.11 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.099 178.054 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 11.6 m -64.26 -58.63 5.98 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.017 0.927 . . . . 0.0 111.514 172.139 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -55.16 -36.36 65.75 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.444 1.02 . . . . 0.0 113.262 -178.255 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 59.5 t -76.53 -43.4 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.465 0.706 . . . . 0.0 112.346 174.467 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.5 m -62.37 -30.67 71.36 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 119.763 1.165 . . . . 0.0 112.882 178.972 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -56.11 -28.97 59.88 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.879 1.271 . . . . 0.0 113.201 171.603 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 -90.46 -30.5 17.29 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-O 117.507 -1.235 . . . . 0.0 114.036 169.613 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 91.1 mt -64.79 -38.3 90.51 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 120.656 1.571 . . . . 0.0 113.035 177.808 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 1.2 m -60.3 -29.8 69.07 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 179.831 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 57' ' ' CYS . . . . . 0.671 ' CB ' HH21 ' B' ' 23' ' ' ARG . 40.0 t -75.86 -41.05 53.42 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.318 0.963 . . . . 0.0 110.682 169.017 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 58' ' ' LEU . . . . . 0.453 HD13 ' HG2' ' B' ' 23' ' ' ARG . 5.5 tp -57.79 -38.68 75.93 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 125.54 1.536 . . . . 0.0 112.597 -174.819 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 58.5 mtm-85 -73.03 -35.33 66.74 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 118.47 0.577 . . . . 0.0 112.098 174.458 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.82 -44.16 7.9 Favored Glycine 0 N--CA 1.468 0.774 0 C-N-CA 124.188 0.899 . . . . 0.0 112.855 -170.287 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 61' ' ' CYS . . . . . 0.472 ' CB ' HH21 ' B' ' 13' ' ' ARG . 94.4 m -74.18 16.21 0.26 Allowed 'General case' 0 CA--C 1.57 1.73 0 C-N-CA 125.837 1.655 . . . . 0.0 112.183 169.538 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.36 28.13 72.88 Favored Glycine 0 C--N 1.343 0.938 0 C-N-CA 127.38 2.419 . . . . 0.0 117.383 167.783 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.519 ' O ' HD23 ' B' ' 77' ' ' LEU . 56.1 mt -92.96 -32.64 14.47 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.183 0.992 . . . . 0.0 113.272 -177.782 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -134.56 138.57 49.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 C-N-CA 125.469 1.508 . . . . 0.0 113.598 -175.72 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 97.1 t -126.15 136.19 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 126.956 2.102 . . . . 0.0 108.83 179.856 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -77.64 141.13 39.61 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.782 0.833 . . . . 0.0 112.141 177.346 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -141.85 154.74 45.37 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.9 0.88 . . . . 0.0 108.828 171.817 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -73.83 132.62 42.75 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 167.715 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.53 -31.84 42.15 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.475 0.71 . . . . 0.0 110.887 166.86 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 145.61 -35.78 1.39 Allowed Glycine 0 CA--C 1.533 1.168 0 C-N-CA 126.51 2.005 . . . . 0.0 113.506 173.92 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 56.4 ttm-85 -96.06 -36.08 11.14 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 127.146 2.179 . . . . 0.0 111.886 169.921 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.38 -171.09 3.71 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.484 1.513 . . . . 0.0 110.768 -178.736 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 17.6 m -100.62 146.0 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.569 1.148 . . . . 0.0 111.106 176.459 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.0 ptt180 -116.39 172.26 7.31 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 126.537 1.935 . . . . 0.0 109.764 177.732 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -111.5 110.68 21.22 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 167.898 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -108.43 143.84 36.83 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.502 0.592 . . . . 0.0 109.49 176.06 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.758 HD21 HD22 ' B' ' 27' ' ' LEU . 8.5 mt -52.97 144.17 15.53 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 122.952 0.501 . . . . 0.0 110.864 169.385 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.28 -30.24 70.35 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 113.747 1.018 . . . . 0.0 113.747 -168.136 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -158.03 155.64 29.69 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 122.737 1.256 . . . . 0.0 111.622 167.387 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -39.95 -32.23 0.15 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 129.751 3.221 . . . . 0.0 113.264 167.185 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -52.95 -51.57 60.96 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.608 1.563 . . . . 0.0 112.844 169.532 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 11.8 mt -69.0 -44.35 72.98 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.225 0.921 . . . . 0.0 110.049 -178.881 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.59 -33.56 55.28 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.252 1.021 . . . . 0.0 112.617 173.52 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -69.61 -54.09 15.67 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.7 1.2 . . . . 0.0 113.479 173.28 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.31 -38.4 91.01 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 120.249 1.386 . . . . 0.0 112.672 178.619 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 60.1 tp -60.86 -41.52 96.08 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.099 1.76 . . . . 0.0 112.872 169.222 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.36 -44.91 6.37 Favored Glycine 0 N--CA 1.474 1.18 0 C-N-CA 127.167 2.318 . . . . 0.0 115.198 -169.062 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -63.15 -27.07 69.12 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 118.297 1.048 . . . . 0.0 109.156 166.641 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 30.6 tp 77.18 163.05 0.23 Allowed 'General case' 0 C--N 1.345 0.38 0 C-N-CA 129.971 3.308 . . . . 0.0 109.487 173.313 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 90' ' ' VAL . . . . . 0.489 HG23 HG12 ' B' ' 92' ' ' VAL . 14.9 m -54.21 -5.77 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 O-C-N 120.203 -1.561 . . . . 0.0 114.564 168.05 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 72.13 -20.32 0.26 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.739 2.015 . . . . 0.0 114.218 164.491 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.489 HG12 HG23 ' B' ' 90' ' ' VAL . 9.2 p -65.66 38.98 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 131.045 3.738 . . . . 0.0 114.275 -177.931 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.1 t 70.97 17.42 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 C-N-CA 126.387 1.875 . . . . 0.0 111.897 175.127 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 56.8 tp 73.95 108.17 0.07 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 129.596 3.158 . . . . 0.0 109.371 -168.507 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.695 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 175.79 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 pp . . . . . 0 N--CA 1.474 0.762 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.49 -26.31 67.83 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 174.221 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.6 mmt-85 -79.33 -43.09 24.24 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.33 -0.843 . . . . 0.0 110.911 168.967 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -56.18 -48.12 76.96 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.904 1.682 . . . . 0.0 112.622 -177.07 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.61 -26.59 71.23 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-O 119.539 -0.589 . . . . 0.0 112.56 -177.02 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.5 tmm_? -70.75 -45.44 64.82 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 118.322 1.061 . . . . 0.0 108.688 166.8 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.01 -22.55 66.97 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.019 1.328 . . . . 0.0 113.988 -176.964 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.7 mp -99.9 -3.45 32.4 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.894 1.225 . . . . 0.0 113.125 168.949 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -86.76 1.38 52.41 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.555 1.142 . . . . 0.0 113.165 167.926 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.82 160.78 71.65 Favored Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 127.177 2.191 . . . . 0.0 114.145 -172.003 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -72.4 -121.68 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.125 1 C-N-CA 126.061 4.508 . . . . 0.0 110.139 173.079 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.9 m -56.97 -21.07 27.51 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.014 1.326 . . . . 0.0 113.405 179.946 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.04 -39.64 79.08 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.6 1.546 . . . . 0.0 112.254 173.547 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 5.7 t -71.28 -28.08 63.88 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.661 -1.274 . . . . 0.0 111.483 169.623 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.9 tpp180 -61.68 -40.25 94.31 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 120.742 -1.224 . . . . 0.0 111.769 170.766 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.496 HG23 HD13 ' A' ' 40' ' ' LEU . 1.9 mm -57.17 -43.49 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 124.873 1.269 . . . . 0.0 112.43 171.585 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 71.6 mt -60.11 -47.0 87.72 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 119.129 -0.462 . . . . 0.0 111.74 174.769 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.4 p -76.55 -26.59 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -171.869 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.84 -21.52 37.54 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 173.334 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.3 tp -77.63 -29.43 51.76 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 120.947 1.703 . . . . 0.0 112.117 170.602 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.42 -49.68 17.77 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.84 2.056 . . . . 0.0 112.51 170.129 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -101.31 29.84 4.53 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 128.538 2.735 . . . . 0.0 110.55 174.703 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -128.02 -84.45 0.45 Allowed Glycine 0 CA--C 1.527 0.791 0 C-N-CA 125.6 1.571 . . . . 0.0 113.256 -177.542 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 26.9 m 31.77 31.4 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 118.347 2.721 . . . . 0.0 118.347 -171.172 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 96.3 m -83.3 -87.33 0.1 Allowed 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 125.316 1.446 . . . . 0.0 110.861 175.821 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -136.37 153.23 76.18 Favored Pre-proline 0 N--CA 1.472 0.63 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -169.569 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -56.53 135.02 68.05 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.991 1.794 . . . . 0.0 109.096 171.882 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.72 -5.89 67.87 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 117.874 -1.515 . . . . 0.0 114.854 -174.961 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.88 -28.89 64.6 Favored 'General case' 0 C--N 1.348 0.539 0 CA-C-N 120.499 2.149 . . . . 0.0 112.38 177.284 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.496 HD13 HG23 ' A' ' 26' ' ' ILE . 4.0 mt -69.09 -16.1 63.6 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 124.262 1.025 . . . . 0.0 111.952 -175.762 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.58 -47.54 66.51 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 119.772 1.169 . . . . 0.0 110.36 174.315 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.48 -39.97 85.26 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.849 -0.532 . . . . 0.0 111.789 172.587 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -71.78 -27.85 63.22 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -175.796 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 37.6 mt -95.96 -22.79 17.19 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.316 1.046 . . . . 0.0 112.16 173.749 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.54 9.81 86.72 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.319 0.961 . . . . 0.0 112.003 -167.97 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 80.3 mt -108.26 167.57 9.93 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.954 1.302 . . . . 0.0 112.445 -169.358 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.7 p -69.15 143.26 54.14 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.526 0.679 . . . . 0.0 112.537 -167.882 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -56.71 -31.49 64.56 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.44 1.096 . . . . 0.0 111.157 172.024 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 12.4 m -66.0 -54.43 26.24 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.14 0.976 . . . . 0.0 111.445 171.096 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -70.43 -35.46 73.41 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.464 1.029 . . . . 0.0 112.239 -175.531 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.405 HG22 HD11 ' A' ' 26' ' ' ILE . 6.3 t -61.78 -34.69 63.61 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 O-C-N 119.57 -1.956 . . . . 0.0 111.865 169.779 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 56.0 m -67.53 -41.93 83.57 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 120.134 1.334 . . . . 0.0 112.523 172.753 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -50.7 -45.98 58.63 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.66 0.784 . . . . 0.0 110.735 171.973 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -68.93 -33.9 74.5 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 -179.189 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 23.8 mt -88.89 -7.32 56.31 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.807 1.243 . . . . 0.0 113.988 -178.172 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.7 t -67.05 -51.18 57.82 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 120.194 1.361 . . . . 0.0 110.886 177.217 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 5.2 t -73.8 -39.84 63.83 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 122.893 0.477 . . . . 0.0 111.76 179.767 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.3 tp -55.25 -38.19 68.21 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.778 2.031 . . . . 0.0 113.556 -174.036 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.7 mtm180 -78.51 -23.11 46.49 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.46 1.104 . . . . 0.0 112.178 -179.741 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -80.49 -55.51 3.41 Favored Glycine 0 C--N 1.342 0.908 0 C-N-CA 125.861 1.696 . . . . 0.0 110.78 172.766 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 66.6 m -51.08 -16.12 0.42 Allowed 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 127.413 2.285 . . . . 0.0 113.164 173.184 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.4 ' O ' ' HB2' ' A' ' 78' ' ' ALA . . . 79.35 -3.24 67.92 Favored Glycine 0 C--N 1.338 0.677 0 C-N-CA 125.91 1.719 . . . . 0.0 113.716 179.468 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 34.5 mt -57.17 -26.57 60.83 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 118.495 1.148 . . . . 0.0 112.323 -179.044 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 6.1 m -133.21 156.88 42.49 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.102 0 C-N-CA 126.488 1.915 . . . . 0.0 111.384 169.204 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.5 m -148.92 151.5 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 126.043 1.737 . . . . 0.0 111.349 -171.907 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -88.4 140.27 29.63 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.355 1.462 . . . . 0.0 112.416 176.94 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 90.2 m -160.84 158.83 29.04 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.774 1.63 . . . . 0.0 107.777 -179.892 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -84.97 138.15 32.66 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 121.57 1.986 . . . . 0.0 112.011 169.6 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.0 -10.2 57.26 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 169.866 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 131.29 -22.5 4.43 Favored Glycine 0 N--CA 1.474 1.205 0 C-N-CA 125.96 1.743 . . . . 0.0 114.751 174.697 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.94 5.71 0.3 Allowed 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.056 2.142 . . . . 0.0 113.886 -179.909 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -152.67 157.64 41.23 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 128.62 2.768 . . . . 0.0 108.043 168.641 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 5.6 p -79.78 145.85 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 168.642 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.9 ptt85 -124.7 148.2 48.16 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 125.535 1.534 . . . . 0.0 109.837 -177.494 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -100.42 135.08 42.41 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 105.443 -2.058 . . . . 0.0 105.443 164.902 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -145.87 158.3 43.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 118.19 -0.909 . . . . 0.0 111.541 -176.003 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 tp -56.53 154.86 8.0 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.064 0.945 . . . . 0.0 112.688 176.342 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 62' ' ' GLY . . . -59.14 -11.08 3.27 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 117.83 2.53 . . . . 0.0 117.83 -175.898 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.0 t70 152.1 161.62 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 131.165 3.786 . . . . 0.0 109.549 -177.371 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -41.33 -22.51 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 129.372 3.069 . . . . 0.0 112.099 163.579 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -64.12 0.96 Allowed 'General case' 0 C--N 1.349 0.563 0 C-N-CA 126.621 1.968 . . . . 0.0 111.485 175.21 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 25.3 mt -56.27 -43.77 79.09 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.701 1.137 . . . . 0.0 108.741 173.928 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.53 -44.65 69.35 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.512 1.125 . . . . 0.0 112.148 -172.884 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -79.67 -15.09 58.22 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 115.706 1.743 . . . . 0.0 115.706 -175.887 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -92.78 -48.45 6.56 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.695 1.134 . . . . 0.0 110.956 170.278 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.5 tp -49.62 -45.83 48.62 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.641 1.976 . . . . 0.0 110.824 169.679 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.81 -19.33 79.31 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 126.796 2.141 . . . . 0.0 116.433 -170.925 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -101.54 -0.88 34.21 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 118.928 1.364 . . . . 0.0 113.047 170.208 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.6 tp 93.7 23.57 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 129.19 2.996 . . . . 0.0 113.68 169.219 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.285 3.9 t 71.34 37.98 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 125.47 1.508 . . . . 0.0 110.04 169.436 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 86.61 -21.98 0.18 Allowed 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.309 -0.869 . . . . 0.0 112.329 130.021 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.9 p -72.66 39.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 129.428 3.091 . . . . 0.0 112.566 171.94 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.6 m 52.44 10.61 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 128.627 2.771 . . . . 0.0 116.425 -179.903 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.8 tt 100.35 101.37 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 130.857 3.663 . . . . 0.0 108.829 -169.719 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -103.1 155.66 18.24 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.258 0.623 . . . . 0.0 111.035 170.255 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 31.3 m -98.24 150.25 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -171.681 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 59.7 p30 -99.57 -4.07 31.92 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 -179.713 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -75.71 40.0 0.18 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 127.708 2.403 . . . . 0.0 115.701 -167.015 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 45.8 t0 62.88 69.56 0.59 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.812 2.045 . . . . 0.0 110.081 170.66 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.97 164.57 33.23 Favored Pre-proline 0 CA--C 1.549 0.925 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.531 -169.879 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -83.21 172.75 10.41 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 124.292 3.328 . . . . 0.0 111.819 177.663 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 31.0 p . . . . . 0 CA--C 1.55 0.946 0 CA-C-O 123.073 1.416 . . . . 0.0 107.26 165.532 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 pp . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.67 -27.85 68.97 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 118.624 0.647 . . . . 0.0 112.49 175.548 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 1.3 mmt-85 -77.16 -26.36 52.92 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 116.854 -1.546 . . . . 0.0 113.413 176.979 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.71 -63.97 1.03 Allowed 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.785 1.175 . . . . 0.0 109.5 170.928 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.27 -37.71 95.31 Favored Glycine 0 N--CA 1.471 0.972 0 CA-C-N 118.22 0.464 . . . . 0.0 112.704 -172.764 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -46.58 88.98 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.698 0.799 . . . . 0.0 111.292 173.799 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.55 -14.72 61.7 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 118.239 -0.886 . . . . 0.0 112.893 -179.625 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 10.6 mp -93.39 -24.21 18.15 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.169 0.895 . . . . 0.0 112.607 170.624 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.18 -16.64 57.71 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.894 1.678 . . . . 0.0 113.776 169.443 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -59.36 130.64 87.5 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 126.423 1.889 . . . . 0.0 109.511 176.643 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -48.92 -72.3 0.05 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.554 1 C-N-CA 125.869 4.379 . . . . 0.0 111.918 -168.59 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 70.8 m -91.56 -15.43 28.69 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 117.914 -1.041 . . . . 0.0 112.082 -173.739 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 48.4 mtt180 -66.1 -33.97 76.99 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 121.415 1.916 . . . . 0.0 110.779 167.997 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 42.4 t -56.75 -46.03 81.64 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 120.024 1.284 . . . . 0.0 111.15 167.309 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -60.88 -46.71 89.55 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.56 0.744 . . . . 0.0 111.866 176.539 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.6 mm -57.85 -49.93 79.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.953 1.301 . . . . 0.0 112.06 174.706 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 85.8 mt -62.11 -45.34 93.89 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.092 0.957 . . . . 0.0 111.496 -178.767 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 5.7 p -74.81 -32.5 28.37 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 CA-C-N 118.868 0.758 . . . . 0.0 112.979 -179.501 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.95 -28.83 64.77 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.494 -0.754 . . . . 0.0 111.875 173.857 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.7 tp -65.3 -36.27 83.54 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-N 119.973 1.26 . . . . 0.0 113.507 175.509 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.96 -40.57 30.93 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.999 2.52 . . . . 0.0 113.077 171.414 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -98.24 9.14 43.68 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 127.023 2.129 . . . . 0.0 112.307 179.499 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -126.0 -82.61 0.46 Allowed Glycine 0 CA--C 1.527 0.815 0 C-N-CA 124.746 1.165 . . . . 0.0 115.147 -169.725 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 34.6 m 36.93 32.13 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 127.884 2.474 . . . . 0.0 116.707 -168.57 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 68.2 m -79.75 -90.65 0.05 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.662 0.785 . . . . 0.0 111.019 179.716 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -136.72 154.65 76.64 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -169.174 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -55.89 125.69 19.94 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.316 2.011 . . . . 0.0 109.696 175.55 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 90.03 -7.27 81.96 Favored Glycine 0 CA--C 1.533 1.178 0 CA-C-O 117.6 -1.667 . . . . 0.0 115.348 -174.409 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -27.05 63.17 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.666 2.233 . . . . 0.0 112.137 178.938 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 2.1 mp -71.35 -18.88 62.36 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-O 117.913 -1.042 . . . . 0.0 113.075 -177.653 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.09 -40.9 97.24 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.88 1.218 . . . . 0.0 111.206 172.443 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.04 -44.13 66.43 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.652 -0.655 . . . . 0.0 111.714 170.122 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.96 -29.23 70.65 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -177.714 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 45.9 mt -103.76 -14.06 16.21 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.336 1.454 . . . . 0.0 113.824 179.18 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.98 -0.51 45.59 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 119.004 0.82 . . . . 0.0 113.797 -169.153 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 43.3 mt -92.37 157.96 16.33 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.757 1.279 . . . . 0.0 111.653 -171.38 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 13.3 p -62.25 147.43 48.02 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.134 0.492 . . . . 0.0 110.91 -174.594 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 ptp180 -57.94 -33.6 68.98 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 122.148 -0.345 . . . . 0.0 111.834 175.883 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 15.9 m -65.68 -49.29 69.11 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.649 0.779 . . . . 0.0 111.532 171.345 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -66.07 -43.03 88.57 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 118.897 0.771 . . . . 0.0 111.246 -178.612 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 4.2 t -59.88 -32.04 48.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 O-C-N 119.303 -2.123 . . . . 0.0 112.55 170.371 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 54.8 m -67.66 -39.93 84.5 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.922 1.237 . . . . 0.0 113.204 172.468 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -50.15 -46.79 54.3 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.976 0.911 . . . . 0.0 110.715 171.215 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -67.18 -45.42 77.0 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 118.523 -0.751 . . . . 0.0 112.162 -179.311 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 32.2 mt -73.49 -22.55 60.11 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.963 1.098 . . . . 0.0 113.963 -177.828 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -56.49 -53.11 61.27 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.137 1.335 . . . . 0.0 113.685 -176.758 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 2.3 t -70.64 -40.17 73.24 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 118.654 0.661 . . . . 0.0 110.727 177.507 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 2.0 tp -56.23 -38.39 70.99 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 127.796 2.439 . . . . 0.0 114.743 -173.32 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 46.9 mtm105 -78.76 -16.05 57.68 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.276 1.03 . . . . 0.0 112.757 177.43 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -85.4 -54.39 2.84 Favored Glycine 0 C--N 1.341 0.847 0 C-N-CA 125.82 1.676 . . . . 0.0 111.025 169.715 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 99.4 m -50.94 -16.26 0.41 Allowed 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 127.549 2.34 . . . . 0.0 113.296 175.162 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.11 -4.18 59.19 Favored Glycine 0 C--N 1.338 0.684 0 C-N-CA 125.99 1.757 . . . . 0.0 113.526 -178.394 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 68.3 mt -56.11 -28.65 58.65 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.633 1.217 . . . . 0.0 112.286 178.707 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 8.1 m -132.22 155.64 41.68 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 C-N-CA 126.025 1.73 . . . . 0.0 111.451 169.642 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 1.7 m -147.63 151.63 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.73 1.612 . . . . 0.0 111.443 -170.213 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -94.13 140.25 29.98 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.442 1.497 . . . . 0.0 111.544 178.006 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.432 HG22 ' N ' ' B' ' 68' ' ' TYR . 47.7 m -163.15 171.97 15.54 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.547 1.539 . . . . 0.0 108.375 -174.442 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.432 ' N ' HG22 ' B' ' 67' ' ' THR . 6.5 m-85 -88.15 145.04 26.13 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 121.04 1.746 . . . . 0.0 111.878 167.807 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.19 -44.71 13.68 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.461 -0.774 . . . . 0.0 111.328 170.533 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.25 -25.55 0.03 OUTLIER Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.553 1.549 . . . . 0.0 114.266 171.368 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.76 -29.73 0.78 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.042 1.737 . . . . 0.0 112.751 176.952 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -117.38 166.55 12.18 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.326 2.25 . . . . 0.0 110.255 176.982 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 8.7 p -79.78 147.93 6.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.641 172.255 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 14.0 ptt85 -130.65 160.93 32.77 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 127.983 2.513 . . . . 0.0 109.646 -177.306 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 21.2 m-30 -104.59 146.56 28.73 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 161.924 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -148.72 157.97 43.82 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 124.376 1.07 . . . . 0.0 110.299 178.807 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 58.3 mt -62.56 155.28 26.34 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.604 0.638 . . . . 0.0 111.529 172.279 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -50.49 -21.5 1.52 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 128.155 2.582 . . . . 0.0 117.3 -176.128 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 8.3 t70 167.4 168.2 0.03 OUTLIER 'General case' 0 C--O 1.24 0.558 0 C-N-CA 130.669 3.588 . . . . 0.0 108.282 177.167 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -42.02 -20.25 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.782 2.433 . . . . 0.0 111.778 162.087 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -63.18 1.3 Allowed 'General case' 0 C--N 1.346 0.415 0 C-N-CA 127.885 2.474 . . . . 0.0 111.742 175.5 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 34.1 mt -65.1 -35.86 82.46 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.384 0.993 . . . . 0.0 109.683 176.25 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.65 -41.72 82.05 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 177.238 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -81.76 -21.59 37.73 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -176.678 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -85.84 -44.31 12.55 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.024 0.829 . . . . 0.0 111.567 171.204 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.74 -39.93 88.13 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 122.762 0.425 . . . . 0.0 111.042 175.564 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.15 -18.96 58.75 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.686 1.612 . . . . 0.0 115.638 -176.698 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.6 -2.23 25.38 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 169.877 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 17.6 tp 106.17 2.26 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 130.596 3.559 . . . . 0.0 114.476 167.542 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . 0.306 2.9 t 80.58 40.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 125.939 1.696 . . . . 0.0 110.068 -177.871 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 86.81 -26.41 0.09 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.367 -0.833 . . . . 0.0 113.049 127.046 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 13.7 p -68.58 31.1 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.918 1 C-N-CA 131.787 4.035 . . . . 0.0 113.595 175.955 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 31.1 m 47.08 25.62 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 127.334 2.254 . . . . 0.0 115.84 -177.107 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt 97.74 98.78 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 130.502 3.521 . . . . 0.0 110.506 -179.348 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.651 0 O-C-N 121.872 -0.517 . . . . 0.0 110.691 169.567 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 pp . . . . . 0 N--CA 1.468 0.436 0 CA-C-O 120.658 0.266 . . . . 0.0 111.588 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.29 -11.2 60.61 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.167 0.987 . . . . 0.0 113.27 -179.176 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.0 mmp_? -108.5 -25.62 10.84 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.731 -1.231 . . . . 0.0 113.354 171.215 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -53.82 -45.78 70.95 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.408 1.083 . . . . 0.0 109.464 169.267 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.03 -36.6 93.24 Favored Glycine 0 CA--C 1.535 1.287 0 CA-C-O 119.349 -0.695 . . . . 0.0 113.365 175.148 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -45.65 92.09 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 118.975 1.388 . . . . 0.0 110.311 177.602 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.46 98.09 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.565 1.146 . . . . 0.0 111.94 176.756 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.6 mt -78.61 -15.11 58.91 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 117.918 -1.039 . . . . 0.0 113.271 177.612 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.86 -26.8 25.46 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 169.74 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -47.83 143.37 6.24 Favored Pre-proline 0 CA--C 1.543 0.689 0 C-N-CA 126.069 1.747 . . . . 0.0 113.571 -173.865 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -61.15 -74.62 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.607 1 C-N-CA 125.604 4.202 . . . . 0.0 111.956 -169.762 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 46.7 m -59.1 -37.94 78.35 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 121.834 -0.541 . . . . 0.0 110.429 172.092 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.55 -32.38 68.04 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -169.019 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.7 t -64.88 -46.89 79.89 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 121.369 1.895 . . . . 0.0 108.273 167.28 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 32.9 ttm-85 -62.55 -15.83 52.87 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.157 1.383 . . . . 0.0 114.661 175.28 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.3 mt -71.71 -55.93 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 CA-C-N 121.46 1.937 . . . . 0.0 108.886 167.571 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.02 -33.24 70.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 117.889 -1.053 . . . . 0.0 113.685 -172.269 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.4 m -60.48 -27.25 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 CA-C-N 119.658 1.117 . . . . 0.0 112.072 173.974 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -104.17 8.05 36.24 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.616 1.966 . . . . 0.0 112.398 -179.038 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.465 HD22 ' HA ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -104.94 -22.12 13.19 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.016 1.726 . . . . 0.0 113.061 172.013 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.14 -59.14 5.75 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.411 1.885 . . . . 0.0 107.007 166.298 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -96.77 35.52 1.52 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 128.213 2.605 . . . . 0.0 112.202 173.716 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -110.61 -98.89 2.51 Favored Glycine 0 N--CA 1.472 1.049 0 O-C-N 120.889 -1.132 . . . . 0.0 113.721 -172.152 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.4 m 43.35 14.67 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 N-CA-C 120.268 3.433 . . . . 0.0 120.268 173.07 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 72.6 m -80.7 -89.88 0.06 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.347 0.976 . . . . 0.0 111.058 175.699 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.461 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 0.5 OUTLIER -133.02 158.14 76.6 Favored Pre-proline 0 CA--C 1.55 0.977 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -168.077 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -59.57 131.22 39.15 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.438 2.759 . . . . 0.0 110.717 177.867 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.09 -2.47 18.6 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-O 117.783 -1.565 . . . . 0.0 115.079 -179.072 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.461 ' HG2' ' H ' ' A' ' 36' ' ' TYR . 2.6 pp0? -60.21 -30.32 69.3 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 120.468 2.134 . . . . 0.0 111.71 -178.637 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 mt -46.87 -26.95 1.08 Allowed 'General case' 0 C--O 1.219 -0.535 0 C-N-CA 126.141 1.777 . . . . 0.0 112.992 174.555 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.74 -39.71 71.53 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 175.096 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.68 -42.77 57.83 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.139 0.881 . . . . 0.0 111.467 172.361 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -31.2 70.38 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 125.689 1.596 . . . . 0.0 113.698 -178.502 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 25.7 mt -103.18 -13.98 16.56 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.814 2.046 . . . . 0.0 113.521 178.854 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.33 3.92 67.35 Favored Glycine 0 CA--C 1.538 1.512 0 C-N-CA 125.164 1.364 . . . . 0.0 114.569 -171.084 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.5 mt -93.04 169.06 10.71 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.758 1.223 . . . . 0.0 112.142 -171.258 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.491 HG23 ' H ' ' A' ' 50' ' ' ASN . 1.3 t -70.65 141.72 51.65 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 120.915 -1.116 . . . . 0.0 110.857 169.339 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -62.78 -11.67 19.3 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.06 0.944 . . . . 0.0 112.949 169.695 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 41.0 t -71.0 -58.44 3.57 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.555 1.142 . . . . 0.0 111.157 167.811 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.491 ' H ' HG23 ' A' ' 47' ' ' THR . 41.6 t-20 -55.08 -49.33 71.93 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.851 1.66 . . . . 0.0 110.811 173.394 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 5.0 t -60.08 -44.59 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-O 117.91 -1.043 . . . . 0.0 112.302 175.326 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 60.0 m -69.76 -35.66 75.12 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 121.335 1.88 . . . . 0.0 113.705 -179.686 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -50.54 -46.58 57.54 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.536 0.734 . . . . 0.0 110.887 172.14 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -82.2 -13.04 57.71 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 175.82 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 92.3 mt -78.78 -26.72 44.46 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 122.117 2.235 . . . . 0.0 110.906 168.637 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.0 m -45.51 -55.93 5.65 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.662 1.119 . . . . 0.0 113.08 172.917 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 1.7 t -93.2 4.64 53.66 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 179.388 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.7 tp -83.72 -40.68 18.56 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.871 -1.143 . . . . 0.0 108.657 167.159 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.2 mtm105 -76.86 -28.76 55.56 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.618 1.567 . . . . 0.0 110.585 173.552 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.71 -64.25 3.55 Favored Glycine 0 C--N 1.345 1.05 0 C-N-CA 125.431 1.491 . . . . 0.0 110.909 174.744 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 49.5 m -65.89 5.72 0.45 Allowed 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 125.7 1.6 . . . . 0.0 114.6 176.202 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.62 -2.4 31.59 Favored Glycine 0 N--CA 1.471 0.974 0 C-N-CA 126.03 1.776 . . . . 0.0 114.973 176.031 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 72.1 mt -59.85 -25.67 65.22 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.718 1.259 . . . . 0.0 113.51 -175.689 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.7 m -123.83 140.77 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.755 1.622 . . . . 0.0 111.815 169.002 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 51.6 t -118.61 138.64 48.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 127.18 2.192 . . . . 0.0 110.025 -175.988 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.49 143.05 40.7 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.605 1.162 . . . . 0.0 111.254 172.574 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.8 m -164.72 150.04 9.89 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 120.256 -1.528 . . . . 0.0 109.644 -176.788 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -84.16 126.34 33.02 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.166 1.348 . . . . 0.0 110.061 165.557 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.282 0.0 OUTLIER -74.34 -41.47 61.03 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.477 0.581 . . . . 0.0 111.844 174.817 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 162.08 -30.36 0.3 Allowed Glycine 0 CA--C 1.531 1.073 0 C-N-CA 125.476 1.512 . . . . 0.0 114.116 169.724 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -112.58 -17.82 12.53 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 127.055 2.142 . . . . 0.0 112.61 172.116 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -151.21 164.27 36.95 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.81 2.444 . . . . 0.0 110.415 -171.913 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 4.2 p -82.55 152.89 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 123.559 0.743 . . . . 0.0 110.51 168.833 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.2 ptt180 -136.96 162.34 33.54 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 126.316 1.846 . . . . 0.0 111.3 -172.755 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -116.68 123.46 47.3 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.142 0.977 . . . . 0.0 108.466 166.463 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -125.3 149.11 48.38 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 117.011 -1.471 . . . . 0.0 110.989 -178.531 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.7 mp -61.0 151.28 31.03 Favored 'General case' 0 C--N 1.348 0.508 0 C-N-CA 118.697 -1.201 . . . . 0.0 108.562 170.291 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.04 -28.78 69.31 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 114.534 -1.212 . . . . 0.0 113.924 -168.912 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -171.7 161.66 6.09 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.644 2.378 . . . . 0.0 111.169 169.604 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.1 m -34.99 -32.73 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 131.024 3.729 . . . . 0.0 113.434 165.505 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -59.8 -56.0 27.3 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.895 1.678 . . . . 0.0 111.078 175.471 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -39.49 89.99 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 120.462 1.483 . . . . 0.0 110.977 176.827 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.7 -37.49 73.58 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-O 119.023 -0.513 . . . . 0.0 112.299 176.779 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -67.17 -45.79 75.96 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 119.433 1.015 . . . . 0.0 113.173 176.929 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.82 -42.94 80.74 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.44 1.018 . . . . 0.0 110.423 -177.229 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -61.83 -28.64 69.63 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 170.854 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.6 -30.18 76.86 Favored Glycine 0 CA--C 1.538 1.528 0 O-C-N 121.0 -1.062 . . . . 0.0 113.917 169.585 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -101.43 22.62 12.3 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 119.089 1.445 . . . . 0.0 111.698 166.551 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 19.4 tp 63.9 -40.88 0.23 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 131.005 3.722 . . . . 0.0 114.254 -171.694 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -170.8 -61.84 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 128.975 2.91 . . . . 0.0 108.481 -172.431 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 174.06 -35.06 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 126.347 1.859 . . . . 0.0 111.126 -173.371 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.1 p -73.48 26.33 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -171.39 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 62.87 25.27 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 125.107 1.363 . . . . 0.0 111.985 172.811 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.5 mp 90.95 95.44 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 131.573 3.949 . . . . 0.0 112.457 175.573 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.93 152.93 44.77 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 166.278 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.407 HG12 ' H ' ' A' ' 98' ' ' THR . 3.4 t -79.33 139.29 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.612 1.565 . . . . 0.0 112.504 -167.718 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -71.29 4.2 3.07 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 125.48 1.512 . . . . 0.0 114.514 174.55 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.407 ' H ' HG12 ' A' ' 96' ' ' VAL . 26.0 p -72.14 111.62 7.52 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 120.88 -1.138 . . . . 0.0 108.218 168.872 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -76.16 113.11 13.33 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 174.35 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -129.97 154.61 81.22 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-O 117.606 -1.188 . . . . 0.0 107.817 179.773 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -67.37 -18.93 49.99 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.505 2.137 . . . . 0.0 114.19 179.365 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . 0.394 1.8 t . . . . . 0 CA--C 1.545 0.773 1 C-N-CA 134.117 4.967 . . . . 0.0 112.373 167.221 . . . . . . . . 2 1 . 1 . 029 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 pp . . . . . 0 N--CA 1.47 0.543 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.97 -14.29 62.64 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.213 1.005 . . . . 0.0 112.975 175.905 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 15.7 mmp_? -93.14 -33.56 13.99 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 120.764 -1.21 . . . . 0.0 112.22 169.473 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -57.3 -55.44 34.79 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.527 1.058 . . . . 0.0 109.317 169.725 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.56 -33.83 88.27 Favored Glycine 0 CA--C 1.53 0.996 0 CA-C-N 118.715 0.689 . . . . 0.0 112.311 -178.447 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -46.99 87.53 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 118.347 1.074 . . . . 0.0 110.207 171.33 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.67 -15.83 63.17 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.42 1.488 . . . . 0.0 113.506 -178.177 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.3 mp -102.71 -12.73 17.44 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.972 0.909 . . . . 0.0 112.586 169.272 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.45 -7.93 59.65 Favored 'General case' 0 CA--C 1.554 1.134 0 N-CA-C 116.985 2.217 . . . . 0.0 116.985 174.573 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -73.0 161.72 78.04 Favored Pre-proline 0 CA--C 1.543 0.707 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -168.822 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -58.82 -70.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.868 1 C-N-CA 125.455 4.103 . . . . 0.0 111.518 168.465 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 24.6 m -75.68 -43.03 49.47 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 117.902 -1.047 . . . . 0.0 111.939 -179.506 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.426 ' HD2' HD13 ' B' ' 58' ' ' LEU . 0.3 OUTLIER -64.29 -40.27 95.61 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 121.006 1.73 . . . . 0.0 115.211 -169.643 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 14.6 t -60.85 -45.06 96.0 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 120.153 1.342 . . . . 0.0 110.351 170.867 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 33.0 ttm-85 -62.49 -23.67 67.05 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.464 1.106 . . . . 0.0 113.556 175.364 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 mt -67.99 -57.13 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 120.156 1.344 . . . . 0.0 107.837 166.928 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 61.8 mt -55.6 -41.83 73.99 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 117.715 -1.136 . . . . 0.0 112.743 -174.367 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.1 m -61.35 -30.72 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-N 119.896 1.225 . . . . 0.0 112.65 176.652 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -95.62 -3.81 45.6 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.302 1.441 . . . . 0.0 112.525 -176.291 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.418 HD22 ' HA ' ' B' ' 30' ' ' LEU . 0.1 OUTLIER -90.67 -23.01 20.88 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 175.945 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.14 -61.21 2.37 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 128.806 2.842 . . . . 0.0 110.167 170.574 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -91.66 7.83 39.71 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 126.593 1.957 . . . . 0.0 113.078 175.655 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.87 -85.9 1.17 Allowed Glycine 0 N--CA 1.47 0.909 0 C-N-CA 125.02 1.295 . . . . 0.0 114.179 -168.376 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 20.9 m 39.14 15.83 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 N-CA-C 120.95 3.685 . . . . 0.0 120.95 179.793 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 69.6 m -79.39 -91.45 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.465 1.03 . . . . 0.0 111.791 -178.12 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 36' ' ' TYR . . . . . 0.513 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 1.8 m-85 -137.88 161.56 59.27 Favored Pre-proline 0 CA--C 1.555 1.161 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -168.216 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -55.61 132.41 51.95 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 123.285 2.657 . . . . 0.0 110.396 174.943 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.05 -6.57 26.92 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 117.686 -1.619 . . . . 0.0 114.827 -179.341 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 39' ' ' GLN . . . . . 0.513 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 2.6 pp0? -56.67 -36.14 69.23 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.686 1.743 . . . . 0.0 111.292 -179.689 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 8.7 mt -50.17 -32.84 17.24 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 125.103 1.361 . . . . 0.0 112.235 176.42 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.8 -53.16 58.85 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.496 0.589 . . . . 0.0 111.334 -177.751 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.5 -39.07 88.5 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.078 0.551 . . . . 0.0 112.083 175.797 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -63.23 -27.23 69.21 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.835 1.654 . . . . 0.0 113.708 179.175 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 18.0 mt -99.15 -21.48 16.12 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 126.144 1.778 . . . . 0.0 112.818 175.385 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.7 10.84 83.73 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 124.957 1.265 . . . . 0.0 113.737 -170.411 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 69.6 mt -105.87 168.87 8.83 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.381 1.473 . . . . 0.0 112.53 -170.727 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.53 HG23 ' H ' ' B' ' 50' ' ' ASN . 3.3 t -71.96 138.34 47.97 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 120.798 -1.188 . . . . 0.0 111.748 170.276 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 23.2 ptt180 -59.72 -17.39 34.35 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.165 1.386 . . . . 0.0 112.587 169.628 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 39.2 t -66.79 -58.13 5.66 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 119.91 1.232 . . . . 0.0 112.142 168.882 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 50' ' ' ASN . . . . . 0.53 ' H ' HG23 ' B' ' 47' ' ' THR . 35.0 t-20 -56.84 -51.71 67.95 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.501 1.521 . . . . 0.0 110.548 173.285 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 94.0 t -62.01 -37.65 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-O 118.305 -0.855 . . . . 0.0 112.02 -178.647 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 24.5 m -74.91 -35.49 62.22 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 120.89 1.677 . . . . 0.0 113.857 175.648 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -50.88 -45.28 59.95 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.127 0.876 . . . . 0.0 111.64 170.628 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -75.64 -19.82 58.92 Favored 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 174.673 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 28.5 mt -80.02 -20.68 44.79 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.501 1.5 . . . . 0.0 113.192 171.586 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 43.4 m -44.09 -55.86 4.44 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 120.161 1.346 . . . . 0.0 112.323 172.416 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.8 t -93.44 -10.79 33.88 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 179.28 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 58' ' ' LEU . . . . . 0.426 HD13 ' HD2' ' B' ' 23' ' ' ARG . 6.4 tp -69.34 -34.62 74.9 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.446 -1.408 . . . . 0.0 109.621 168.645 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.4 ' HG2' HG23 ' B' ' 64' ' ' VAL . 74.7 mtm180 -80.77 -22.26 40.3 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.798 1.239 . . . . 0.0 112.683 169.72 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -69.79 -65.44 2.56 Favored Glycine 0 N--CA 1.472 1.092 0 C-N-CA 125.21 1.386 . . . . 0.0 111.571 175.7 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 56.3 m -67.23 5.12 0.77 Allowed 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 125.796 1.639 . . . . 0.0 114.338 175.23 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.07 6.53 79.64 Favored Glycine 0 C--N 1.343 0.961 0 O-C-N 120.85 -1.157 . . . . 0.0 114.188 172.57 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.404 HD12 HD12 ' B' ' 58' ' ' LEU . 98.4 mt -62.12 -31.41 71.86 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.748 1.219 . . . . 0.0 112.929 179.605 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.4 HG23 ' HG2' ' B' ' 59' ' ' ARG . 1.6 m -125.18 136.02 62.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 126.214 1.805 . . . . 0.0 112.333 170.99 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 47.3 t -119.11 137.98 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 127.357 2.263 . . . . 0.0 111.35 -171.242 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.22 142.75 34.36 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.831 1.252 . . . . 0.0 112.613 173.463 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.9 m -167.4 142.49 3.93 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 117.034 -1.46 . . . . 0.0 111.768 -173.993 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -74.72 121.03 21.07 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 121.31 1.868 . . . . 0.0 109.276 165.658 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.305 0.0 OUTLIER -68.24 -55.72 11.22 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 118.234 -0.888 . . . . 0.0 109.858 175.185 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -173.55 -32.7 0.03 OUTLIER Glycine 0 CA--C 1.535 1.287 0 C-N-CA 125.769 1.652 . . . . 0.0 113.984 169.171 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 29.2 tpt180 -114.0 -19.45 11.41 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.601 2.36 . . . . 0.0 113.413 176.729 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -149.55 164.9 33.8 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 128.468 2.707 . . . . 0.0 109.926 -170.821 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 4.2 p -79.32 147.15 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 121.22 -0.925 . . . . 0.0 109.845 168.672 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -128.68 160.96 30.83 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 127.043 2.137 . . . . 0.0 110.674 -176.18 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -111.39 121.4 45.13 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 106.873 -1.529 . . . . 0.0 106.873 167.069 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -123.42 154.65 38.75 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 117.156 -1.402 . . . . 0.0 111.243 174.741 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 mp -66.87 152.8 44.94 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 117.771 -1.572 . . . . 0.0 106.886 166.602 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.8 -24.05 67.56 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -170.401 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -173.66 161.34 3.91 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.931 1.692 . . . . 0.0 112.157 171.197 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -36.92 -34.55 0.08 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 130.504 3.521 . . . . 0.0 113.523 166.251 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 22.1 t60 -62.82 -52.44 63.14 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.707 1.203 . . . . 0.0 110.425 177.854 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -41.65 93.64 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 120.471 1.487 . . . . 0.0 111.076 175.206 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.26 -35.04 69.25 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 178.104 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 3.2 ptm85 -74.21 -39.1 63.36 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 177.566 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.15 -44.41 84.22 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.452 1.024 . . . . 0.0 110.058 176.144 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -54.33 -42.27 70.01 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.248 0.619 . . . . 0.0 111.597 169.76 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -60.83 -19.84 56.3 Favored Glycine 0 CA--C 1.541 1.683 0 C-N-CA 124.858 1.218 . . . . 0.0 115.184 177.037 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . 0.253 9.7 pt-20 -121.14 25.49 9.53 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.343 1.571 . . . . 0.0 112.626 165.961 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 58.0 tp 66.54 -49.3 0.45 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 131.229 3.812 . . . . 0.0 113.058 -173.363 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 33.5 t -153.48 -51.76 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 C-N-CA 128.649 2.78 . . . . 0.0 107.87 169.502 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 175.54 -22.06 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.992 1.317 . . . . 0.0 114.452 -160.619 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 8.4 p -74.49 26.64 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 O-C-N 120.247 -1.533 . . . . 0.0 113.508 -178.283 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 61.18 28.05 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.919 0 C-N-CA 124.346 1.058 . . . . 0.0 111.319 176.137 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.8 mp 75.13 111.35 0.07 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 130.247 3.419 . . . . 0.0 113.435 -171.902 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.075 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 163.307 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.0 tp . . . . . 0 CA--C 1.542 0.666 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -49.05 -39.09 26.14 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.17 1.788 . . . . 0.0 112.354 169.888 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -14.76 56.16 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 126.109 1.764 . . . . 0.0 112.845 -176.862 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -72.01 -58.01 3.8 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.782 0.833 . . . . 0.0 108.954 167.006 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -57.65 -32.46 65.28 Favored Glycine 0 C--N 1.337 0.622 0 CA-C-O 118.681 -1.066 . . . . 0.0 112.263 -169.789 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.42 -22.26 65.54 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.044 1.422 . . . . 0.0 111.552 177.267 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -80.78 -17.14 51.87 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.324 -1.485 . . . . 0.0 113.699 172.325 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.7 mp -103.34 -18.14 14.98 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.527 0.731 . . . . 0.0 112.224 172.425 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' B' ' 12' ' ' ALA . . . -65.77 15.63 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 129.366 3.066 . . . . 0.0 116.355 177.071 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.97 145.38 30.39 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 126.554 1.942 . . . . 0.0 109.418 -177.168 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -62.48 -84.96 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.68 1 C-N-CA 126.059 4.506 . . . . 0.0 112.309 -169.298 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 85.8 m -44.45 -40.72 5.73 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 126.203 1.801 . . . . 0.0 111.282 170.857 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.8 ttp180 -74.6 -32.65 62.42 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 116.249 1.944 . . . . 0.0 116.249 -168.667 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 50.5 t -63.37 -39.79 95.49 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 120.377 1.444 . . . . 0.0 109.616 168.287 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 39.2 mtt180 -65.17 -40.1 93.83 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.429 1.092 . . . . 0.0 111.459 176.63 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 8.7 mt -47.6 -56.45 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-N 119.623 1.101 . . . . 0.0 110.981 167.541 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 74.6 mt -60.04 -44.65 94.51 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.263 -1.335 . . . . 0.0 112.695 -178.222 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -66.09 -31.38 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 120.18 1.355 . . . . 0.0 113.251 174.456 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.78 7.34 21.01 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.789 2.035 . . . . 0.0 114.433 173.611 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.553 HD22 ' HA ' ' A' ' 76' ' ' ALA . 7.1 mt -101.44 -28.91 12.31 Favored 'General case' 0 N--CA 1.435 -1.177 0 C-N-CA 126.917 2.087 . . . . 0.0 113.054 167.374 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 mt -62.41 -42.14 99.21 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 124.435 1.085 . . . . 0.0 109.169 168.588 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -124.59 86.96 2.64 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.9 2.08 . . . . 0.0 110.91 169.91 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -171.34 -86.21 0.06 OUTLIER Glycine 0 N--CA 1.474 1.216 0 C-N-CA 127.263 2.363 . . . . 0.0 113.227 174.415 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 18.5 m 37.36 38.31 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 127.485 2.314 . . . . 0.0 116.79 -179.267 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.409 ' HB2' ' HG2' ' A' ' 39' ' ' GLN . 9.4 m -83.76 -79.53 0.2 Allowed 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 126.374 1.87 . . . . 0.0 110.568 -176.729 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -147.83 145.34 20.86 Favored Pre-proline 0 N--CA 1.475 0.784 0 C-N-CA 125.696 1.598 . . . . 0.0 110.209 -172.226 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.97 -10.34 22.55 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.023 2.482 . . . . 0.0 116.676 -169.138 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.65 -2.39 40.28 Favored Glycine 0 CA--C 1.539 1.562 0 CA-C-N 119.885 1.22 . . . . 0.0 114.871 169.219 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.43 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -60.46 -29.4 69.02 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.034 1.334 . . . . 0.0 113.292 -171.959 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 29.4 mt -49.97 -28.28 6.6 Favored 'General case' 0 C--O 1.218 -0.588 0 C-N-CA 125.878 1.671 . . . . 0.0 111.808 179.602 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -75.07 -32.95 61.61 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -173.616 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.89 -36.57 28.01 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.153 0.501 . . . . 0.0 110.697 169.037 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.43 ' CD2' HE22 ' A' ' 39' ' ' GLN . 11.3 t60 -73.39 -31.59 63.98 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 -174.131 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.8 mt -96.09 -19.43 19.42 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.692 1.597 . . . . 0.0 112.676 172.66 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.07 -5.12 20.53 Favored Glycine 0 CA--C 1.536 1.386 0 CA-C-O 118.832 -0.982 . . . . 0.0 113.594 -168.471 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -73.71 133.71 43.4 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.608 1.563 . . . . 0.0 109.891 175.578 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.4 t -60.83 146.02 47.81 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.646 1.112 . . . . 0.0 111.511 -177.283 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.428 ' CD ' ' H ' ' A' ' 48' ' ' ARG . 0.0 OUTLIER -55.0 -29.72 57.94 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 -174.659 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.2 m -63.86 -48.76 75.45 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.059 0.845 . . . . 0.0 112.374 170.408 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -64.37 -46.27 84.13 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.901 1.68 . . . . 0.0 110.968 178.039 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 1.2 t -56.66 -44.57 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 124.17 0.988 . . . . 0.0 111.905 170.181 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 97.2 p -67.62 -38.38 83.83 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.725 1.148 . . . . 0.0 113.971 179.423 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -56.94 -52.19 66.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.748 1.219 . . . . 0.0 109.839 174.976 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -72.15 -27.59 62.69 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 120.825 -1.172 . . . . 0.0 113.983 177.464 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 34.6 mt -67.85 -33.13 74.17 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 121.473 1.942 . . . . 0.0 112.566 169.59 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.7 m -59.51 -34.59 72.8 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.404 0.682 . . . . 0.0 112.006 -177.939 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 34.1 t -75.87 -43.07 47.33 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.673 -0.642 . . . . 0.0 111.912 173.624 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.3 tp -71.32 -39.4 71.43 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.589 1.556 . . . . 0.0 112.848 -169.243 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -74.09 -7.86 54.05 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.605 1.162 . . . . 0.0 111.766 173.186 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -100.05 -40.39 3.08 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.749 1.642 . . . . 0.0 113.452 172.997 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.3 m -75.35 1.11 14.64 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.043 1.737 . . . . 0.0 112.688 170.661 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.24 2.92 80.78 Favored Glycine 0 N--CA 1.467 0.709 0 C-N-CA 127.42 2.438 . . . . 0.0 116.494 166.778 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 76.5 mt -71.43 -20.04 62.16 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.623 1.712 . . . . 0.0 113.893 -175.001 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.454 HG12 ' CD1' ' A' ' 30' ' ' LEU . 6.3 m -126.97 140.35 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.226 1.411 . . . . 0.0 113.791 -178.559 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.1 t -141.33 142.24 29.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.974 -170.821 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.14 148.02 23.24 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.357 1.463 . . . . 0.0 113.582 171.833 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -135.49 178.6 6.91 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.124 1.769 . . . . 0.0 106.964 167.923 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -96.11 128.79 43.34 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 166.368 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -19.43 60.06 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.25 1.02 . . . . 0.0 112.492 168.948 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 128.16 -40.95 1.65 Allowed Glycine 0 N--CA 1.471 1.002 0 C-N-CA 125.526 1.536 . . . . 0.0 112.381 172.85 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -91.94 -38.1 12.47 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.599 1.959 . . . . 0.0 110.733 171.819 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.23 -175.84 4.59 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.945 2.098 . . . . 0.0 110.693 177.793 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.6 151.42 5.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 C-N-CA 123.481 0.712 . . . . 0.0 109.838 168.013 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -120.91 -173.31 2.57 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 126.918 2.087 . . . . 0.0 108.861 167.234 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.521 ' CE2' HD21 ' A' ' 30' ' ' LEU . 0.8 OUTLIER -145.07 161.29 39.81 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.65 1.18 . . . . 0.0 108.122 -179.393 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.553 ' HA ' HD22 ' A' ' 30' ' ' LEU . . . -166.9 159.49 13.54 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 120.669 1.577 . . . . 0.0 112.887 -168.957 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -60.7 137.11 58.22 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 165.668 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.32 -23.38 66.73 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.785 1.402 . . . . 0.0 114.785 -173.8 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -159.23 161.72 36.09 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.267 1.027 . . . . 0.0 113.17 168.722 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 54.6 p -42.91 -35.33 1.17 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.572 1.949 . . . . 0.0 112.76 166.877 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -48.81 77.68 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.581 1.552 . . . . 0.0 112.764 177.661 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.7 mt -69.65 -47.24 64.03 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.75 1.159 . . . . 0.0 109.003 179.226 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.03 -16.82 3.12 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.853 1.661 . . . . 0.0 114.552 172.437 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -79.23 -67.05 0.79 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.821 1.248 . . . . 0.0 109.996 176.373 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.72 -32.49 72.72 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 178.941 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 tp -68.17 -32.61 72.98 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.766 1.627 . . . . 0.0 111.441 169.662 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.17 -36.52 9.87 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 127.273 2.368 . . . . 0.0 115.632 -172.02 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.83 -9.76 58.86 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 119.75 1.775 . . . . 0.0 112.853 169.17 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.2 tt 67.87 142.31 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 127.002 2.121 . . . . 0.0 108.031 -170.906 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 33.9 m -69.71 19.41 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 O-C-N 120.328 -1.483 . . . . 0.0 114.091 -175.107 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 47.3 mm-40 77.08 -13.88 0.9 Allowed 'General case' 0 N--CA 1.447 -0.598 0 O-C-N 120.685 -1.26 . . . . 0.0 113.707 156.519 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.2 p -68.38 35.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 126.966 2.106 . . . . 0.0 115.605 -177.105 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.3 t 69.07 4.76 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 125.941 1.696 . . . . 0.0 112.529 173.055 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.8 mp 97.34 105.49 0.01 OUTLIER 'General case' 0 C--N 1.348 0.521 0 C-N-CA 131.302 3.841 . . . . 0.0 110.259 -170.447 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.76 66.05 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 126.962 2.105 . . . . 0.0 114.459 176.462 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.1 m -52.49 138.19 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 O-C-N 121.568 -0.707 . . . . 0.0 110.412 168.563 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -59.35 -30.99 68.79 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.396 0.678 . . . . 0.0 112.44 -168.449 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.1 m 70.61 151.46 0.1 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 128.315 2.646 . . . . 0.0 111.633 178.524 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -87.36 1.34 53.6 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.859 1.664 . . . . 0.0 114.151 175.261 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.2 146.91 35.77 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 115.073 1.509 . . . . 0.0 115.073 -166.998 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -94.48 17.96 0.86 Allowed 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 124.029 3.153 . . . . 0.0 114.438 -178.325 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.5 t . . . . . 0 CA--C 1.547 0.85 0 CA-C-O 124.65 2.167 . . . . 0.0 113.893 -177.871 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.538 0.517 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.526 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 12' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' A' ' 19' ' ' ALA . . . -51.51 -45.88 63.03 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.009 0.924 . . . . 0.0 111.533 167.701 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -30.24 67.14 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.226 1.81 . . . . 0.0 111.934 175.442 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -81.39 -46.71 14.24 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.056 -1.027 . . . . 0.0 111.358 172.619 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.59 -32.3 68.82 Favored Glycine 0 C--O 1.219 -0.83 0 C-N-CA 124.493 1.044 . . . . 0.0 111.803 -178.165 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.6 -32.28 72.05 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.001 1.401 . . . . 0.0 111.171 173.739 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -80.63 -20.58 42.84 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 176.189 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.5 mp -101.78 -23.04 14.25 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 118.951 0.796 . . . . 0.0 112.761 175.198 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -83.64 37.76 0.6 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.372 1.469 . . . . 0.0 114.877 178.132 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.94 142.39 24.53 Favored Pre-proline 0 CA--C 1.55 0.947 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 168.181 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -59.0 -85.38 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.785 1 C-N-CA 125.793 4.329 . . . . 0.0 112.676 -167.482 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 58.9 m -49.58 -33.93 16.38 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 126.357 1.863 . . . . 0.0 112.507 170.09 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 23' ' ' ARG . . . . . 0.509 ' HG2' HD13 ' B' ' 58' ' ' LEU . 18.2 ttp180 -72.08 -38.87 69.33 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -170.824 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 37.1 t -56.93 -39.95 75.46 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.249 0.931 . . . . 0.0 110.369 168.709 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 16.1 mtt-85 -64.59 -38.92 92.65 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-O 118.485 -0.769 . . . . 0.0 113.061 175.161 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 26' ' ' ILE . . . . . 0.416 HG13 ' HA ' ' B' ' 23' ' ' ARG . 3.0 mt -52.09 -49.61 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 CA-C-N 120.069 1.304 . . . . 0.0 111.835 169.426 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 92.6 mt -65.4 -47.12 77.4 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.939 -178.242 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.24 -33.85 65.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 118.911 0.778 . . . . 0.0 112.562 178.099 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.1 -9.25 59.07 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.84 1.256 . . . . 0.0 113.419 174.265 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.557 HD21 ' CD2' ' B' ' 75' ' ' TYR . 5.6 mt -82.9 -37.96 23.52 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 117.361 -1.304 . . . . 0.0 112.353 167.079 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.2 mt -55.82 -46.22 78.14 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 125.195 1.56 . . . . 0.0 110.754 175.498 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -107.03 46.41 0.93 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 129.037 2.935 . . . . 0.0 110.453 177.762 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -150.9 -84.29 0.05 OUTLIER Glycine 0 N--CA 1.47 0.952 0 N-CA-C 116.996 1.559 . . . . 0.0 116.996 -176.261 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 34.9 m 49.57 -12.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 C-N-CA 129.175 2.99 . . . . 0.0 118.849 -168.348 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 51.9 m -37.01 -82.23 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 127.016 2.126 . . . . 0.0 116.368 -167.368 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 36' ' ' TYR . . . . . 0.459 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 7.3 m-85 -149.64 143.88 17.23 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 126.364 1.865 . . . . 0.0 109.809 -174.656 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -65.7 -7.18 15.69 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 124.07 3.18 . . . . 0.0 116.88 -168.686 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.9 -14.3 21.42 Favored Glycine 0 CA--C 1.536 1.366 0 CA-C-N 120.078 1.308 . . . . 0.0 115.161 171.053 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 39' ' ' GLN . . . . . 0.459 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 0.9 OUTLIER -69.92 -19.85 63.38 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.146 1.535 . . . . 0.0 115.146 -169.072 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 20.7 mt -44.51 -32.28 1.36 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.019 1.328 . . . . 0.0 112.333 175.928 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.16 -40.41 77.2 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -178.078 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.72 -43.38 37.68 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.141 0.496 . . . . 0.0 110.92 174.747 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -64.78 -24.09 67.45 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.79 1.236 . . . . 0.0 113.792 -177.011 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 20.4 mt -109.39 -18.12 13.63 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.224 1.809 . . . . 0.0 113.799 179.043 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.48 -9.59 54.35 Favored Glycine 0 CA--C 1.536 1.346 0 CA-C-O 118.383 -1.232 . . . . 0.0 114.487 -169.941 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.04 131.94 45.11 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.889 2.076 . . . . 0.0 111.786 177.541 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 6.1 t -59.81 140.49 56.53 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 119.985 -1.697 . . . . 0.0 109.242 168.935 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 48' ' ' ARG . . . . . 0.44 ' HD3' ' H ' ' B' ' 48' ' ' ARG . 0.0 OUTLIER -59.58 -21.0 59.7 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -174.497 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 5.7 m -64.44 -48.55 74.9 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.946 1.248 . . . . 0.0 111.272 169.488 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -70.46 -38.9 74.53 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.538 -0.726 . . . . 0.0 111.23 176.248 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -62.15 -35.87 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 O-C-N 120.877 -1.139 . . . . 0.0 111.978 172.352 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 96.2 p -67.91 -30.22 69.49 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 120.038 1.29 . . . . 0.0 114.404 175.661 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 55.5 t-20 -60.3 -59.87 4.72 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.678 0.791 . . . . 0.0 110.589 178.94 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -67.94 -19.37 64.97 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 176.511 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 40.0 mt -73.78 -29.24 62.08 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 121.377 1.899 . . . . 0.0 112.493 169.493 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 45.4 m -61.88 -29.18 70.02 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.429 0.559 . . . . 0.0 111.807 175.942 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.4 t -80.37 -50.72 9.76 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 118.881 0.764 . . . . 0.0 111.388 169.163 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 58' ' ' LEU . . . . . 0.509 HD13 ' HG2' ' B' ' 23' ' ' ARG . 6.7 tp -58.12 -41.05 82.8 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.099 0.96 . . . . 0.0 113.016 -172.642 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.498 ' HG2' HG23 ' B' ' 64' ' ' VAL . 82.8 mtt180 -82.34 -6.42 59.25 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.545 1.538 . . . . 0.0 113.167 179.353 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -97.74 -43.96 2.78 Favored Glycine 0 N--CA 1.472 1.04 0 C-N-CA 124.758 1.171 . . . . 0.0 111.666 172.086 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 80.8 m -75.87 9.03 2.6 Favored 'General case' 0 CA--C 1.557 1.212 0 C-N-CA 127.463 2.305 . . . . 0.0 113.849 177.329 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.19 11.34 81.9 Favored Glycine 0 N--CA 1.471 1.022 0 C-N-CA 128.242 2.829 . . . . 0.0 117.216 167.493 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 95.5 mt -80.82 -21.88 40.47 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 118.799 1.3 . . . . 0.0 114.105 -173.846 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.498 HG23 ' HG2' ' B' ' 59' ' ' ARG . 5.2 m -137.63 149.51 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 125.303 1.441 . . . . 0.0 113.915 -174.601 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 77.3 t -145.01 147.17 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -176.996 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.72 147.98 28.96 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 127.737 2.415 . . . . 0.0 112.065 169.8 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -136.78 170.61 15.8 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.379 1.872 . . . . 0.0 107.395 175.658 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 68' ' ' TYR . . . . . 0.416 ' HA ' ' HA ' ' B' ' 73' ' ' VAL . 0.4 OUTLIER -81.41 133.0 35.35 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 162.929 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.52 -9.1 58.64 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 119.279 0.945 . . . . 0.0 112.842 167.985 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 126.29 -15.55 6.81 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 126.224 1.869 . . . . 0.0 113.754 173.452 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.48 -40.57 0.51 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.042 2.137 . . . . 0.0 110.616 -172.887 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -127.64 177.45 6.78 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 128.468 2.707 . . . . 0.0 108.063 167.738 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 73' ' ' VAL . . . . . 0.416 ' HA ' ' HA ' ' B' ' 68' ' ' TYR . 2.3 m -86.48 143.55 11.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 123.152 0.581 . . . . 0.0 109.609 165.731 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 12.3 ptt180 -106.17 -176.44 3.08 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 127.127 2.171 . . . . 0.0 108.64 172.202 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.557 ' CD2' HD21 ' B' ' 30' ' ' LEU 0.254 0.2 OUTLIER -143.76 171.54 14.07 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 124.709 1.204 . . . . 0.0 109.696 171.618 . . . . . . . . 4 4 . 1 . 030 nuclear build core ' B' B ' 76' ' ' ALA . . . . . 0.513 ' HA ' HD22 ' B' ' 30' ' ' LEU . . . -174.27 159.36 3.12 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.622 1.569 . . . . 0.0 111.687 -169.38 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -60.51 142.22 55.54 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 164.864 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.43 -23.26 65.7 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -174.841 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -157.56 159.36 37.04 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 168.366 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 56.6 p -44.25 -34.93 2.06 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 113.683 -1.598 . . . . 0.0 112.002 165.295 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.93 -45.65 93.85 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.582 1.553 . . . . 0.0 111.915 -179.489 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 9.0 mt -69.06 -45.64 69.88 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.447 1.021 . . . . 0.0 109.53 174.684 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.63 -20.73 50.22 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.965 1.306 . . . . 0.0 113.797 178.008 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -75.11 -66.52 0.75 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.591 1.556 . . . . 0.0 110.404 177.518 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.33 -36.26 79.65 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.022 0.828 . . . . 0.0 113.208 178.632 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 49.8 tp -61.89 -38.07 86.97 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.724 1.21 . . . . 0.0 111.13 169.494 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -78.97 -42.69 11.98 Favored Glycine 0 C--N 1.341 0.815 0 C-N-CA 127.509 2.481 . . . . 0.0 114.968 -171.754 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.22 -12.02 60.98 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.142 1.471 . . . . 0.0 112.484 168.843 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 89' ' ' LEU . . . . . 0.416 HD23 ' H ' ' B' ' 91' ' ' GLN . 9.7 tt 72.22 142.41 0.06 Allowed 'General case' 0 C--N 1.342 0.279 0 C-N-CA 127.554 2.341 . . . . 0.0 108.849 175.539 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 33.7 m -60.4 12.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 116.819 2.155 . . . . 0.0 116.819 -173.489 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 91' ' ' GLN . . . . . 0.416 ' H ' HD23 ' B' ' 89' ' ' LEU . 26.0 mm-40 78.43 -18.79 0.48 Allowed 'General case' 0 CA--C 1.535 0.367 0 O-C-N 120.347 -1.47 . . . . 0.0 114.281 155.865 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 2.8 p -66.8 32.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 126.795 2.038 . . . . 0.0 115.132 177.517 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 61.77 10.95 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 C-N-CA 125.645 1.578 . . . . 0.0 113.509 -179.686 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 10.1 mp 86.04 115.67 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 131.35 3.86 . . . . 0.0 109.709 -168.58 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.785 0 CA-C-O 121.475 0.655 . . . . 0.0 110.688 167.172 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.44 -6.39 55.17 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -175.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.502 HH11 ' HB2' ' B' ' 102' ' ' CYS . 5.6 mmp_? -90.47 -50.57 5.87 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.704 1.202 . . . . 0.0 108.96 167.031 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -44.01 -71.86 0.07 Allowed 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 127.87 2.468 . . . . 0.0 109.981 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -83.09 -8.19 85.95 Favored Glycine 0 CA--C 1.526 0.744 0 C-N-CA 119.112 -1.518 . . . . 0.0 115.259 -168.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.36 -45.66 53.68 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.482 1.641 . . . . 0.0 108.245 168.381 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.24 -23.4 57.52 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 118.084 -0.96 . . . . 0.0 112.804 174.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 18' ' ' LEU . 4.8 tp -80.71 -34.89 34.21 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.508 1.049 . . . . 0.0 112.249 179.278 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -104.7 71.3 0.97 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 122.256 1.027 . . . . 0.0 110.463 169.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.488 ' CG ' ' HE ' ' A' ' 23' ' ' ARG . 4.0 t70 -132.59 143.17 47.6 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.93 1.292 . . . . 0.0 110.284 171.095 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -41.06 -68.21 0.1 Allowed 'Trans proline' 0 C--N 1.356 0.969 1 C-N-CA 127.012 5.141 . . . . 0.0 113.75 -173.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.23 -32.86 29.53 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 116.896 -1.525 . . . . 0.0 110.801 -175.487 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.488 ' HE ' ' CG ' ' A' ' 20' ' ' ASP . 16.7 mtm180 -67.72 -41.48 83.46 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 116.256 -1.831 . . . . 0.0 113.893 -177.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 38.7 t -55.52 -42.72 74.92 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 121.658 2.026 . . . . 0.0 110.545 170.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.89 -45.18 94.87 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.156 0.982 . . . . 0.0 113.184 175.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.6 mt -53.69 -56.55 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 124.395 1.078 . . . . 0.0 110.366 171.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 90.1 mt -61.66 -40.76 96.07 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.835 0.854 . . . . 0.0 111.713 -169.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.6 p -73.99 -30.3 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 175.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.21 -23.89 47.29 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.053 0.941 . . . . 0.0 113.522 174.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.438 ' O ' HG13 ' A' ' 34' ' ' VAL . 4.4 tp -63.35 -44.26 95.34 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 121.09 -1.006 . . . . 0.0 110.987 173.306 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -47.86 -49.06 30.64 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 128.396 2.678 . . . . 0.0 112.226 177.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -93.6 14.6 18.42 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 127.444 2.298 . . . . 0.0 112.619 -179.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -134.95 -85.82 0.22 Allowed Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.568 1.556 . . . . 0.0 114.442 -175.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.556 HG12 ' HA ' ' A' ' 76' ' ' ALA . 27.8 m 41.38 30.28 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 126.771 2.029 . . . . 0.0 115.388 -168.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 2.3 m -80.39 -86.53 0.08 Allowed 'General case' 0 C--O 1.224 -0.266 0 O-C-N 121.822 -0.549 . . . . 0.0 110.654 -178.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -135.43 161.97 60.09 Favored Pre-proline 0 CA--C 1.538 0.5 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -169.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -54.07 124.15 15.24 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.377 2.718 . . . . 0.0 110.476 174.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.37 3.3 88.58 Favored Glycine 0 CA--C 1.528 0.882 0 CA-C-O 117.25 -1.861 . . . . 0.0 114.815 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.49 -30.58 70.7 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 121.012 2.406 . . . . 0.0 111.276 169.138 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.5 mt -53.7 -20.13 5.02 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 124.984 1.314 . . . . 0.0 112.674 172.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.29 -34.78 75.77 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.825 0.739 . . . . 0.0 111.319 176.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.43 -45.64 53.26 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.065 0.546 . . . . 0.0 111.159 175.031 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -60.17 -32.41 71.04 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 177.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 35.7 mt -103.3 -20.16 14.21 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -174.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.71 7.07 68.55 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.027 0.823 . . . . 0.0 113.905 -169.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.6 mt -108.69 150.48 27.5 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.945 1.298 . . . . 0.0 110.959 -174.481 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.0 p -60.87 145.74 49.03 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.315 0.578 . . . . 0.0 111.667 -169.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 40.5 ptt180 -59.54 -32.88 70.73 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 -177.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.4 m -64.6 -54.82 26.01 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.553 0.741 . . . . 0.0 111.29 169.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 55.9 t-20 -55.75 -54.1 48.58 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.794 1.238 . . . . 0.0 111.177 -178.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 97.4 t -58.38 -40.11 76.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 O-C-N 121.457 -0.777 . . . . 0.0 111.8 176.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 47.2 m -71.4 -28.65 64.16 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 114.217 1.191 . . . . 0.0 114.217 -177.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -49.27 -46.91 46.93 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.004 1.322 . . . . 0.0 111.59 173.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 3.9 m80 -65.28 -27.05 68.36 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 60.3 mt -67.52 -31.03 70.86 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 118.833 0.742 . . . . 0.0 111.118 176.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 68.7 m -62.94 -8.07 6.45 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 174.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.434 ' CB ' HH11 ' A' ' 23' ' ' ARG . 43.2 t -99.16 -46.76 5.45 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 118.942 0.792 . . . . 0.0 111.514 164.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.4 tp -58.26 -36.08 72.71 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.178 2.591 . . . . 0.0 113.515 -168.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 80.2 mtm-85 -68.18 -41.71 81.04 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.626 0.771 . . . . 0.0 110.867 175.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -73.19 -36.66 55.89 Favored Glycine 0 N--CA 1.472 1.05 0 C-N-CA 124.094 0.854 . . . . 0.0 111.498 -177.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 27.4 m -67.26 -2.89 6.58 Favored 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 125.889 1.676 . . . . 0.0 113.398 168.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.22 -4.92 65.02 Favored Glycine 0 N--CA 1.47 0.929 0 C-N-CA 127.06 2.267 . . . . 0.0 114.829 174.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 73.5 mt -73.88 -20.71 60.33 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -169.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.6 m -134.21 144.99 33.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 C-N-CA 125.194 1.398 . . . . 0.0 111.941 177.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.4 t -127.23 138.43 54.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 125.161 1.384 . . . . 0.0 109.72 176.257 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.51 136.08 33.29 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.822 0.849 . . . . 0.0 111.003 173.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.98 179.79 5.38 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.938 2.095 . . . . 0.0 108.133 -175.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -119.26 147.83 43.82 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.945 1.698 . . . . 0.0 108.371 165.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.27 1.3 pp20? -119.66 -148.93 0.42 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.694 1.198 . . . . 0.0 111.578 176.154 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -70.38 -18.36 75.16 Favored Glycine 0 CA--C 1.535 1.341 0 CA-C-N 121.52 1.964 . . . . 0.0 115.251 -175.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.5 mmt180 -148.68 -17.82 0.32 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.538 1.681 . . . . 0.0 115.538 -177.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.55 -179.83 7.15 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 122.221 2.282 . . . . 0.0 112.335 -178.169 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 29.7 m -84.31 149.17 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.403 1.081 . . . . 0.0 111.253 172.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.1 ptt180 -126.67 170.93 11.6 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.782 1.233 . . . . 0.0 110.299 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -127.3 125.28 40.57 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.743 1.217 . . . . 0.0 109.611 169.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.556 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -128.73 153.81 46.99 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.547 1.539 . . . . 0.0 111.638 -177.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 82.8 mt -58.4 151.69 19.38 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 122.83 0.452 . . . . 0.0 109.858 170.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -49.03 -41.87 36.32 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.006 1.322 . . . . 0.0 114.031 -172.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -170.57 166.43 8.22 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 127.412 2.285 . . . . 0.0 109.135 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.1 m -36.24 -37.98 0.13 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 129.687 3.195 . . . . 0.0 112.297 165.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -44.19 -60.1 2.05 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 127.343 2.257 . . . . 0.0 113.394 171.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 13.4 mt -76.51 -34.98 58.58 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.255 0.934 . . . . 0.0 110.607 -177.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.17 -32.38 72.12 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 118.826 0.739 . . . . 0.0 112.733 176.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -77.47 -59.54 2.74 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.0 0.92 . . . . 0.0 110.941 176.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.85 -34.56 76.19 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tt -66.51 -46.44 76.23 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.238 -0.914 . . . . 0.0 108.858 168.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.02 -11.0 69.53 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 127.165 2.317 . . . . 0.0 117.078 -176.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -71.08 -40.03 71.81 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-N 121.728 2.764 . . . . 0.0 108.079 165.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 46.4 tp 90.91 112.62 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 131.628 3.971 . . . . 0.0 106.827 -167.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.5 m -39.31 -3.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 130.404 3.482 . . . . 0.0 117.925 169.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 78.57 -28.79 0.15 Allowed 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 128.696 2.798 . . . . 0.0 112.814 164.098 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 8.0 p -59.18 35.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 C-N-CA 129.484 3.114 . . . . 0.0 115.697 173.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.0 t 73.84 5.06 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.891 0 C-N-CA 128.436 2.694 . . . . 0.0 112.025 169.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 85.1 104.52 0.05 OUTLIER 'General case' 0 C--N 1.346 0.439 0 C-N-CA 130.578 3.551 . . . . 0.0 106.226 -169.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.99 122.37 14.14 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.644 -0.66 . . . . 0.0 110.947 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.4 t -129.86 157.5 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 126.699 2.0 . . . . 0.0 106.688 168.13 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -54.52 123.6 13.58 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.724 0.809 . . . . 0.0 110.455 168.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -151.11 145.26 25.34 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.601 1.56 . . . . 0.0 108.728 -169.541 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -85.91 67.2 9.94 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.303 1.441 . . . . 0.0 110.529 -171.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -120.8 136.69 25.67 Favored Pre-proline 0 CA--C 1.551 1.012 0 O-C-N 121.195 -0.94 . . . . 0.0 111.171 176.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -85.63 -166.59 0.34 Allowed 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 124.755 3.637 . . . . 0.0 114.877 -166.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 8.6 t -126.68 -176.79 3.79 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 126.32 1.848 . . . . 0.0 112.307 173.3 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 13.6 t 69.42 127.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 128.814 2.846 . . . . 0.0 112.374 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.22 147.28 53.56 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.075 1.35 . . . . 0.0 112.67 176.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 59.43 19.76 8.1 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 124.263 1.025 . . . . 0.0 113.66 177.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.471 0.596 0 C-N-CA 125.47 1.508 . . . . 0.0 112.325 -169.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.423 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.0 tt -44.69 -52.25 8.46 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.612 1.565 . . . . 0.0 113.006 -176.206 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.14 1.5 18.06 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.219 1.562 . . . . 0.0 115.219 -177.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -107.08 -54.02 2.53 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.795 2.038 . . . . 0.0 110.138 168.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -43.3 -56.67 3.39 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 127.513 2.325 . . . . 0.0 110.41 174.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.66 -35.08 62.58 Favored Glycine 0 C--N 1.339 0.706 0 C-N-CA 120.357 -0.925 . . . . 0.0 113.64 -172.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.31 -38.01 71.75 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.363 1.082 . . . . 0.0 109.912 -179.04 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.51 -32.53 58.35 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 117.192 -1.385 . . . . 0.0 113.221 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.8 mp -81.14 -37.07 29.43 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 120.886 1.676 . . . . 0.0 112.435 178.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -90.95 70.55 6.42 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.532 1.06 . . . . 0.0 111.858 173.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -146.06 141.29 16.41 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 125.702 1.601 . . . . 0.0 110.49 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -45.43 -62.56 0.43 Allowed 'Trans proline' 0 C--N 1.357 0.979 1 C-N-CA 126.574 4.849 . . . . 0.0 113.053 -173.436 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 1.2 p -84.01 -38.83 20.41 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-O 116.813 -1.565 . . . . 0.0 110.714 -175.06 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 25.1 mtm180 -67.51 -36.35 80.87 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 121.195 1.816 . . . . 0.0 114.02 -175.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 43.5 t -56.34 -47.44 78.81 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 121.073 1.761 . . . . 0.0 109.784 169.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.1 -36.31 81.34 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.054 1.341 . . . . 0.0 113.249 177.264 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 3.2 mt -60.41 -61.93 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.109 0.964 . . . . 0.0 109.565 171.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 90.8 mt -56.95 -43.58 81.69 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 124.318 1.012 . . . . 0.0 111.168 -169.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 6.3 p -69.51 -31.52 49.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.34 -16.65 48.49 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.163 0.892 . . . . 0.0 113.27 175.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 3.5 tp -71.8 -37.72 70.35 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.223 -0.923 . . . . 0.0 112.288 172.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -45.8 -47.97 15.65 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.254 2.222 . . . . 0.0 111.65 170.371 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -100.17 22.39 11.49 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 127.23 2.212 . . . . 0.0 112.704 176.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -128.81 -95.1 0.8 Allowed Glycine 0 N--CA 1.476 1.305 0 C-N-CA 126.0 1.762 . . . . 0.0 114.67 -173.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 34' ' ' VAL . . . . . 0.612 HG12 ' HA ' ' B' ' 76' ' ' ALA . 32.9 m 39.16 35.39 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 128.095 2.558 . . . . 0.0 116.64 -169.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 88.9 m -82.18 -106.8 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 122.91 0.484 . . . . 0.0 111.07 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -125.54 165.57 25.88 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 -169.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -55.47 124.25 15.82 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 122.557 2.171 . . . . 0.0 110.684 177.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.15 -1.34 88.85 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 117.82 -1.545 . . . . 0.0 115.267 -175.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -26.09 64.55 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 121.054 2.427 . . . . 0.0 113.663 177.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 10.3 mt -64.94 -18.61 65.39 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 123.752 0.821 . . . . 0.0 111.735 177.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.7 -36.98 72.7 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.86 0.754 . . . . 0.0 112.188 174.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.82 -41.43 68.21 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.838 0.745 . . . . 0.0 111.234 174.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -64.26 -33.21 75.3 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 177.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 38.5 mt -104.7 -21.15 13.43 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -172.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.29 -1.48 42.16 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 124.959 1.266 . . . . 0.0 113.944 -169.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 86.8 mt -93.73 153.25 18.43 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.28 1.432 . . . . 0.0 110.552 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 29.9 p -63.75 150.65 44.07 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 121.214 -0.929 . . . . 0.0 111.924 -169.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 40.9 ptt180 -59.43 -24.77 63.78 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 175.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 4.4 m -68.51 -59.8 2.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.52 1.528 . . . . 0.0 110.463 168.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -48.51 -56.76 7.44 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.359 1.864 . . . . 0.0 111.363 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 24.5 t -67.07 -35.31 74.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 O-C-N 121.085 -1.009 . . . . 0.0 112.732 -174.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 52.8 m -68.74 -28.83 67.17 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 34.5 t-20 -51.14 -51.41 53.85 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.855 1.262 . . . . 0.0 111.222 172.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -68.07 -28.43 67.35 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.963 -1.086 . . . . 0.0 113.086 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 92.9 mt -65.04 -30.21 71.17 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.646 -0.659 . . . . 0.0 111.236 173.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 66.3 m -67.63 -7.13 24.04 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 53.3 t -95.71 -44.18 7.56 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.672 0.789 . . . . 0.0 110.544 164.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 7.7 tp -64.14 -37.83 88.85 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 127.621 2.368 . . . . 0.0 113.179 -168.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 75.9 mtm-85 -70.93 -22.43 62.24 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.13 0.572 . . . . 0.0 112.001 174.169 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -86.55 -37.95 8.5 Favored Glycine 0 N--CA 1.473 1.164 0 C-N-CA 124.86 1.219 . . . . 0.0 111.423 178.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 48.2 m -68.26 -4.21 13.44 Favored 'General case' 0 CA--C 1.56 1.348 0 C-N-CA 125.906 1.683 . . . . 0.0 112.032 168.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.23 -22.75 6.77 Favored Glycine 0 N--CA 1.47 0.955 0 C-N-CA 128.479 2.942 . . . . 0.0 114.868 177.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 89.8 mt -52.59 -22.16 4.68 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 129.285 3.034 . . . . 0.0 116.235 -168.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.95 138.42 54.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 125.02 1.328 . . . . 0.0 109.648 172.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 41.4 t -114.27 122.56 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 125.073 1.349 . . . . 0.0 108.812 178.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -88.41 119.29 28.71 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.609 1.164 . . . . 0.0 109.7 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.446 ' HB ' ' HG2' ' B' ' 74' ' ' ARG . 0.2 OUTLIER -123.7 -177.17 3.66 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 127.059 2.144 . . . . 0.0 109.711 -167.686 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -123.08 142.59 50.71 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.699 2.0 . . . . 0.0 108.784 166.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -113.25 -149.37 0.45 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.442 1.497 . . . . 0.0 111.813 176.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -71.21 -19.92 77.71 Favored Glycine 0 CA--C 1.535 1.342 0 O-C-N 119.801 -1.812 . . . . 0.0 114.81 -173.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 36.8 mmt180 -144.81 -18.6 0.52 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.547 1.539 . . . . 0.0 115.087 -177.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.47 -179.17 7.0 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 121.704 2.047 . . . . 0.0 113.174 -175.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 18.6 m -87.25 150.94 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 124.553 1.141 . . . . 0.0 111.345 177.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 74' ' ' ARG . . . . . 0.446 ' HG2' ' HB ' ' B' ' 67' ' ' THR . 15.1 ptt180 -135.85 169.75 17.08 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.995 0.918 . . . . 0.0 110.761 -174.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 40.0 m-85 -123.64 113.89 19.27 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 168.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.612 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -109.29 156.06 20.41 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.727 1.211 . . . . 0.0 111.161 177.085 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 82.8 mt -59.17 150.02 26.56 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.754 0.707 . . . . 0.0 109.499 169.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -51.57 -35.55 41.64 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.393 1.077 . . . . 0.0 113.818 -171.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -173.31 168.69 4.61 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.882 2.473 . . . . 0.0 109.176 175.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -34.07 -35.6 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 129.655 3.182 . . . . 0.0 112.307 164.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -37.64 -67.41 0.19 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 127.703 2.401 . . . . 0.0 113.518 169.235 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 16.6 mt -77.24 -35.61 55.26 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 118.975 -0.536 . . . . 0.0 109.766 -174.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.92 -30.79 66.2 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.8 -60.05 2.3 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.362 -0.836 . . . . 0.0 111.112 175.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.91 -29.17 70.03 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -176.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.63 -32.21 47.3 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 120.78 -1.2 . . . . 0.0 111.433 169.744 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.27 -18.76 79.86 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 126.525 2.012 . . . . 0.0 115.367 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.58 -32.73 64.28 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 120.688 2.244 . . . . 0.0 108.99 165.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 39.7 tp 77.28 127.09 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 130.652 3.581 . . . . 0.0 108.388 -169.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 90' ' ' VAL . . . . . 0.424 HG23 HG12 ' B' ' 92' ' ' VAL . 12.8 m -44.03 -7.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 127.993 2.517 . . . . 0.0 116.734 169.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 73.63 -21.1 0.27 Allowed 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 127.215 2.206 . . . . 0.0 114.054 165.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.424 HG12 HG23 ' B' ' 90' ' ' VAL . 5.9 p -60.48 41.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 129.881 3.272 . . . . 0.0 114.792 171.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER 67.64 -0.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 C-N-CA 128.708 2.803 . . . . 0.0 113.633 177.461 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.0 tt 89.49 105.7 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 130.394 3.478 . . . . 0.0 105.431 -168.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.23 118.03 5.44 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 122.794 0.438 . . . . 0.0 111.063 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 1.9 t -119.74 158.38 21.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 125.499 1.519 . . . . 0.0 108.525 169.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -56.9 138.54 53.64 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 166.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.83 150.27 13.42 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.178 -0.951 . . . . 0.0 109.029 -174.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -84.84 74.28 10.51 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.583 0.753 . . . . 0.0 110.498 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -119.09 142.33 31.93 Favored Pre-proline 0 CA--C 1.542 0.667 0 O-C-N 121.668 -0.645 . . . . 0.0 110.426 169.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -81.97 -171.07 1.09 Allowed 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 124.478 3.452 . . . . 0.0 112.959 -168.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 102' ' ' CYS . . . . . 0.502 ' HB2' HH11 ' A' ' 13' ' ' ARG . 8.5 t -127.83 177.26 6.95 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.824 1.25 . . . . 0.0 111.096 168.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 6.5 t 66.82 133.44 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 127.976 2.51 . . . . 0.0 110.758 -170.026 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.85 154.07 23.02 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.703 1.601 . . . . 0.0 112.351 172.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 54.0 22.76 3.59 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 125.081 1.352 . . . . 0.0 113.75 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.47 0.553 0 O-C-N 120.475 -1.391 . . . . 0.0 111.816 -173.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.467 ' HB2' ' HB2' ' B' ' 100' ' ' GLN . . . . . . . . 0 N--CA 1.464 0.27 0 CA-C-O 121.263 0.554 . . . . 0.0 110.035 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -67.23 -21.62 65.73 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.327 -0.858 . . . . 0.0 113.144 -168.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.47 -39.76 80.82 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 118.818 0.735 . . . . 0.0 111.734 167.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.2 mtp180 -60.02 -32.13 70.6 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 121.029 -1.044 . . . . 0.0 112.317 174.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.39 -43.6 98.43 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.281 1.032 . . . . 0.0 111.578 177.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -74.53 -33.98 54.98 Favored Glycine 0 N--CA 1.474 1.179 0 CA-C-N 118.59 0.632 . . . . 0.0 112.695 176.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 16.3 mtp180 -55.24 -49.66 71.44 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.304 1.042 . . . . 0.0 109.721 170.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.76 -28.39 63.61 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 mp -85.92 -20.28 29.24 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.252 0.933 . . . . 0.0 113.325 -177.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -96.88 16.92 17.97 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.28 165.17 9.27 Favored Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 125.931 1.692 . . . . 0.0 112.05 168.574 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -69.34 -115.57 0.0 OUTLIER 'Trans proline' 0 CA--C 1.554 1.502 1 C-N-CA 126.314 4.676 . . . . 0.0 111.519 172.021 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -37.5 -35.7 0.14 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 128.626 2.771 . . . . 0.0 115.245 169.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.536 HH12 ' CB ' ' A' ' 57' ' ' CYS . 6.4 ttm-85 -64.12 -38.45 91.12 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 120.008 1.277 . . . . 0.0 112.974 178.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.9 t -58.35 -43.61 88.43 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.501 1.046 . . . . 0.0 109.855 174.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -38.05 89.69 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 173.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 6.2 mm -57.95 -47.83 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 125.433 1.493 . . . . 0.0 111.337 171.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.3 mt -65.49 -43.61 89.63 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.52 -0.738 . . . . 0.0 112.075 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.4 p -71.81 -24.17 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 CA-C-N 119.076 0.853 . . . . 0.0 112.243 175.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.0 -38.03 79.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.439 0.696 . . . . 0.0 111.214 171.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.492 HD23 ' HA ' ' A' ' 30' ' ' LEU . 25.4 mt -71.99 -33.5 68.16 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -178.541 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -39.55 -50.96 2.23 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.322 2.249 . . . . 0.0 112.94 170.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -97.7 -20.36 17.65 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.575 1.15 . . . . 0.0 113.107 173.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.95 15.93 54.84 Favored Glycine 0 N--CA 1.469 0.897 0 C-N-CA 126.661 2.077 . . . . 0.0 116.552 -165.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 1.8 m -50.47 74.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 127.251 2.22 . . . . 0.0 115.575 171.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 9.0 t -144.44 -54.22 0.33 Allowed 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.474 1.657 . . . . 0.0 115.474 -174.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 12.3 p90 -158.24 157.08 28.83 Favored Pre-proline 0 N--CA 1.481 1.1 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 177.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -53.94 127.89 27.46 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.943 2.429 . . . . 0.0 108.737 168.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.93 -3.08 62.26 Favored Glycine 0 CA--C 1.53 1.021 0 CA-C-O 117.484 -1.731 . . . . 0.0 115.006 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.87 -34.38 62.92 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 120.595 2.198 . . . . 0.0 110.902 169.824 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.695 HD12 ' H ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -62.16 -17.79 59.0 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 127.147 2.179 . . . . 0.0 112.204 -178.441 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.07 -43.99 97.06 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.028 0.531 . . . . 0.0 111.002 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.05 -38.69 75.88 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.806 -0.559 . . . . 0.0 111.957 173.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 9.6 t-160 -73.49 -15.6 61.31 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 -177.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 30.0 mt -110.53 -24.84 10.33 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.435 1.494 . . . . 0.0 113.842 174.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.56 6.89 88.85 Favored Glycine 0 CA--C 1.533 1.197 0 CA-C-N 119.554 1.07 . . . . 0.0 112.514 -168.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.8 mt -110.93 148.94 31.4 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.355 1.062 . . . . 0.0 111.693 -170.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.48 HG23 ' H ' ' A' ' 50' ' ' ASN . 3.4 t -58.31 149.71 23.8 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.795 0.838 . . . . 0.0 112.839 -172.057 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.7 mtm-85 -48.43 -37.14 16.37 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.977 1.711 . . . . 0.0 111.632 172.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.6 m -60.79 -60.01 4.48 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.281 1.032 . . . . 0.0 111.376 175.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.48 ' H ' HG23 ' A' ' 47' ' ' THR . 7.9 m-20 -67.97 -34.37 76.43 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.603 -0.685 . . . . 0.0 111.011 -175.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.9 t -57.21 -52.78 52.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 123.448 0.699 . . . . 0.0 111.191 169.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 13.1 p -72.67 -26.79 61.76 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -177.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -49.63 -48.38 49.2 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.355 1.074 . . . . 0.0 111.438 174.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -78.8 -18.21 54.46 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 177.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 56.9 mt -70.72 -21.46 62.54 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 120.995 1.725 . . . . 0.0 112.042 172.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.0 t -63.21 -53.29 55.43 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.534 1.061 . . . . 0.0 110.908 176.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.536 ' CB ' HH12 ' A' ' 23' ' ' ARG . 48.9 t -78.94 12.81 1.99 Allowed 'General case' 0 CA--C 1.561 1.367 0 C-N-CA 125.557 1.543 . . . . 0.0 112.611 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -106.96 -52.22 2.8 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 126.821 2.048 . . . . 0.0 111.216 175.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 44.7 mtm105 -81.78 -25.76 34.99 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.692 0.797 . . . . 0.0 112.422 -170.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.503 ' HA3' ' HB2' ' B' ' 104' ' ' ALA . . . -92.64 -31.11 9.01 Favored Glycine 0 N--CA 1.474 1.233 0 C-N-CA 124.034 0.826 . . . . 0.0 113.715 178.073 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 41.5 m -82.39 -5.92 58.94 Favored 'General case' 0 CA--C 1.567 1.618 0 C-N-CA 126.065 1.746 . . . . 0.0 113.596 173.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.75 -3.68 83.25 Favored Glycine 0 N--CA 1.478 1.456 0 C-N-CA 126.831 2.158 . . . . 0.0 116.891 170.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.7 mt -56.62 -22.31 33.19 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.997 1.719 . . . . 0.0 114.195 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.9 m -143.97 149.68 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 C-N-CA 126.689 1.996 . . . . 0.0 111.842 177.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 97.7 t -115.61 143.13 26.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 126.464 1.905 . . . . 0.0 109.276 176.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -99.2 123.25 43.34 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.975 0.91 . . . . 0.0 111.953 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -124.36 162.54 23.62 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.645 1.178 . . . . 0.0 109.348 -178.185 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -91.86 126.55 36.99 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 164.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.258 0.0 OUTLIER -90.85 4.03 52.87 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -179.544 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 109.25 -15.79 32.77 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 125.124 1.345 . . . . 0.0 113.32 175.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.58 -45.08 2.2 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 128.197 2.599 . . . . 0.0 111.602 172.162 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -139.69 169.11 18.33 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.312 2.245 . . . . 0.0 110.917 -168.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 7.1 p -83.24 145.16 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 O-C-N 121.328 -0.857 . . . . 0.0 109.877 167.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.1 ptt180 -134.54 172.91 12.26 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.457 1.103 . . . . 0.0 111.829 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -122.77 124.62 43.75 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.483 1.113 . . . . 0.0 110.651 173.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -123.63 143.18 50.39 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.122 1.369 . . . . 0.0 110.768 -177.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.2 tp -52.14 143.73 13.71 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.589 1.156 . . . . 0.0 111.492 177.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -45.79 -38.87 7.62 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 115.907 1.817 . . . . 0.0 115.907 -173.102 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -176.41 168.32 2.75 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.515 1.926 . . . . 0.0 109.803 -175.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.3 p -41.94 -31.54 0.35 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.852 2.061 . . . . 0.0 112.174 164.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -46.81 -67.04 0.32 Allowed 'General case' 0 C--N 1.345 0.37 0 C-N-CA 127.249 2.22 . . . . 0.0 113.566 169.141 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 13.8 mt -68.09 -34.71 76.91 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 119.527 1.058 . . . . 0.0 109.813 178.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.29 -32.29 73.87 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.819 0.736 . . . . 0.0 112.357 -172.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.2 -58.84 3.03 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.911 0.884 . . . . 0.0 112.31 170.327 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.75 -28.41 69.86 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.958 1.254 . . . . 0.0 113.59 -174.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.99 -33.13 21.17 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.906 0.882 . . . . 0.0 112.611 172.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.05 -31.86 75.83 Favored Glycine 0 CA--C 1.539 1.583 0 C-N-CA 125.064 1.316 . . . . 0.0 113.155 175.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -62.67 -23.36 67.07 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.467 1.907 . . . . 0.0 111.299 166.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 46.2 tp 81.67 128.26 0.05 OUTLIER 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 130.305 3.442 . . . . 0.0 107.047 -174.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 76.3 t -65.06 5.81 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 125.433 1.493 . . . . 0.0 114.544 -169.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.42 ' C ' ' H ' ' A' ' 93' ' ' VAL . 2.5 tp-100 88.07 -26.86 0.07 Allowed 'General case' 0 C--O 1.217 -0.619 0 O-C-N 120.12 -1.612 . . . . 0.0 111.191 132.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.3 p -63.97 35.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 130.327 3.451 . . . . 0.0 112.666 167.244 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.42 ' H ' ' C ' ' A' ' 91' ' ' GLN . 0.2 OUTLIER 59.18 8.36 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 C-N-CA 128.007 2.523 . . . . 0.0 114.047 176.653 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 96.63 111.24 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 131.141 3.776 . . . . 0.0 106.791 -166.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.51 96.57 0.17 Allowed 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.925 -0.485 . . . . 0.0 110.895 175.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.0 t -52.98 147.44 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 167.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.17 34.58 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 129.526 3.13 . . . . 0.0 113.665 -175.131 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.2 p -100.34 129.03 46.28 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 126.153 1.781 . . . . 0.0 111.421 -176.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -127.35 153.83 45.72 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.379 166.266 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -170.63 163.03 5.84 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 126.569 1.948 . . . . 0.0 108.904 -167.032 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -64.76 155.11 69.17 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.187 1.925 . . . . 0.0 110.15 169.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -93.04 -149.4 0.26 Allowed 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 122.179 0.99 . . . . 0.0 113.43 -172.429 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 5.3 t 50.41 52.81 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 125.855 1.662 . . . . 0.0 110.193 175.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.452 ' HB2' ' HA3' ' B' ' 60' ' ' GLY . . . 77.18 -12.89 1.0 Allowed 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 127.024 2.13 . . . . 0.0 116.434 178.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -60.77 167.12 2.92 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.595 1.089 . . . . 0.0 113.249 -177.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.5 mtm180 . . . . . 0 N--CA 1.469 0.503 0 C-N-CA 125.394 1.477 . . . . 0.0 110.974 -169.153 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.545 0 CA-C-O 121.614 0.721 . . . . 0.0 111.108 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -65.93 -21.32 66.43 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -167.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.24 -31.74 72.34 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 120.27 1.396 . . . . 0.0 112.511 168.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -61.43 -32.75 72.73 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.374 -0.829 . . . . 0.0 111.835 173.443 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -50.78 -57.84 7.4 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.85 1.26 . . . . 0.0 109.498 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.3 -34.03 88.84 Favored Glycine 0 CA--C 1.53 1.03 0 O-C-N 121.803 -0.561 . . . . 0.0 112.827 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 17.5 mtp180 -69.6 -11.52 60.9 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.035 1.334 . . . . 0.0 114.16 173.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.53 -8.11 14.67 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.756 1.622 . . . . 0.0 113.763 170.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -96.79 -29.98 13.44 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 119.909 1.231 . . . . 0.0 113.197 175.127 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -88.53 36.42 0.79 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.47 1.108 . . . . 0.0 112.604 173.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' ASP . . . . . 0.554 ' CG ' ' HE ' ' B' ' 23' ' ' ARG . 0.1 OUTLIER -78.6 167.04 38.44 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 128.217 2.607 . . . . 0.0 112.46 172.882 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -69.12 -115.63 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.358 1 C-N-CA 126.686 4.924 . . . . 0.0 111.767 169.36 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -42.17 -33.67 0.64 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 128.314 2.645 . . . . 0.0 114.412 176.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.581 HH12 ' CB ' ' B' ' 57' ' ' CYS . 6.9 ttm-85 -59.92 -32.14 70.49 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 117.957 -1.021 . . . . 0.0 112.91 178.237 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 1.6 m -53.37 -56.64 15.08 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.403 1.002 . . . . 0.0 109.716 169.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -35.57 80.78 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 117.799 -1.096 . . . . 0.0 112.189 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 5.2 mm -53.74 -50.96 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 CA-C-N 120.778 1.626 . . . . 0.0 112.279 170.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 42.6 mt -69.21 -40.84 77.74 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.555 -0.736 . . . . 0.0 112.062 -174.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 12.5 p -74.38 -25.25 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-N 118.995 0.816 . . . . 0.0 112.276 175.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.3 -27.92 68.95 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.1 -1.0 . . . . 0.0 111.996 170.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.506 ' O ' HG13 ' B' ' 34' ' ' VAL . 4.9 mp -67.82 -51.08 52.75 Favored 'General case' 0 C--O 1.226 -0.16 0 CA-C-O 117.176 -1.392 . . . . 0.0 111.598 168.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 4.7 mt -44.48 -46.03 9.5 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.767 1.227 . . . . 0.0 112.022 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -81.07 3.52 23.0 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 126.932 2.093 . . . . 0.0 113.998 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -153.12 -63.31 0.01 OUTLIER Glycine 0 N--CA 1.478 1.452 0 N-CA-C 118.049 1.98 . . . . 0.0 118.049 -167.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 34' ' ' VAL . . . . . 0.506 HG13 ' O ' ' B' ' 30' ' ' LEU . 16.0 m 33.42 40.37 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 127.854 2.462 . . . . 0.0 115.915 -169.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 3.6 t -96.74 -60.84 1.51 Allowed 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 -169.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -158.97 159.22 29.43 Favored Pre-proline 0 N--CA 1.479 1.008 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 -174.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -60.09 124.54 15.46 Favored 'Trans proline' 0 C--N 1.356 0.93 0 C-N-CA 123.112 2.542 . . . . 0.0 110.368 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.28 -4.62 85.3 Favored Glycine 0 CA--C 1.527 0.832 0 CA-C-O 117.423 -1.765 . . . . 0.0 114.331 -175.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -36.05 67.33 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 120.002 1.901 . . . . 0.0 109.776 169.322 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.668 ' H ' HD12 ' B' ' 40' ' ' LEU . 0.3 OUTLIER -60.94 -18.92 59.7 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 125.916 1.686 . . . . 0.0 112.574 179.799 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.99 -58.29 5.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 118.397 0.544 . . . . 0.0 110.222 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.34 -33.08 74.74 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 122.669 0.387 . . . . 0.0 111.286 176.038 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -71.94 -13.28 61.59 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 33.5 mt -117.85 -23.66 7.44 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.969 1.707 . . . . 0.0 113.721 177.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.7 12.04 84.03 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 124.633 1.111 . . . . 0.0 111.808 -167.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 94.8 mt -124.82 132.48 53.33 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 118.599 1.199 . . . . 0.0 112.209 -169.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 8.7 t -48.87 145.96 3.55 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.134 1.774 . . . . 0.0 115.448 -169.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 38.8 mtm-85 -49.68 -34.96 20.01 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.726 2.01 . . . . 0.0 112.508 177.332 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 5.9 m -61.72 -59.33 5.33 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.588 0.755 . . . . 0.0 110.989 174.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -64.59 -37.24 86.87 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.029 0.932 . . . . 0.0 111.534 -178.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.1 t -55.76 -49.93 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 C-N-CA 123.611 0.764 . . . . 0.0 111.177 169.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 15.4 p -76.38 -25.42 54.56 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 -176.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -51.3 -49.14 61.86 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.461 1.104 . . . . 0.0 110.969 170.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 60.3 m-70 -75.79 -22.4 56.42 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 173.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 91.6 mt -67.71 -23.07 65.24 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 121.008 1.731 . . . . 0.0 112.221 171.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.8 t -62.41 -53.55 53.2 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.718 1.144 . . . . 0.0 111.336 178.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 57' ' ' CYS . . . . . 0.581 ' CB ' HH12 ' B' ' 23' ' ' ARG 0.265 42.2 t -82.79 15.47 2.65 Favored 'General case' 0 CA--C 1.559 1.32 0 CA-C-O 122.417 1.104 . . . . 0.0 111.705 -178.991 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.486 ' CD1' ' HD3' ' B' ' 23' ' ' ARG . 1.3 tp -105.28 -51.18 3.07 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 127.638 2.375 . . . . 0.0 111.708 173.019 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 29.9 mtm105 -89.63 -8.33 52.76 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.597 1.159 . . . . 0.0 112.656 -170.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 60' ' ' GLY . . . . . 0.452 ' HA3' ' HB2' ' A' ' 104' ' ' ALA . . . -106.35 -29.84 4.64 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.356 1.455 . . . . 0.0 113.291 172.117 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 97.8 m -87.11 8.99 21.31 Favored 'General case' 0 CA--C 1.563 1.475 0 C-N-CA 126.067 1.747 . . . . 0.0 113.293 171.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.37 -13.84 14.45 Favored Glycine 0 N--CA 1.476 1.334 0 C-N-CA 126.825 2.155 . . . . 0.0 117.017 170.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 91.5 mt -48.79 -26.14 2.22 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.479 1.912 . . . . 0.0 114.88 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 4.0 m -136.99 150.64 26.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 126.186 1.794 . . . . 0.0 111.688 173.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 90.2 t -118.76 148.59 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 126.659 1.984 . . . . 0.0 108.661 170.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.92 135.12 51.92 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.784 1.234 . . . . 0.0 112.406 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.4 p -120.35 -178.49 3.7 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.811 1.244 . . . . 0.0 110.836 176.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -97.63 135.01 40.05 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 104.866 -2.272 . . . . 0.0 104.866 160.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.57 -11.94 23.11 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 115.146 1.535 . . . . 0.0 115.146 177.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 117.55 -34.15 4.65 Favored Glycine 0 N--CA 1.474 1.176 0 C-N-CA 124.85 1.214 . . . . 0.0 112.874 176.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -96.75 -35.39 11.0 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 125.85 1.66 . . . . 0.0 111.454 169.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -155.05 -141.74 0.1 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 128.046 2.538 . . . . 0.0 110.382 -177.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 15.2 m -133.65 152.9 35.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 127.152 2.181 . . . . 0.0 108.583 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 7.2 ptt85 -135.04 173.83 11.28 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.077 0.853 . . . . 0.0 111.751 -173.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -121.71 141.96 50.64 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.531 1.132 . . . . 0.0 109.063 168.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.502 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -142.42 145.06 33.4 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.851 1.261 . . . . 0.0 109.003 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 tp -51.91 147.26 7.24 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.41 1.084 . . . . 0.0 111.05 175.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -49.57 -43.01 45.86 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 115.0 1.481 . . . . 0.0 115.0 -175.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -168.36 163.44 12.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.934 1.694 . . . . 0.0 110.61 -174.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 97.3 p -40.81 -33.92 0.34 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.624 2.37 . . . . 0.0 113.468 167.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -58.98 -54.95 41.38 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.344 1.058 . . . . 0.0 113.817 175.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 20.2 mt -66.37 -31.35 72.07 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.465 1.029 . . . . 0.0 109.746 177.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.22 -32.22 73.72 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 118.512 0.596 . . . . 0.0 109.512 178.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 2.8 mmt85 -71.57 -57.09 4.71 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.709 1.204 . . . . 0.0 111.123 168.191 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.45 -32.56 62.87 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.942 1.246 . . . . 0.0 114.036 -177.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -87.97 -37.47 16.36 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 172.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -81.42 -42.93 8.87 Favored Glycine 0 CA--C 1.539 1.533 0 C-N-CA 124.767 1.175 . . . . 0.0 113.984 -171.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -71.06 -35.88 72.09 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.8 1.24 . . . . 0.0 108.29 166.298 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 21.6 tp 93.76 144.34 0.02 OUTLIER 'General case' 0 C--N 1.342 0.268 0 C-N-CA 130.736 3.614 . . . . 0.0 111.434 168.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 1.5 m -53.2 -14.91 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 126.162 1.785 . . . . 0.0 113.897 171.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 65.42 -13.18 0.13 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 127.026 2.131 . . . . 0.0 114.011 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 1.3 p -58.02 24.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 130.635 3.574 . . . . 0.0 117.423 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.3 t 65.63 13.96 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 126.949 2.1 . . . . 0.0 111.358 171.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 78.75 116.15 0.06 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.604 2.362 . . . . 0.0 108.123 -167.483 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.68 87.72 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 169.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -57.73 147.46 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 C-N-CA 124.992 1.317 . . . . 0.0 110.928 168.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -50.39 58.32 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.061 1 C-N-CA 131.832 4.053 . . . . 0.0 115.021 170.236 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 16.5 p -135.48 123.73 23.13 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 120.764 -1.21 . . . . 0.0 112.224 176.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -126.37 156.75 40.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 114.275 -1.329 . . . . 0.0 108.294 165.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 100' ' ' GLN . . . . . 0.467 ' HB2' ' HB2' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -168.31 164.3 8.23 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 124.585 1.154 . . . . 0.0 109.357 -166.845 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -64.26 156.33 60.28 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 121.602 1.535 . . . . 0.0 109.264 167.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -101.02 -148.81 0.37 Allowed 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 122.189 0.995 . . . . 0.0 112.989 -169.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 4.7 t 51.43 50.54 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 125.533 1.533 . . . . 0.0 110.149 176.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 104' ' ' ALA . . . . . 0.503 ' HB2' ' HA3' ' A' ' 60' ' ' GLY . . . 85.27 -16.93 0.45 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 128.266 2.627 . . . . 0.0 116.225 177.115 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 -61.36 173.57 0.87 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.911 1.285 . . . . 0.0 114.45 -173.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 . . . . . 0 N--CA 1.471 0.606 0 C-N-CA 127.328 2.251 . . . . 0.0 110.483 -169.394 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.827 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.499 ' H ' HD22 ' A' ' 11' ' ' LEU . 2.8 mm? -52.4 -39.59 61.08 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -166.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.46 -36.78 52.55 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.799 1.181 . . . . 0.0 111.722 174.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -62.89 -28.19 69.88 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.136 1.374 . . . . 0.0 112.562 177.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -47.85 -57.54 5.52 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.877 1.671 . . . . 0.0 109.337 168.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -76.85 -14.72 82.29 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-O 119.065 -0.853 . . . . 0.0 113.722 -178.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 76.6 mmt-85 -66.97 -62.59 1.36 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 166.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.13 -38.2 85.55 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.603 1.961 . . . . 0.0 114.905 -173.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.2 mp -79.66 -14.16 58.98 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 119.571 1.078 . . . . 0.0 112.538 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -118.88 24.26 10.95 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.452 1.101 . . . . 0.0 112.064 170.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -90.17 148.66 39.81 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 104.91 -2.255 . . . . 0.0 104.91 165.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -54.56 -99.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 0.979 1 C-N-CA 126.788 4.992 . . . . 0.0 113.777 -166.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.4 p -46.76 -36.88 7.74 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 126.155 1.782 . . . . 0.0 112.157 169.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -65.45 -36.87 85.21 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.179 0.899 . . . . 0.0 111.466 -174.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 52.4 t -67.38 -45.14 77.13 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.157 -0.964 . . . . 0.0 110.65 166.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.91 -43.08 69.41 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 121.743 -0.598 . . . . 0.0 112.535 178.127 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.6 mm -55.58 -50.42 66.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.617 1.567 . . . . 0.0 111.59 171.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 85.4 mt -61.47 -40.71 95.52 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.157 0.889 . . . . 0.0 112.015 -177.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 7.3 p -80.72 -32.6 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.1 -28.19 61.24 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.743 0.817 . . . . 0.0 112.522 173.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.44 ' O ' HG13 ' A' ' 34' ' ' VAL . 17.7 tp -66.33 -39.49 89.27 Favored 'General case' 0 N--CA 1.437 -1.088 0 CA-C-O 116.644 -1.646 . . . . 0.0 111.601 169.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -47.33 -62.43 1.43 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.703 2.001 . . . . 0.0 110.1 175.196 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -83.3 26.24 0.66 Allowed 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.595 1.958 . . . . 0.0 113.04 174.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.25 -87.25 0.31 Allowed Glycine 0 C--N 1.337 0.63 0 C-N-CA 125.783 1.659 . . . . 0.0 112.738 -177.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.521 HG12 ' HA ' ' A' ' 76' ' ' ALA . 30.7 m 39.66 41.3 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 127.455 2.302 . . . . 0.0 114.575 -170.866 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -90.68 -68.16 0.8 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -177.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 24.1 p90 -159.25 157.76 27.74 Favored Pre-proline 0 N--CA 1.475 0.781 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -170.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -56.74 128.85 31.65 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.451 2.1 . . . . 0.0 109.276 171.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.74 -0.61 81.47 Favored Glycine 0 CA--C 1.534 1.226 0 CA-C-O 117.738 -1.59 . . . . 0.0 114.818 -175.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.451 HE21 ' HG ' ' A' ' 40' ' ' LEU . 4.3 pp0? -59.1 -37.89 78.23 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 120.631 2.215 . . . . 0.0 110.898 170.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.451 ' HG ' HE21 ' A' ' 39' ' ' GLN . 1.5 mt -60.84 -17.8 52.0 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.564 1.145 . . . . 0.0 112.126 -179.237 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.33 -31.84 73.1 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 118.698 0.681 . . . . 0.0 111.316 174.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.14 -50.43 19.45 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.429 0.692 . . . . 0.0 111.042 173.214 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 37.1 m170 -57.78 -37.39 73.61 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.7 mt -98.29 -23.22 15.74 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.772 0.829 . . . . 0.0 113.196 -174.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.14 6.49 74.46 Favored Glycine 0 CA--C 1.534 1.273 0 CA-C-N 119.568 1.077 . . . . 0.0 113.919 -170.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.9 mp -96.93 155.44 16.78 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 118.143 0.971 . . . . 0.0 111.442 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.601 HG23 ' H ' ' A' ' 50' ' ' ASN . 1.4 t -58.21 144.7 39.86 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.971 0.508 . . . . 0.0 111.698 -179.287 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 29.9 mtt85 -55.24 -24.24 26.76 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.084 1.354 . . . . 0.0 111.947 171.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.9 m -65.33 -62.92 1.25 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.096 1.358 . . . . 0.0 111.275 170.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.601 ' H ' HG23 ' A' ' 47' ' ' THR . 3.7 m120 -66.12 -36.9 84.36 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.386 -0.821 . . . . 0.0 111.234 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.41 -31.8 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 O-C-N 120.327 -1.483 . . . . 0.0 113.045 169.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.3 m -75.47 -37.33 60.34 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.327 1.421 . . . . 0.0 113.209 171.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -54.58 -49.22 70.91 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.521 0.728 . . . . 0.0 110.154 172.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 16.7 m80 -64.27 -20.91 66.38 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 65.2 mt -88.98 -18.83 26.61 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 117.033 -1.461 . . . . 0.0 114.443 174.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 55.3 m -53.47 -58.0 8.68 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 121.988 2.176 . . . . 0.0 112.114 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 40.5 t -66.01 -45.13 82.64 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 122.853 1.311 . . . . 0.0 110.344 -176.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.84 -41.33 57.69 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 127.916 2.487 . . . . 0.0 113.356 -178.32 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.7 mtm180 -84.33 -21.04 31.11 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -177.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -95.7 -45.08 3.0 Favored Glycine 0 N--CA 1.473 1.145 0 CA-C-N 119.275 0.943 . . . . 0.0 113.879 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 51.7 m -66.04 -13.91 60.77 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 124.987 1.315 . . . . 0.0 111.831 174.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 97.45 14.36 41.53 Favored Glycine 0 C--N 1.346 1.1 0 C-N-CA 127.427 2.442 . . . . 0.0 115.848 167.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.9 mt -71.11 -28.62 64.44 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.772 1.286 . . . . 0.0 113.562 179.255 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 3.5 m -140.81 159.11 23.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 126.007 1.723 . . . . 0.0 111.901 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 2.9 t -140.85 160.59 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 125.487 1.515 . . . . 0.0 110.137 -172.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -86.08 146.45 26.61 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.842 1.257 . . . . 0.0 112.344 169.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -140.73 174.63 10.33 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.715 1.606 . . . . 0.0 107.396 169.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -111.32 127.47 55.65 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.153 0.981 . . . . 0.0 111.948 169.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -80.66 14.75 1.97 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.858 0.863 . . . . 0.0 110.984 165.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 80.52 -56.34 4.7 Favored Glycine 0 C--N 1.343 0.937 0 C-N-CA 126.415 1.959 . . . . 0.0 112.067 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -76.05 -18.73 59.1 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.173 1.789 . . . . 0.0 112.568 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -164.08 167.3 20.45 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.8 2.04 . . . . 0.0 109.763 -173.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 34.3 m -87.04 154.98 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 O-C-N 121.725 -0.609 . . . . 0.0 110.078 167.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.4 ' HD2' ' HB ' ' A' ' 34' ' ' VAL . 20.4 ptt180 -132.67 169.43 16.67 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 125.321 1.448 . . . . 0.0 109.169 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -108.15 162.03 14.44 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 164.147 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.521 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -152.47 151.14 30.4 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.81 1.644 . . . . 0.0 110.214 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.2 tp -64.03 148.08 50.6 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.059 0.944 . . . . 0.0 109.249 169.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -76.75 -8.0 56.45 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 117.641 2.46 . . . . 0.0 117.641 -169.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -179.54 164.38 1.28 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 127.644 2.377 . . . . 0.0 111.883 172.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 26.4 t -47.65 -28.87 2.59 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.235 2.214 . . . . 0.0 112.448 166.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -49.14 -65.07 0.63 Allowed 'General case' 0 C--N 1.341 0.223 0 C-N-CA 125.51 1.524 . . . . 0.0 112.082 169.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.9 mt -68.29 -34.22 75.76 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 118.976 0.807 . . . . 0.0 110.138 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.98 -43.81 91.38 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 119.21 0.914 . . . . 0.0 111.207 -174.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.93 -31.69 40.07 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-O 117.906 -1.045 . . . . 0.0 112.574 179.33 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.94 -42.86 59.94 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 120.457 1.48 . . . . 0.0 112.518 176.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.18 -43.06 74.96 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.364 -0.835 . . . . 0.0 110.102 174.373 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.91 -30.47 65.72 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 125.855 1.693 . . . . 0.0 113.394 -174.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -62.79 -25.61 68.31 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 125.029 1.332 . . . . 0.0 111.499 166.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.499 ' C ' ' H ' ' A' ' 91' ' ' GLN . 27.8 tp 77.55 148.39 0.1 Allowed 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 129.139 2.975 . . . . 0.0 107.877 -167.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 4.3 m -57.1 5.09 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 120.396 -1.44 . . . . 0.0 113.969 165.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.499 ' H ' ' C ' ' A' ' 89' ' ' LEU . 28.7 mm-40 71.9 -43.28 0.56 Allowed 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 130.66 3.584 . . . . 0.0 111.026 -175.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -55.47 103.21 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 125.939 1.696 . . . . 0.0 112.937 -171.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.4 t 61.82 -31.03 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 C-N-CA 130.606 3.562 . . . . 0.0 117.651 168.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 tm? 109.38 93.03 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.509 1 C-N-CA 132.278 4.231 . . . . 0.0 101.858 -163.547 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.492 ' H ' HD11 ' A' ' 89' ' ' LEU . . . -62.61 82.57 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 -169.161 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.7 t -63.11 149.58 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 126.835 2.054 . . . . 0.0 111.889 169.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -59.45 -6.82 1.15 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 128.88 2.872 . . . . 0.0 115.403 175.043 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 17.7 p -75.97 113.38 13.41 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.426 1.091 . . . . 0.0 112.294 -175.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -75.44 69.5 2.22 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.864 1.266 . . . . 0.0 110.353 168.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.94 145.34 72.37 Favored Pre-proline 0 CA--C 1.55 0.949 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.478 173.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -63.83 136.1 51.58 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 123.111 2.54 . . . . 0.0 113.47 -168.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.0 t -70.16 66.36 0.28 Allowed 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 127.347 2.259 . . . . 0.0 111.106 -178.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 9.0 p -34.21 -51.08 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 N-CA-C 117.604 2.446 . . . . 0.0 117.604 -166.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -89.57 133.65 34.5 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 119.631 1.105 . . . . 0.0 111.336 174.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 55.49 35.1 24.42 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.043 1.337 . . . . 0.0 114.15 -172.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? . . . . . 0 CA--C 1.539 0.548 0 C-N-CA 125.257 1.423 . . . . 0.0 114.523 -174.232 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.834 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.535 HD22 ' H ' ' B' ' 11' ' ' LEU . 2.9 mm? -45.35 -41.95 9.48 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.864 2.065 . . . . 0.0 116.011 -167.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.13 -52.38 14.42 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.48 1.036 . . . . 0.0 111.568 173.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -53.85 -35.17 61.2 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.405 1.482 . . . . 0.0 113.188 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.499 ' CD2' HD22 ' B' ' 63' ' ' LEU . 2.5 tm? -50.28 -56.36 11.54 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 127.597 2.359 . . . . 0.0 110.347 169.454 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.62 -19.61 78.0 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-O 118.858 -0.968 . . . . 0.0 113.781 177.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 57.8 mmt-85 -66.75 -49.4 66.07 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.447 1.623 . . . . 0.0 108.624 168.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.96 -37.22 72.78 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.955 1.702 . . . . 0.0 113.971 -178.146 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 7.0 mp -72.52 -14.84 61.74 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.382 0.992 . . . . 0.0 113.156 176.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -121.84 29.45 7.11 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.107 0.963 . . . . 0.0 112.681 170.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -90.87 153.2 45.17 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 165.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -54.8 -94.36 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.781 1 C-N-CA 126.224 4.616 . . . . 0.0 113.38 -168.16 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 16.5 p -51.7 -31.01 24.35 Favored 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 126.492 1.917 . . . . 0.0 112.625 170.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.87 -42.18 77.37 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.553 1.069 . . . . 0.0 111.726 -176.169 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 39.0 t -61.93 -42.72 99.43 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 119.003 0.819 . . . . 0.0 109.988 167.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -46.52 81.82 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 118.21 -0.9 . . . . 0.0 113.116 175.563 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.4 mm -55.81 -51.77 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 CA-C-N 120.487 1.494 . . . . 0.0 110.091 173.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 79.6 mt -59.68 -42.67 93.44 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 118.635 -0.698 . . . . 0.0 112.408 -177.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 7.1 p -80.45 -30.23 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 118.874 0.761 . . . . 0.0 112.731 -178.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.39 -35.95 68.57 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.586 -0.696 . . . . 0.0 112.215 173.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 20.0 tp -61.76 -37.97 86.27 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 117.068 -1.444 . . . . 0.0 112.5 177.037 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -44.24 -53.77 6.32 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 128.365 2.666 . . . . 0.0 112.28 -177.446 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -88.26 -15.47 35.73 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.732 1.613 . . . . 0.0 112.447 179.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.39 -77.54 1.26 Allowed Glycine 0 C--N 1.338 0.682 0 C-N-CA 124.901 1.239 . . . . 0.0 112.281 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 34' ' ' VAL . . . . . 0.425 HG12 ' HA ' ' B' ' 76' ' ' ALA . 29.4 m 37.45 41.21 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 126.582 1.953 . . . . 0.0 114.509 -169.241 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -87.67 -72.78 0.51 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 121.727 -0.608 . . . . 0.0 112.046 -173.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 49.4 p90 -155.82 157.49 31.43 Favored Pre-proline 0 CA--C 1.538 0.506 0 CA-C-O 118.761 -0.638 . . . . 0.0 112.571 -170.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -60.49 125.04 16.34 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.576 2.184 . . . . 0.0 109.703 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.95 -1.54 88.81 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-O 117.564 -1.687 . . . . 0.0 114.763 -174.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' GLN . . . . . 0.572 HE21 ' HG ' ' B' ' 40' ' ' LEU . 4.3 pp0? -56.81 -36.27 69.73 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.336 2.068 . . . . 0.0 111.015 169.751 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.572 ' HG ' HE21 ' B' ' 39' ' ' GLN . 2.2 mt -61.51 -18.49 59.34 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.218 1.007 . . . . 0.0 112.133 -177.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.35 -34.36 75.15 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 118.596 0.635 . . . . 0.0 111.026 175.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.77 -38.66 32.69 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.133 0.973 . . . . 0.0 112.741 175.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -62.18 -34.7 76.93 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 172.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 26.2 mt -103.55 -23.08 13.53 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -173.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.54 8.29 85.9 Favored Glycine 0 CA--C 1.533 1.216 0 CA-C-N 119.194 0.907 . . . . 0.0 114.015 -170.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 9.3 mp -104.64 155.73 18.6 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 118.404 1.102 . . . . 0.0 112.395 -177.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.536 HG23 ' H ' ' B' ' 50' ' ' ASN . 1.6 t -59.47 145.68 43.03 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.11 0.964 . . . . 0.0 112.282 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 29.5 mtm180 -57.19 -24.08 52.0 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.14 1.376 . . . . 0.0 112.469 169.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.9 m -59.76 -59.29 5.66 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.587 1.155 . . . . 0.0 109.856 169.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 50' ' ' ASN . . . . . 0.536 ' H ' HG23 ' B' ' 47' ' ' THR . 2.7 m120 -72.67 -42.51 64.21 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.969 0.908 . . . . 0.0 110.831 -177.482 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.5 t -53.79 -40.53 44.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 120.565 1.53 . . . . 0.0 111.924 171.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 50.5 m -68.66 -39.52 80.6 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 120.078 1.308 . . . . 0.0 113.441 175.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -57.99 -48.55 79.68 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.932 0.893 . . . . 0.0 111.259 172.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 19.4 m170 -60.63 -38.49 84.95 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 118.034 -0.984 . . . . 0.0 112.097 173.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 42.7 mt -70.89 -21.22 62.42 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.11 1.364 . . . . 0.0 114.115 174.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 56' ' ' SER . . . . . 0.487 ' HA ' HH21 ' B' ' 59' ' ' ARG . 0.2 OUTLIER -61.14 -59.35 5.48 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 121.476 1.944 . . . . 0.0 112.711 -172.282 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -73.21 -26.35 61.11 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 122.121 0.962 . . . . 0.0 111.487 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.22 -48.17 71.36 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.62 1.568 . . . . 0.0 111.216 169.4 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.487 HH21 ' HA ' ' B' ' 56' ' ' SER . 76.5 mtm180 -82.81 -21.54 34.47 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.537 1.135 . . . . 0.0 112.48 178.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -78.29 -60.45 2.68 Favored Glycine 0 N--CA 1.469 0.891 0 CA-C-N 119.381 0.991 . . . . 0.0 113.234 177.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 20.8 m -67.89 -7.94 32.41 Favored 'General case' 0 CA--C 1.564 1.495 0 C-N-CA 125.236 1.414 . . . . 0.0 114.106 -178.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.87 7.99 54.72 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 127.008 2.242 . . . . 0.0 115.87 171.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.499 HD22 ' CD2' ' B' ' 14' ' ' LEU . 1.7 mt -66.5 -26.38 67.14 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.77 1.628 . . . . 0.0 112.98 -176.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 3.0 m -142.38 159.75 19.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 127.417 2.287 . . . . 0.0 110.723 174.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 4.8 t -133.91 167.04 27.22 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 C-N-CA 126.185 1.794 . . . . 0.0 109.449 176.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.33 130.43 50.6 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.652 1.581 . . . . 0.0 111.84 171.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.478 HG22 ' H ' ' B' ' 68' ' ' TYR . 1.3 m -120.64 -178.23 3.66 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.637 1.575 . . . . 0.0 108.223 178.177 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.478 ' H ' HG22 ' B' ' 67' ' ' THR . 29.7 m-85 -116.21 131.46 56.94 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.332 1.053 . . . . 0.0 112.005 169.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.52 10.29 18.23 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.579 0.752 . . . . 0.0 110.484 165.022 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.9 -56.45 4.94 Favored Glycine 0 C--N 1.344 0.984 0 C-N-CA 125.956 1.741 . . . . 0.0 112.182 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -70.49 -19.98 62.89 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.645 1.578 . . . . 0.0 112.553 174.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -165.2 168.47 17.05 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.121 2.168 . . . . 0.0 109.621 -174.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 32.9 m -88.3 156.73 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 O-C-N 121.489 -0.757 . . . . 0.0 110.226 167.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 74' ' ' ARG . . . . . 0.439 ' HG2' ' HB ' ' B' ' 67' ' ' THR . 24.2 ptt180 -132.92 173.13 11.72 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.503 1.121 . . . . 0.0 109.034 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -111.59 160.53 17.12 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 164.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.425 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -156.16 152.87 28.42 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.649 1.58 . . . . 0.0 110.295 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 tp -63.25 158.39 20.28 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.417 1.487 . . . . 0.0 112.594 176.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.67 -29.88 60.09 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 116.958 2.207 . . . . 0.0 116.958 -175.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 10.0 t70 168.63 166.37 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 129.425 3.09 . . . . 0.0 109.4 -169.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 45.2 t -46.11 -33.21 3.36 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.435 1.894 . . . . 0.0 112.121 166.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -45.76 -64.66 0.68 Allowed 'General case' 0 C--N 1.343 0.287 0 C-N-CA 125.208 1.403 . . . . 0.0 112.878 171.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 14.5 mt -68.07 -31.91 71.87 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.416 1.007 . . . . 0.0 110.848 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.27 -45.23 94.2 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.416 1.007 . . . . 0.0 110.286 -176.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.95 -40.24 28.49 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.569 0.748 . . . . 0.0 112.765 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.2 -33.58 71.88 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.797 1.18 . . . . 0.0 113.733 179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.13 -42.34 47.17 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.47 -0.769 . . . . 0.0 110.193 170.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.05 -39.06 54.8 Favored Glycine 0 CA--C 1.538 1.519 0 C-N-CA 125.6 1.571 . . . . 0.0 114.222 -169.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.84 -31.67 59.45 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 119.116 1.458 . . . . 0.0 109.662 166.217 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 19.3 tp 82.14 160.8 0.14 Allowed 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 128.98 2.912 . . . . 0.0 111.296 169.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 90' ' ' VAL . . . . . 0.511 HG23 HG12 ' B' ' 92' ' ' VAL . 15.9 m -57.07 8.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 127.21 2.204 . . . . 0.0 114.648 169.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 71.56 -20.39 0.24 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.461 1.905 . . . . 0.0 114.895 171.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.511 HG12 HG23 ' B' ' 90' ' ' VAL . 2.5 p -54.56 29.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 C-N-CA 131.393 3.877 . . . . 0.0 118.301 -176.363 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.2 t 69.26 15.72 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 125.533 1.533 . . . . 0.0 111.379 171.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 2.1 tm? 101.63 107.3 0.01 OUTLIER 'General case' 0 C--N 1.35 0.601 0 C-N-CA 130.583 3.553 . . . . 0.0 109.055 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.04 88.91 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.873 0 O-C-N 120.94 -1.1 . . . . 0.0 110.998 168.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 15.3 t -65.38 149.13 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 125.916 1.687 . . . . 0.0 110.312 173.106 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -57.91 -2.58 0.16 Allowed 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 127.284 2.234 . . . . 0.0 115.24 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 38.0 p -87.05 118.98 26.79 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.864 1.266 . . . . 0.0 111.976 -178.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -76.97 67.1 2.92 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 122.655 1.217 . . . . 0.0 109.769 167.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.68 134.9 64.45 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 172.381 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -57.59 136.77 77.8 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.382 2.721 . . . . 0.0 112.895 -169.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 9.0 t -65.7 55.35 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 128.786 2.835 . . . . 0.0 111.331 175.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 7.5 p -25.49 -58.11 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 128.772 2.829 . . . . 0.0 115.034 -166.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.46 110.68 13.75 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.861 0.755 . . . . 0.0 109.448 168.09 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . 0.26 73.0 mt-10 78.0 30.37 0.45 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 126.414 1.885 . . . . 0.0 113.737 171.374 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? . . . . . 0 CA--C 1.539 0.523 0 C-N-CA 124.739 1.216 . . . . 0.0 112.562 170.08 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.424 0 CA-C-O 121.846 0.832 . . . . 0.0 109.909 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -59.72 -30.06 68.56 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 -170.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.59 -32.04 49.34 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 120.293 1.406 . . . . 0.0 112.91 172.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.0 mmt85 -66.94 -18.36 65.34 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 120.312 -1.492 . . . . 0.0 113.017 177.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.554 HD21 HD21 ' A' ' 63' ' ' LEU . 3.1 tm? -70.28 -39.22 75.02 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.6 1.16 . . . . 0.0 110.807 172.644 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.08 -40.83 99.7 Favored Glycine 0 C--N 1.341 0.86 0 N-CA-C 111.099 -0.8 . . . . 0.0 111.099 171.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -57.25 -46.03 83.4 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.212 1.006 . . . . 0.0 109.674 171.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.73 -19.63 65.1 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 116.916 -1.516 . . . . 0.0 113.578 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 mp -98.4 -16.35 19.31 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 171.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.86 -34.17 51.81 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.633 1.973 . . . . 0.0 114.3 169.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -50.85 136.37 26.74 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 125.098 1.359 . . . . 0.0 111.203 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -60.01 -77.34 0.02 OUTLIER 'Trans proline' 0 CA--C 1.537 0.647 1 C-N-CA 125.47 4.113 . . . . 0.0 113.23 -169.03 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.443 ' HB ' ' CD2' ' A' ' 54' ' ' HIS . 24.6 m -53.98 -36.7 63.18 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 117.59 -1.195 . . . . 0.0 110.408 174.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.32 -43.0 82.7 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.915 1.234 . . . . 0.0 113.336 -175.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 11.8 t -54.43 -44.63 72.62 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.601 1.16 . . . . 0.0 110.276 168.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -43.68 93.98 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-O 117.857 -1.068 . . . . 0.0 112.444 175.13 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -54.44 -50.45 57.68 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 C-N-CA 125.948 1.699 . . . . 0.0 111.061 174.528 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 14.9 mt -52.57 -39.39 61.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 118.671 -0.68 . . . . 0.0 112.573 -176.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.08 -20.26 26.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 118.807 0.731 . . . . 0.0 112.559 -177.725 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.39 -6.93 59.43 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 174.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -105.91 -13.26 15.55 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 169.287 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.47 -48.35 64.72 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 127.394 2.277 . . . . 0.0 108.773 165.08 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -135.86 96.06 3.35 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.514 2.726 . . . . 0.0 107.932 175.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 159.59 -95.8 0.14 Allowed Glycine 0 N--CA 1.468 0.78 0 C-N-CA 124.824 1.202 . . . . 0.0 111.105 176.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.0 m 51.4 33.13 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 178.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 2.4 m -80.55 -65.58 0.99 Allowed 'General case' 0 C--O 1.222 -0.364 0 O-C-N 121.199 -0.938 . . . . 0.0 111.284 178.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -150.96 157.5 35.41 Favored Pre-proline 0 N--CA 1.47 0.533 0 CA-C-O 117.731 -1.128 . . . . 0.0 111.069 -172.56 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -59.07 -18.1 41.76 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 122.892 2.395 . . . . 0.0 114.166 169.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -86.91 -12.27 68.83 Favored Glycine 0 CA--C 1.536 1.403 0 CA-C-O 118.494 -1.17 . . . . 0.0 115.252 170.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.87 -36.67 56.6 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.884 1.842 . . . . 0.0 112.051 -170.018 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.686 HD12 ' H ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -66.71 -19.4 65.75 Favored 'General case' 0 C--O 1.217 -0.616 0 C-N-CA 123.14 0.576 . . . . 0.0 110.919 -174.546 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.8 -36.75 79.82 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.387 -0.82 . . . . 0.0 112.734 -177.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -75.0 -47.76 27.53 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 122.794 0.437 . . . . 0.0 110.926 170.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -57.68 -35.72 70.97 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.766 1.226 . . . . 0.0 113.919 -176.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.434 HD12 HG22 ' A' ' 51' ' ' VAL . 65.7 mt -94.53 -15.27 24.29 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 127.598 2.359 . . . . 0.0 112.324 -178.605 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.33 10.96 54.88 Favored Glycine 0 CA--C 1.53 1.023 0 C-N-CA 124.291 0.948 . . . . 0.0 112.976 -170.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.4 mt -117.22 149.99 39.49 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 124.107 0.963 . . . . 0.0 111.427 -169.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 12.7 p -61.75 147.31 46.61 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.833 -0.542 . . . . 0.0 110.115 -172.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -59.15 -20.33 52.77 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 177.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.0 m -73.94 -46.53 43.64 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.138 0.975 . . . . 0.0 112.085 169.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -65.09 -44.2 89.62 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.364 1.065 . . . . 0.0 111.889 175.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.434 HG22 HD12 ' A' ' 44' ' ' LEU . 23.2 t -61.53 -40.87 87.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.725 1.21 . . . . 0.0 111.391 173.11 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 70.7 m -64.04 -41.35 97.44 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.921 1.237 . . . . 0.0 112.717 172.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -55.11 -48.93 72.93 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 123.491 0.716 . . . . 0.0 111.48 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' HIS . . . . . 0.443 ' CD2' ' HB ' ' A' ' 22' ' ' THR 0.272 11.2 m-70 -80.4 -22.98 40.71 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.811 1.412 . . . . 0.0 114.811 176.45 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 31.4 mt -65.16 -30.5 71.42 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.773 1.624 . . . . 0.0 110.619 166.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.6 t -50.76 -59.81 3.71 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.568 1.076 . . . . 0.0 112.857 -173.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 9.0 t -78.29 -11.02 59.91 Favored 'General case' 0 CA--C 1.554 1.112 0 O-C-N 121.476 -0.765 . . . . 0.0 112.227 174.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.9 tp -68.15 -36.28 79.42 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 122.065 2.211 . . . . 0.0 109.882 168.09 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.0 mtp180 -81.34 -12.77 58.92 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.37 1.868 . . . . 0.0 111.131 173.09 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -88.48 -60.84 1.5 Allowed Glycine 0 C--N 1.34 0.8 0 C-N-CA 125.044 1.307 . . . . 0.0 111.006 176.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 96.1 m -59.2 8.13 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 128.361 2.664 . . . . 0.0 115.022 171.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.23 -3.55 14.67 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 126.202 1.858 . . . . 0.0 115.743 177.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.554 HD21 HD21 ' A' ' 14' ' ' LEU . 75.4 mt -59.65 -29.53 68.1 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 126.398 1.879 . . . . 0.0 114.555 -174.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.38 137.25 58.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 125.16 1.384 . . . . 0.0 111.95 173.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.6 t -118.06 139.86 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 C-N-CA 125.849 1.66 . . . . 0.0 109.298 174.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -89.01 149.58 23.19 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.556 1.142 . . . . 0.0 113.461 177.046 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 m -171.16 157.79 5.25 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 126.442 1.897 . . . . 0.0 108.05 -176.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -73.1 143.79 47.24 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 118.903 0.774 . . . . 0.0 112.529 171.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.438 ' CD ' ' H ' ' A' ' 70' ' ' GLY 0.289 2.2 pp20? -84.75 -124.42 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 117.034 -1.46 . . . . 0.0 107.654 165.264 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.438 ' H ' ' CD ' ' A' ' 69' ' ' GLU . . . -77.29 -28.82 57.35 Favored Glycine 0 CA--C 1.537 1.416 0 CA-C-N 121.919 2.145 . . . . 0.0 114.286 171.288 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.49 -29.02 0.07 Allowed 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 119.15 1.475 . . . . 0.0 114.818 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -81.99 168.86 17.41 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 125.711 1.605 . . . . 0.0 111.011 169.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 26.7 m -98.84 146.78 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 123.272 0.629 . . . . 0.0 110.181 169.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -129.83 168.64 16.28 Favored 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 125.432 1.493 . . . . 0.0 111.626 -171.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -121.6 129.0 52.54 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 124.97 1.308 . . . . 0.0 109.215 170.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -143.05 153.44 42.95 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 125.333 1.453 . . . . 0.0 111.398 -173.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 68.7 mt -64.42 147.24 53.09 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -177.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.35 -28.71 61.26 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -172.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -163.8 159.54 21.36 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 123.148 1.451 . . . . 0.0 112.931 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 96.0 p -43.42 -36.34 1.91 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 128.646 2.778 . . . . 0.0 113.815 167.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -50.78 -52.68 38.5 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 125.201 1.4 . . . . 0.0 112.59 172.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.9 mt -71.43 -53.4 14.12 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.31 -36.52 61.33 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.661 1.185 . . . . 0.0 113.0 -177.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -74.92 -57.42 3.92 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 117.726 -1.131 . . . . 0.0 111.974 -177.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.7 -27.33 68.84 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.466 1.03 . . . . 0.0 112.869 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 60.1 tp -69.35 -41.15 76.98 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.565 1.146 . . . . 0.0 111.469 169.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -78.47 -38.36 25.05 Favored Glycine 0 N--CA 1.469 0.88 0 C-N-CA 126.692 2.091 . . . . 0.0 115.129 -172.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -82.94 -16.6 46.74 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 118.637 1.219 . . . . 0.0 113.014 171.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 43.5 tp 67.95 140.94 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 128.841 2.856 . . . . 0.0 112.241 178.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 34.7 m -63.64 22.19 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.434 1.893 . . . . 0.0 114.656 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 81.08 -26.91 0.14 Allowed 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 125.98 1.712 . . . . 0.0 112.949 158.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.406 ' CG2' HD12 ' B' ' 11' ' ' LEU . 4.1 p -54.44 23.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 C-N-CA 131.57 3.948 . . . . 0.0 118.135 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 68.56 11.69 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 O-C-N 120.379 -1.45 . . . . 0.0 112.459 167.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.1 tt 84.94 100.93 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 129.389 3.076 . . . . 0.0 109.369 -172.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.93 108.13 0.98 Allowed 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 -175.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -66.89 150.42 11.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 125.125 1.37 . . . . 0.0 113.843 169.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -87.41 146.22 25.96 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.423 1.889 . . . . 0.0 108.621 165.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -173.01 136.29 0.65 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.557 1.943 . . . . 0.0 109.164 -177.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.0 p30 -67.48 -31.12 71.05 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 129.783 3.233 . . . . 0.0 112.115 169.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.09 168.26 2.3 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 128.501 2.721 . . . . 0.0 113.378 172.609 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -68.49 158.73 56.42 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 123.017 2.478 . . . . 0.0 112.848 -172.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 31.4 p -47.49 -57.42 5.4 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 123.418 1.58 . . . . 0.0 106.793 165.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -176.84 -56.15 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.479 1 C-N-CA 131.826 4.05 . . . . 0.0 108.134 167.545 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -87.25 56.63 4.06 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.628 1.171 . . . . 0.0 112.563 175.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -140.87 -177.31 5.02 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.002 2.121 . . . . 0.0 107.174 172.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.079 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 176.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.393 0 CA-C-O 121.247 0.546 . . . . 0.0 111.27 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.406 HD12 ' CG2' ' A' ' 92' ' ' VAL . 4.0 mm? -64.28 -18.64 64.77 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 114.487 1.291 . . . . 0.0 114.487 -176.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.91 -39.46 62.78 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 120.975 1.716 . . . . 0.0 110.027 167.05 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 67.8 mtt180 -72.25 -13.35 61.5 Favored 'General case' 0 CA--C 1.55 0.976 0 O-C-N 120.334 -1.479 . . . . 0.0 113.58 178.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -69.59 -41.85 75.21 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 120.14 1.336 . . . . 0.0 109.751 169.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -60.37 -38.54 94.87 Favored Glycine 0 N--CA 1.47 0.958 0 O-C-N 120.911 -1.118 . . . . 0.0 111.91 172.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -58.09 -38.86 77.23 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.711 -0.876 . . . . 0.0 110.659 172.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.12 -12.93 61.07 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 117.86 -1.067 . . . . 0.0 113.77 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 12.4 mt -93.7 -25.71 17.33 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.205 0.911 . . . . 0.0 112.258 169.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.67 -20.54 49.98 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.641 1.976 . . . . 0.0 114.638 168.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' ASP . . . . . 0.474 ' CG ' ' HE ' ' B' ' 23' ' ' ARG . 9.7 t70 -56.92 130.09 78.71 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 127.287 2.235 . . . . 0.0 109.371 178.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -49.03 -83.0 0.02 OUTLIER 'Trans proline' 0 C--O 1.237 0.452 1 C-N-CA 126.925 5.083 . . . . 0.0 114.003 -165.28 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.435 ' HB ' ' CG ' ' B' ' 54' ' ' HIS . 59.8 m -59.6 -32.63 70.57 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 116.652 -1.642 . . . . 0.0 110.89 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.474 ' HE ' ' CG ' ' B' ' 20' ' ' ASP . 23.7 mtm180 -62.27 -42.41 99.31 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 121.136 1.789 . . . . 0.0 114.441 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 6.7 t -52.47 -47.84 66.25 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.689 0.757 . . . . 0.0 110.413 173.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.57 -42.47 82.51 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.488 1.115 . . . . 0.0 112.849 175.016 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -53.21 -52.12 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 C-N-CA 126.585 1.954 . . . . 0.0 110.263 176.089 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 25.4 mt -54.73 -37.34 65.77 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 123.556 0.742 . . . . 0.0 112.167 -172.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -64.03 -22.15 30.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 118.928 0.785 . . . . 0.0 112.821 178.006 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.14 -5.11 59.19 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.031 1.332 . . . . 0.0 114.286 173.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -106.8 -19.57 13.6 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 124.867 1.267 . . . . 0.0 113.562 170.5 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.24 -48.06 77.25 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 127.191 2.197 . . . . 0.0 108.953 164.215 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -135.12 93.56 3.01 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 128.324 2.649 . . . . 0.0 108.462 175.096 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . 161.86 -92.73 0.11 Allowed Glycine 0 N--CA 1.468 0.773 0 C-N-CA 124.552 1.073 . . . . 0.0 112.145 173.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 4.0 m 51.4 35.86 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 2.7 m -81.8 -66.88 0.83 Allowed 'General case' 0 C--O 1.223 -0.336 0 O-C-N 121.185 -0.947 . . . . 0.0 111.694 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -147.98 157.17 43.71 Favored Pre-proline 0 CA--C 1.537 0.465 0 CA-C-O 117.738 -1.125 . . . . 0.0 110.685 -174.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -59.1 -14.25 22.77 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 123.299 2.666 . . . . 0.0 114.599 171.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -93.89 -14.3 52.61 Favored Glycine 0 CA--C 1.535 1.336 0 CA-C-O 118.242 -1.31 . . . . 0.0 115.465 170.159 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.65 -34.13 73.57 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.262 2.031 . . . . 0.0 112.108 -170.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.653 ' H ' HD12 ' B' ' 40' ' ' LEU . 0.2 OUTLIER -66.81 -19.01 65.66 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 123.75 0.82 . . . . 0.0 110.511 -172.984 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.52 -37.32 80.78 Favored 'General case' 0 CA--C 1.547 0.833 0 O-C-N 120.891 -1.131 . . . . 0.0 112.174 -177.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.04 -46.83 27.3 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.168 0.587 . . . . 0.0 111.361 171.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -58.72 -32.31 69.08 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -176.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.406 HD12 HG22 ' B' ' 51' ' ' VAL . 69.2 mt -98.93 -20.24 16.9 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 127.128 2.171 . . . . 0.0 112.674 -177.21 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.4 13.52 77.22 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 124.807 1.194 . . . . 0.0 112.964 -170.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 76.3 mt -118.69 151.36 38.12 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 118.229 1.014 . . . . 0.0 111.96 -169.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.8 p -62.89 145.53 54.94 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.497 -0.752 . . . . 0.0 109.783 -173.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -61.39 -17.39 53.9 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 176.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 6.0 m -73.42 -47.94 37.8 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.212 1.005 . . . . 0.0 111.68 169.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -66.17 -45.42 80.94 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.756 0.822 . . . . 0.0 111.134 175.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 51' ' ' VAL . . . . . 0.406 HG22 HD12 ' B' ' 44' ' ' LEU . 5.3 t -58.3 -40.02 76.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 117.929 -1.034 . . . . 0.0 112.218 171.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 67.8 m -67.34 -41.04 85.85 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 121.005 1.729 . . . . 0.0 112.676 174.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -57.99 -47.65 82.35 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.488 0.715 . . . . 0.0 111.218 177.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 54' ' ' HIS . . . . . 0.435 ' CG ' ' HB ' ' B' ' 22' ' ' THR . 79.0 m-70 -75.75 -26.11 57.13 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 121.262 -0.899 . . . . 0.0 113.329 175.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 38.3 mt -66.07 -29.43 69.77 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 121.077 1.762 . . . . 0.0 111.193 167.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.2 t -51.33 -57.93 7.56 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.593 1.088 . . . . 0.0 113.375 -172.086 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 34.2 t -79.69 -9.79 59.69 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 123.542 0.737 . . . . 0.0 112.672 172.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.2 tp -67.03 -37.57 84.36 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 121.965 2.166 . . . . 0.0 109.063 167.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 22.6 mtp-105 -82.2 -7.28 59.62 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.08 2.152 . . . . 0.0 111.429 174.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -91.14 -64.35 1.18 Allowed Glycine 0 C--N 1.342 0.863 0 C-N-CA 125.936 1.732 . . . . 0.0 111.358 173.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 67.8 m -61.1 13.79 0.01 OUTLIER 'General case' 0 CA--C 1.563 1.472 0 C-N-CA 128.227 2.611 . . . . 0.0 115.238 172.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.06 -2.36 6.97 Favored Glycine 0 N--CA 1.474 1.216 0 C-N-CA 126.439 1.971 . . . . 0.0 115.836 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.45 HD23 HD13 ' B' ' 82' ' ' LEU . 52.7 mt -59.27 -28.26 66.57 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.845 1.658 . . . . 0.0 113.8 -175.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -129.46 137.32 57.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 125.243 1.417 . . . . 0.0 112.636 172.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 75.1 t -116.0 136.75 51.91 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 C-N-CA 126.289 1.836 . . . . 0.0 109.566 171.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.68 145.56 28.71 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 122.192 0.996 . . . . 0.0 112.457 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 41.1 m -158.68 159.44 35.32 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 126.048 1.739 . . . . 0.0 107.206 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -83.63 144.2 29.59 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 119.481 1.037 . . . . 0.0 111.771 170.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.269 2.6 pp20? -88.39 -141.48 0.13 Allowed 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 165.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -69.82 -23.09 77.06 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 121.636 2.016 . . . . 0.0 114.572 177.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.72 -30.12 0.07 Allowed 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 -89.36 171.92 9.4 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 126.826 2.05 . . . . 0.0 112.068 174.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 19.7 m -96.13 150.21 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.315 0.646 . . . . 0.0 109.742 167.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -137.57 163.54 30.94 Favored 'General case' 0 CA--C 1.521 -0.139 0 C-N-CA 125.73 1.612 . . . . 0.0 110.935 -171.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -119.54 127.83 53.37 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 125.238 1.415 . . . . 0.0 109.187 174.149 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -141.15 156.06 46.0 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.348 1.459 . . . . 0.0 110.971 -175.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 61.8 mt -63.85 148.38 49.5 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.155 0.502 . . . . 0.0 111.751 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.0 -28.07 62.16 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 -173.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -167.16 160.12 13.52 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.06 1.344 . . . . 0.0 111.715 -178.078 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 94.6 p -41.7 -35.91 0.87 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 128.134 2.574 . . . . 0.0 113.448 167.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -48.38 -54.76 12.79 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 126.08 1.752 . . . . 0.0 112.784 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 82' ' ' LEU . . . . . 0.45 HD13 HD23 ' B' ' 63' ' ' LEU . 7.5 mt -75.32 -47.07 29.49 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.629 -0.7 . . . . 0.0 109.474 -177.256 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.42 -36.08 53.45 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.103 0.961 . . . . 0.0 113.026 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -76.03 -56.13 4.95 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.888 1.275 . . . . 0.0 111.865 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.81 -28.96 66.49 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 176.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 61.1 tp -77.64 -37.5 49.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.426 1.89 . . . . 0.0 112.524 171.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -80.95 -42.37 9.69 Favored Glycine 0 N--CA 1.469 0.837 0 C-N-CA 126.035 1.779 . . . . 0.0 113.915 -169.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -80.69 -23.74 39.35 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 117.967 0.884 . . . . 0.0 111.372 168.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 19.8 tp 68.76 160.71 0.19 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 129.464 3.106 . . . . 0.0 111.398 178.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 90' ' ' VAL . . . . . 0.407 HG23 HG12 ' B' ' 92' ' ' VAL . 17.8 m -58.92 12.22 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 125.857 1.663 . . . . 0.0 114.087 167.351 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 73.82 -17.75 0.43 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 126.146 1.778 . . . . 0.0 114.229 168.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.407 HG12 HG23 ' B' ' 90' ' ' VAL . 1.6 p -59.49 20.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 C-N-CA 128.187 2.595 . . . . 0.0 116.863 177.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.4 t 65.87 23.45 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 C-N-CA 125.373 1.469 . . . . 0.0 113.656 165.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 tt 79.34 92.56 0.06 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 127.47 2.308 . . . . 0.0 110.203 -176.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.68 130.07 42.75 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 178.279 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -84.94 148.64 4.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.755 1.222 . . . . 0.0 111.174 168.605 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -79.96 151.38 30.08 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.106 0.962 . . . . 0.0 109.476 166.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -174.31 144.31 0.92 Allowed 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.832 1.653 . . . . 0.0 109.225 -171.089 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 7.0 p30 -79.96 -22.54 42.47 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 130.465 3.506 . . . . 0.0 112.946 171.13 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.28 -176.64 0.26 Allowed Pre-proline 0 CA--C 1.556 1.177 0 C-N-CA 126.784 2.033 . . . . 0.0 113.596 -176.159 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -76.19 151.67 34.56 Favored 'Trans proline' 0 C--N 1.352 0.753 0 CA-C-N 122.505 1.93 . . . . 0.0 111.383 177.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 26.4 p -44.77 -56.18 4.7 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-O 123.534 1.635 . . . . 0.0 107.998 166.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -176.33 -57.85 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.593 1 C-N-CA 132.459 4.304 . . . . 0.0 107.396 169.637 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -88.96 50.85 2.03 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.082 1.353 . . . . 0.0 113.367 178.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -135.71 -173.47 3.37 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.026 1.73 . . . . 0.0 107.907 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . 0.268 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.017 0 O-C-N 119.468 -2.02 . . . . 0.0 115.524 175.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.619 0 CA-C-O 120.813 0.339 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.651 ' H ' HD12 ' A' ' 11' ' ' LEU . 5.4 mp -47.4 -56.41 6.98 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 126.886 2.075 . . . . 0.0 113.199 -169.175 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.21 -34.38 76.35 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.173 -0.955 . . . . 0.0 112.356 178.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -58.27 -31.48 67.48 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 120.983 -1.073 . . . . 0.0 112.893 -176.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -49.57 -58.08 5.9 Favored 'General case' 0 C--O 1.225 -0.228 0 C-N-CA 126.119 1.768 . . . . 0.0 110.576 173.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -61.3 -35.01 90.29 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-N 118.77 0.714 . . . . 0.0 112.186 -173.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.8 -50.42 62.69 Favored 'General case' 0 C--O 1.221 -0.434 0 C-N-CA 124.043 0.937 . . . . 0.0 110.538 173.072 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.99 -22.93 64.98 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -177.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -88.19 -24.76 23.21 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 119.107 0.867 . . . . 0.0 112.133 170.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.45 31.74 1.48 Allowed 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.652 1.581 . . . . 0.0 112.574 167.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.56 167.29 21.28 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 125.528 1.531 . . . . 0.0 107.407 167.492 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.76 -105.9 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 123.975 3.117 . . . . 0.0 109.997 174.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.7 m -63.85 -14.76 55.87 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.626 1.57 . . . . 0.0 113.078 -178.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.75 -37.86 87.53 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 120.285 1.402 . . . . 0.0 111.765 169.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 19.8 t -64.93 -40.18 94.64 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 118.901 0.773 . . . . 0.0 110.593 172.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 13.5 mmp_? -59.69 -51.4 69.96 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.941 0.896 . . . . 0.0 112.77 172.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.3 mm -47.7 -57.16 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 124.279 1.032 . . . . 0.0 110.835 170.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 86.9 mt -60.8 -50.4 73.62 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.022 0.828 . . . . 0.0 112.092 -176.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.4 p -72.12 -27.07 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -174.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.3 -26.23 28.7 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.358 0.663 . . . . 0.0 112.685 173.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.499 ' O ' HG13 ' A' ' 34' ' ' VAL . 7.8 mt -63.2 -41.76 99.21 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 117.879 -1.057 . . . . 0.0 112.154 170.007 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -40.13 -51.89 2.6 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.93 2.492 . . . . 0.0 114.492 -177.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -97.8 -16.08 19.99 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.613 1.565 . . . . 0.0 112.459 173.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.09 -46.9 9.75 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 125.388 1.471 . . . . 0.0 115.069 -174.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.546 HG12 ' HA ' ' A' ' 76' ' ' ALA . 15.9 m 3.48 58.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 131.245 3.818 . . . . 0.0 118.603 -178.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 55.6 m -118.65 -57.86 2.01 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.517 1.927 . . . . 0.0 111.669 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -149.02 148.77 28.16 Favored Pre-proline 0 N--CA 1.474 0.728 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -171.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -55.53 -45.34 40.4 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 122.7 2.266 . . . . 0.0 112.406 172.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -74.89 -6.55 78.86 Favored Glycine 0 CA--C 1.532 1.14 0 CA-C-O 118.836 -0.98 . . . . 0.0 114.541 178.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -65.42 -33.74 76.66 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.159 1.48 . . . . 0.0 111.875 -175.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.49 HD21 ' HG ' ' A' ' 30' ' ' LEU . 2.2 mt -64.39 -6.97 8.18 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 123.443 0.697 . . . . 0.0 112.043 -175.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.84 -39.96 95.47 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 122.638 0.375 . . . . 0.0 110.462 172.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.77 -38.85 62.07 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.608 0.763 . . . . 0.0 111.59 171.327 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.412 ' HD2' HD23 ' A' ' 40' ' ' LEU . 2.4 m-70 -61.63 -23.73 66.24 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 177.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 69.0 mt -119.81 -16.3 8.75 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.076 1.35 . . . . 0.0 113.941 -173.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.78 10.31 67.4 Favored Glycine 0 CA--C 1.537 1.423 0 CA-C-N 118.99 0.814 . . . . 0.0 112.925 -168.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 79.4 mt -104.86 158.26 16.65 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.574 1.187 . . . . 0.0 112.98 -171.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.2 t -66.4 153.37 42.96 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 122.103 0.954 . . . . 0.0 111.374 176.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -54.59 -22.47 13.45 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.348 1.459 . . . . 0.0 113.424 173.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.6 t -67.39 -56.71 8.57 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.336 0.971 . . . . 0.0 111.293 169.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -62.69 -37.58 87.02 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.47 1.108 . . . . 0.0 112.151 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.8 t -58.16 -50.0 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 123.557 0.743 . . . . 0.0 111.024 169.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.4 m -63.34 -34.09 76.95 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 177.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -57.43 -52.63 64.59 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.722 1.609 . . . . 0.0 110.651 -178.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 49.1 m-70 -76.98 -19.0 57.85 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.343 1.238 . . . . 0.0 114.343 175.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 41.7 mt -76.05 -22.14 56.01 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 120.402 1.456 . . . . 0.0 112.845 169.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 88.9 p -52.2 -64.13 0.92 Allowed 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 120.648 1.567 . . . . 0.0 113.48 -175.216 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 51.0 t -64.69 -39.62 93.97 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.404 1.082 . . . . 0.0 110.785 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.5 tp -48.02 -40.65 23.41 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.673 1.589 . . . . 0.0 113.761 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 -88.1 -17.0 31.99 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.928 1.291 . . . . 0.0 113.3 -175.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -93.3 -45.55 3.49 Favored Glycine 0 N--CA 1.477 1.4 0 C-N-CA 125.248 1.404 . . . . 0.0 111.959 175.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 55.5 m -75.23 7.58 3.32 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 127.151 2.181 . . . . 0.0 112.866 170.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 66.1 6.28 31.42 Favored Glycine 0 N--CA 1.468 0.827 0 C-N-CA 126.019 1.771 . . . . 0.0 117.083 169.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 47.2 mt -61.37 -19.95 62.45 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.4 1.6 . . . . 0.0 113.384 178.221 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.1 m -132.47 147.26 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 127.333 2.253 . . . . 0.0 111.862 169.032 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 82.8 t -128.82 137.37 57.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 126.791 2.036 . . . . 0.0 109.616 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.19 172.82 11.08 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 123.126 1.441 . . . . 0.0 114.346 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.7 m -160.72 149.16 16.37 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.92 1.288 . . . . 0.0 108.514 177.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -98.63 114.25 26.64 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.692 1.133 . . . . 0.0 110.869 168.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.46 ' CD ' ' HD3' ' A' ' 74' ' ' ARG . 12.1 mm-40 -93.52 34.36 1.18 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.144 1.778 . . . . 0.0 113.428 -173.27 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.33 -17.35 1.08 Allowed Glycine 0 CA--C 1.536 1.363 0 O-C-N 120.209 -1.557 . . . . 0.0 115.254 174.044 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -145.26 -17.09 0.49 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.28 1.432 . . . . 0.0 113.773 -178.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -152.61 -178.98 7.2 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 127.944 2.498 . . . . 0.0 107.105 175.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 16.3 m -108.85 155.48 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 123.785 0.834 . . . . 0.0 109.212 168.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.46 ' HD3' ' CD ' ' A' ' 69' ' ' GLU . 2.2 ptt180 -122.95 175.21 6.7 Favored 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 124.76 1.224 . . . . 0.0 111.092 176.456 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.402 ' O ' HD22 ' A' ' 30' ' ' LEU . 39.1 m-85 -130.76 118.66 21.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.094 -1.412 . . . . 0.0 107.914 168.423 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.546 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -108.92 156.97 19.08 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 125.07 1.348 . . . . 0.0 109.396 174.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.2 tp -54.99 152.27 7.76 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.048 1.339 . . . . 0.0 111.377 172.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -45.54 -48.35 14.27 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.514 1.302 . . . . 0.0 114.514 -171.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -171.87 -179.96 2.57 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.122 0.963 . . . . 0.0 111.308 -176.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.6 p -42.78 -39.23 2.39 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.441 1.896 . . . . 0.0 112.309 167.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -54.19 -57.08 12.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.469 1.507 . . . . 0.0 113.262 177.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 18.4 mt -74.61 -34.87 62.92 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.9 1.227 . . . . 0.0 110.626 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.39 -21.92 66.73 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.457 0.571 . . . . 0.0 112.329 -178.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -81.58 -74.28 0.34 Allowed 'General case' 0 C--O 1.219 -0.515 0 CA-C-O 116.753 -1.594 . . . . 0.0 111.278 166.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.04 -21.91 66.71 Favored 'General case' 0 CA--C 1.555 1.168 0 CA-C-N 123.06 2.663 . . . . 0.0 115.974 -169.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.69 -42.62 50.57 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 120.553 1.524 . . . . 0.0 109.702 167.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -66.26 -32.32 81.74 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 127.912 2.672 . . . . 0.0 115.6 179.102 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.32 -27.25 62.04 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 126.85 2.06 . . . . 0.0 112.416 169.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 28.6 tp 71.29 97.95 0.07 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 128.408 2.683 . . . . 0.0 108.909 -170.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.464 HG23 HG12 ' A' ' 92' ' ' VAL . 33.6 m -51.62 11.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 129.414 3.086 . . . . 0.0 118.418 -176.73 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.5 mm-40 80.64 -28.58 0.13 Allowed 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 119.749 -1.844 . . . . 0.0 113.464 157.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.464 HG12 HG23 ' A' ' 90' ' ' VAL . 4.9 p -62.12 43.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 C-N-CA 128.755 2.822 . . . . 0.0 115.691 176.453 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 67.32 6.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 C-N-CA 127.609 2.364 . . . . 0.0 113.058 177.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.8 tt 71.97 93.71 0.08 Allowed 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 127.731 2.412 . . . . 0.0 107.414 -168.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.49 123.23 14.04 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.108 0.563 . . . . 0.0 112.326 -173.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 29.0 t -63.55 164.78 1.38 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 126.19 1.796 . . . . 0.0 110.149 169.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.88 19.27 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 126.098 1.759 . . . . 0.0 113.905 172.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 16.3 p -109.39 131.58 54.93 Favored 'General case' 0 CA--C 1.516 -0.352 0 O-C-N 120.124 -1.61 . . . . 0.0 114.268 -173.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -87.89 131.31 34.62 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 105.81 -1.922 . . . . 0.0 105.81 162.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -132.84 137.88 30.66 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 105.675 -1.972 . . . . 0.0 105.675 -174.665 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -73.6 179.37 5.65 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 124.682 3.588 . . . . 0.0 113.367 -168.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.08 138.19 58.16 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-O 121.595 0.712 . . . . 0.0 111.178 178.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 21.3 t -68.23 -25.6 32.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 O-C-N 121.748 -0.595 . . . . 0.0 111.566 -171.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -86.47 -21.61 26.93 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 170.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -149.01 106.23 3.62 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.213 1.005 . . . . 0.0 111.542 -169.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.552 1.05 0 C-N-CA 126.356 1.862 . . . . 0.0 115.68 -170.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.013 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 29.3 mt -46.31 -66.05 0.46 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 128.819 2.848 . . . . 0.0 112.469 -169.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.31 -37.69 68.89 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 122.833 0.453 . . . . 0.0 112.166 173.221 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.33 -30.19 62.27 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -176.449 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -46.4 -60.93 2.04 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 127.199 2.2 . . . . 0.0 110.015 169.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.13 -21.96 70.36 Favored Glycine 0 C--N 1.338 0.684 0 CA-C-O 118.806 -0.997 . . . . 0.0 112.842 -172.2 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -53.81 8.79 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.388 1.094 . . . . 0.0 110.171 169.089 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.98 -22.77 65.9 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -174.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -87.97 -19.38 27.3 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.369 0.986 . . . . 0.0 112.093 169.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -82.31 63.65 6.59 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.009 1.324 . . . . 0.0 110.097 171.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.5 166.88 20.13 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 125.033 1.333 . . . . 0.0 112.73 -168.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -71.64 -116.82 0.01 OUTLIER 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 124.671 3.581 . . . . 0.0 107.781 165.193 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 42.4 p -60.19 -22.18 62.64 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 -173.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.423 ' CG ' HD13 ' B' ' 58' ' ' LEU . 4.5 ttp180 -61.57 -36.24 80.08 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 121.635 2.016 . . . . 0.0 112.23 174.541 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 48.7 t -69.25 -41.74 76.54 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.027 0.83 . . . . 0.0 111.577 168.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 17.1 mmp_? -58.97 -52.44 65.73 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.372 0.669 . . . . 0.0 112.075 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 18.3 mm -42.78 -56.16 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 125.837 1.655 . . . . 0.0 109.832 172.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 94.6 mt -62.71 -45.53 92.33 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 118.983 -0.532 . . . . 0.0 112.422 -175.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 8.4 p -74.24 -28.05 22.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -178.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.8 -25.75 27.96 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 175.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.506 HD23 ' HA ' ' B' ' 30' ' ' LEU . 9.0 mt -62.23 -43.05 99.72 Favored 'General case' 0 CA--C 1.52 -0.178 0 O-C-N 121.28 -0.888 . . . . 0.0 111.977 172.28 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -41.65 -45.18 3.34 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 129.137 2.975 . . . . 0.0 115.092 -174.653 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -117.35 13.17 14.48 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 126.059 1.744 . . . . 0.0 112.658 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.69 -69.34 0.77 Allowed Glycine 0 N--CA 1.472 1.093 0 C-N-CA 127.321 2.391 . . . . 0.0 112.806 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 29.43 41.13 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 128.599 2.76 . . . . 0.0 117.201 -177.623 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 94.2 m -84.07 -79.31 0.21 Allowed 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 125.443 1.497 . . . . 0.0 110.208 173.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.36 158.35 51.17 Favored Pre-proline 0 N--CA 1.482 1.143 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 -168.436 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.08 -34.69 93.39 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 123.162 2.574 . . . . 0.0 113.519 176.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -76.92 -12.43 84.61 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-O 118.419 -1.212 . . . . 0.0 113.916 175.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.12 -31.15 72.2 Favored 'General case' 0 C--N 1.348 0.502 0 CA-C-N 120.076 1.938 . . . . 0.0 112.424 -170.023 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.447 HD21 ' HG ' ' B' ' 30' ' ' LEU . 1.1 mt -69.06 -7.34 34.88 Favored 'General case' 0 C--N 1.342 0.258 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -175.699 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.0 -39.06 80.7 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 118.422 0.555 . . . . 0.0 110.651 169.006 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.79 -43.93 57.41 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.62 0.768 . . . . 0.0 111.867 172.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 55.5 m170 -59.13 -27.1 65.3 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 67.9 mt -111.83 -16.59 13.13 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.983 1.713 . . . . 0.0 113.533 -177.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.09 15.26 69.45 Favored Glycine 0 CA--C 1.536 1.367 0 CA-C-N 118.757 0.708 . . . . 0.0 112.708 -168.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 86.4 mt -108.76 171.04 7.66 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.753 1.276 . . . . 0.0 113.453 -173.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.9 t -69.98 151.09 45.99 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 122.026 0.917 . . . . 0.0 111.149 169.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -54.45 -18.92 4.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.686 1.594 . . . . 0.0 113.553 168.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 11.7 t -68.05 -58.62 4.2 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.066 0.848 . . . . 0.0 111.493 169.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -59.32 -36.73 76.16 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.452 -0.78 . . . . 0.0 112.531 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 42.1 t -57.83 -50.29 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 123.419 0.688 . . . . 0.0 111.027 170.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 41.2 m -68.7 -31.82 71.18 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -178.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 32.4 t-20 -57.43 -62.0 2.09 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.212 1.405 . . . . 0.0 109.806 178.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 -68.13 -24.53 65.02 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 121.034 -1.041 . . . . 0.0 112.876 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 73.7 mt -69.97 -19.19 63.37 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 119.711 1.141 . . . . 0.0 113.76 170.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 89.3 p -58.16 -48.17 81.11 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 121.075 1.761 . . . . 0.0 111.892 174.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 51.7 t -68.89 -46.23 68.91 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.566 0.621 . . . . 0.0 111.034 175.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.423 HD13 ' CG ' ' B' ' 23' ' ' ARG . 2.9 tp -57.52 -36.83 72.08 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.307 1.043 . . . . 0.0 113.357 -171.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -90.13 -16.38 29.7 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.242 1.417 . . . . 0.0 112.867 178.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -79.97 -51.71 4.95 Favored Glycine 0 N--CA 1.472 1.06 0 CA-C-N 119.38 0.991 . . . . 0.0 111.135 170.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 83.4 m -74.44 3.19 7.91 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 126.913 2.085 . . . . 0.0 113.903 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.53 3.95 50.24 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.006 1.288 . . . . 0.0 115.446 169.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 84.5 mt -57.85 -23.81 54.59 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.496 1.648 . . . . 0.0 112.619 176.291 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.8 m -126.73 147.6 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 126.742 2.017 . . . . 0.0 111.662 168.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 65.8 t -136.05 132.99 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 126.838 2.055 . . . . 0.0 109.589 -176.091 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.75 157.82 27.04 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.832 1.653 . . . . 0.0 113.488 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 15.7 m -165.29 140.73 5.22 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.547 1.539 . . . . 0.0 108.072 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -63.83 122.29 16.08 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.814 0.734 . . . . 0.0 111.479 172.499 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 69' ' ' GLU . . . . . 0.469 ' CD ' ' H ' ' B' ' 72' ' ' GLN . 5.1 pt-20 -71.99 -21.66 61.54 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -178.014 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 116.25 4.67 17.92 Favored Glycine 0 CA--C 1.539 1.589 0 C-N-CA 125.52 1.534 . . . . 0.0 113.834 -168.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 71' ' ' ARG . . . . . 0.421 ' H ' ' HG2' ' B' ' 69' ' ' GLU . 29.2 ttm180 -155.5 -53.46 0.09 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.187 1.395 . . . . 0.0 111.493 175.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 72' ' ' GLN . . . . . 0.469 ' H ' ' CD ' ' B' ' 69' ' ' GLU . 9.4 mm-40 -116.37 -125.04 0.28 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.57 1.548 . . . . 0.0 108.181 167.013 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 11.5 p -149.13 137.07 14.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 126.095 1.758 . . . . 0.0 107.182 -167.378 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.2 ptt85 -105.04 170.84 7.64 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.967 1.307 . . . . 0.0 109.034 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.454 ' O ' HD22 ' B' ' 30' ' ' LEU . 45.6 m-85 -129.27 116.14 18.68 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 168.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -108.43 169.18 8.81 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.773 1.229 . . . . 0.0 109.579 175.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 tp -59.88 162.07 5.85 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.987 0.915 . . . . 0.0 111.421 169.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -48.96 -54.42 15.62 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.981 0.912 . . . . 0.0 112.603 176.173 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -165.97 165.63 17.91 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.708 1.203 . . . . 0.0 110.945 -169.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 92.2 p -40.26 -37.5 0.65 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.615 2.366 . . . . 0.0 112.582 166.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -52.33 -58.45 6.63 Favored 'General case' 0 C--N 1.341 0.231 0 C-N-CA 125.165 1.386 . . . . 0.0 113.762 173.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 13.9 mt -70.36 -32.47 70.17 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.505 1.048 . . . . 0.0 110.011 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.5 -28.33 67.74 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.682 0.793 . . . . 0.0 111.769 -176.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.42 -71.11 0.46 Allowed 'General case' 0 C--O 1.22 -0.461 0 CA-C-O 116.63 -1.652 . . . . 0.0 111.407 168.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.9 -22.91 65.97 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 122.998 2.635 . . . . 0.0 115.253 -170.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.57 -46.55 25.81 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.049 -1.032 . . . . 0.0 110.356 167.532 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.24 -28.83 74.02 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 126.158 1.837 . . . . 0.0 115.304 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.11 -26.9 67.99 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.673 1.989 . . . . 0.0 112.257 168.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 34.7 tp 70.32 100.11 0.06 Allowed 'General case' 0 C--O 1.232 0.172 0 C-N-CA 128.481 2.712 . . . . 0.0 109.281 -172.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 90' ' ' VAL . . . . . 0.54 HG23 HG12 ' B' ' 92' ' ' VAL . 34.0 m -51.5 11.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 C-N-CA 129.431 3.092 . . . . 0.0 118.247 -178.156 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 91' ' ' GLN . . . . . 0.45 ' C ' ' H ' ' B' ' 93' ' ' VAL . 31.0 mm-40 77.84 -18.0 0.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 O-C-N 119.854 -1.779 . . . . 0.0 114.53 159.284 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.54 HG12 HG23 ' B' ' 90' ' ' VAL . 4.5 p -66.42 34.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 127.049 2.14 . . . . 0.0 113.452 168.566 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 93' ' ' VAL . . . . . 0.45 ' H ' ' C ' ' B' ' 91' ' ' GLN . 2.7 t 69.98 1.07 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.028 0 C-N-CA 127.381 2.273 . . . . 0.0 113.367 169.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 87.53 99.41 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 130.101 3.36 . . . . 0.0 107.135 -174.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.96 100.98 0.05 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.159 0.984 . . . . 0.0 113.137 -173.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 25.2 t -51.97 153.66 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 125.622 1.569 . . . . 0.0 110.205 168.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -66.75 32.17 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 126.907 2.083 . . . . 0.0 114.984 175.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 33.8 p -121.73 111.03 16.66 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.226 1.81 . . . . 0.0 112.815 -174.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -93.95 143.22 26.55 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 165.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -154.97 174.09 4.21 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 124.657 1.183 . . . . 0.0 108.265 -168.483 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -72.29 165.39 32.79 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.175 1.917 . . . . 0.0 112.661 -170.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -70.19 140.72 52.56 Favored 'General case' 0 CA--C 1.552 1.056 0 O-C-N 122.162 -0.336 . . . . 0.0 110.219 178.189 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 19.2 t -55.29 -22.92 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -166.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -100.6 -16.75 17.35 Favored 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 178.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -143.6 121.77 12.21 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.477 1.035 . . . . 0.0 110.658 -169.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.547 0.864 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -169.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.619 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 pp -65.71 -22.42 66.61 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.112 169.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.94 -56.83 9.69 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 169.071 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 -53.76 -36.37 62.29 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.369 1.068 . . . . 0.0 113.647 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.25 -64.92 0.75 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.492 1.517 . . . . 0.0 110.404 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.64 -19.18 76.32 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 118.927 -0.929 . . . . 0.0 113.531 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -65.55 -4.09 5.5 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.63 1.715 . . . . 0.0 113.328 174.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.4 -6.73 1.54 Allowed 'General case' 0 CA--C 1.547 0.865 0 CA-C-O 117.116 -1.421 . . . . 0.0 114.3 169.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.88 -31.61 17.25 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 121.394 1.906 . . . . 0.0 110.171 165.682 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.436 ' HB2' ' HA3' ' B' ' 15' ' ' GLY . . . -94.73 76.04 3.69 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.435 1.094 . . . . 0.0 111.913 -177.22 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.519 ' CG ' ' HE ' ' A' ' 23' ' ' ARG . 1.4 t70 -164.27 140.34 5.0 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 126.62 1.968 . . . . 0.0 111.239 -173.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -51.84 -60.59 0.72 Allowed 'Trans proline' 0 C--N 1.353 0.81 1 C-N-CA 125.463 4.109 . . . . 0.0 112.97 -171.087 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.9 m -79.15 -31.36 44.02 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 119.425 -0.321 . . . . 0.0 110.566 -173.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.519 ' HE ' ' CG ' ' A' ' 20' ' ' ASP . 67.1 mtm180 -69.23 -33.56 73.48 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 116.241 -1.838 . . . . 0.0 113.633 -173.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 44.5 t -57.67 -55.21 37.79 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 121.185 1.812 . . . . 0.0 110.29 168.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 44.3 mtt180 -45.2 -45.33 11.63 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.221 1.408 . . . . 0.0 112.998 169.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.5 mt -62.4 -58.41 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 CA-C-N 120.181 1.355 . . . . 0.0 111.156 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.13 -44.86 79.57 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.967 0.907 . . . . 0.0 110.883 -175.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.4 p -79.2 -29.39 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 124.496 1.118 . . . . 0.0 112.374 -174.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.73 -35.11 30.08 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 122.893 0.477 . . . . 0.0 112.022 175.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.506 ' O ' HG13 ' A' ' 34' ' ' VAL . 13.2 tp -67.29 -32.14 72.93 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 116.733 -1.603 . . . . 0.0 112.37 172.648 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -41.67 -45.31 3.39 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.431 1.892 . . . . 0.0 112.579 -178.406 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -99.9 -26.22 14.08 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.524 1.93 . . . . 0.0 112.724 169.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -83.01 -3.7 90.33 Favored Glycine 0 C--N 1.339 0.74 0 CA-C-O 116.591 -2.227 . . . . 0.0 117.101 -168.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.506 HG13 ' O ' ' A' ' 30' ' ' LEU . 16.7 m -29.91 45.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.663 1 C-N-CA 132.087 4.155 . . . . 0.0 120.564 171.445 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 2.4 t -107.78 -51.88 2.84 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 119.369 -2.082 . . . . 0.0 113.203 -175.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.3 p90 -158.24 157.78 29.34 Favored Pre-proline 0 N--CA 1.477 0.882 0 N-CA-C 115.347 1.61 . . . . 0.0 115.347 -178.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -55.83 128.77 31.67 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.223 1.949 . . . . 0.0 108.214 169.05 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.69 -3.61 68.36 Favored Glycine 0 CA--C 1.531 1.086 0 CA-C-O 116.639 -2.201 . . . . 0.0 115.413 -176.097 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.94 -37.3 63.72 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 121.475 2.638 . . . . 0.0 110.841 170.702 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 20.5 mt -53.14 -28.99 28.71 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 127.144 2.178 . . . . 0.0 112.488 176.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.79 -32.62 70.78 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 118.427 0.558 . . . . 0.0 110.89 -179.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.82 -45.62 27.96 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.687 0.795 . . . . 0.0 112.092 174.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 30.3 m170 -58.8 -32.66 69.54 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 175.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 16.0 mt -102.37 -26.86 13.13 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -173.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.41 1.79 66.1 Favored Glycine 0 CA--C 1.533 1.215 0 CA-C-N 119.503 1.047 . . . . 0.0 113.975 -170.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.9 mp -99.52 147.44 25.31 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.104 0.952 . . . . 0.0 109.663 177.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 70.4 p -59.23 151.95 21.87 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.305 1.442 . . . . 0.0 111.184 -169.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.14 -20.34 57.94 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.308 171.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.3 m -73.62 -55.29 6.48 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.232 -0.918 . . . . 0.0 110.805 169.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -53.08 -56.45 16.11 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.402 1.081 . . . . 0.0 110.898 178.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 69.3 t -65.96 -24.5 34.11 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 O-C-N 120.904 -1.122 . . . . 0.0 112.428 -177.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.7 m -71.05 -36.69 72.42 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 120.54 1.518 . . . . 0.0 113.657 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -52.99 -50.48 64.1 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.675 0.79 . . . . 0.0 110.4 169.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -63.84 -36.06 82.68 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.381 1.073 . . . . 0.0 113.688 178.129 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 21.3 mt -72.51 -31.56 65.44 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 117.841 -1.076 . . . . 0.0 113.533 174.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.89 -46.7 43.08 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.821 1.191 . . . . 0.0 112.876 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 4.0 t -78.9 -35.63 43.28 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-O 121.601 0.715 . . . . 0.0 112.093 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.6 tp -59.61 -38.44 81.29 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.738 1.215 . . . . 0.0 112.332 178.017 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 45.2 mtm105 -77.47 -30.0 52.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.372 1.069 . . . . 0.0 112.467 177.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.475 ' HA3' ' HB2' ' B' ' 104' ' ' ALA . . . -90.33 -40.39 5.76 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 124.59 1.091 . . . . 0.0 114.769 -173.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 69.9 m -71.6 -9.75 58.71 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 124.116 0.966 . . . . 0.0 111.828 171.077 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 91.17 20.76 37.67 Favored Glycine 0 C--N 1.344 0.976 0 C-N-CA 125.472 1.511 . . . . 0.0 115.851 168.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.3 mt -86.6 -23.09 25.87 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.622 1.711 . . . . 0.0 114.799 178.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.5 m -127.97 148.49 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 124.728 1.211 . . . . 0.0 111.214 169.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 25.6 t -137.45 148.96 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.383 1.473 . . . . 0.0 109.8 -178.077 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.97 160.88 30.06 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.262 1.425 . . . . 0.0 113.814 173.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.2 m -163.24 167.8 21.48 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.392 1.877 . . . . 0.0 108.426 173.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -101.68 121.19 41.58 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 165.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.27 -13.25 59.36 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -178.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 133.37 -26.01 3.57 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 125.762 1.648 . . . . 0.0 113.958 173.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 48.5 ttt-85 -132.62 -10.75 3.14 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.395 1.878 . . . . 0.0 112.737 172.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -148.79 160.05 43.57 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.892 2.077 . . . . 0.0 111.304 -177.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 23.4 m -82.91 145.0 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 O-C-N 121.44 -0.787 . . . . 0.0 109.757 168.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.1 ptt180 -131.2 165.62 22.93 Favored 'General case' 0 CA--C 1.518 -0.275 0 C-N-CA 124.769 1.228 . . . . 0.0 110.408 -172.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -107.65 148.64 29.1 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 163.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.436 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -147.67 156.97 43.32 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 123.397 0.679 . . . . 0.0 110.146 174.567 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tp -53.96 144.79 18.06 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 123.542 0.526 . . . . 0.0 110.172 170.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.97 -20.12 64.17 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 116.083 1.883 . . . . 0.0 116.083 -170.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -168.97 164.03 11.47 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.711 1.604 . . . . 0.0 112.367 173.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 50.7 m -51.49 -30.14 18.99 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.845 2.058 . . . . 0.0 112.574 168.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -52.82 -58.24 7.57 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 126.643 1.977 . . . . 0.0 112.334 171.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 19.1 mt -64.21 -44.19 92.7 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 177.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -56.94 -34.3 67.87 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 125.068 1.347 . . . . 0.0 111.444 -175.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.1 ttm-85 -74.22 -57.7 3.78 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 116.685 -1.626 . . . . 0.0 112.092 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.26 -22.91 64.73 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 122.103 2.229 . . . . 0.0 113.33 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 54.5 tp -71.64 -45.52 61.81 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.425 1.89 . . . . 0.0 110.69 168.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.53 -36.24 12.52 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 126.147 1.832 . . . . 0.0 115.088 -171.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -77.91 -5.51 51.32 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.34 1.456 . . . . 0.0 112.777 176.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 25.9 tp 60.79 89.46 0.07 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.657 2.383 . . . . 0.0 113.484 168.303 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.3 m -41.37 150.42 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 125.194 1.398 . . . . 0.0 112.4 176.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -72.0 2.9 4.94 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 -159.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.7 p -66.45 35.39 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 126.289 1.836 . . . . 0.0 114.221 174.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 61.08 20.01 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 126.396 1.879 . . . . 0.0 113.544 169.493 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 tt 94.93 106.96 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 129.337 3.055 . . . . 0.0 106.513 -167.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.79 89.5 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.97 0.908 . . . . 0.0 111.667 170.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.0 t -63.43 135.57 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 125.201 1.4 . . . . 0.0 110.266 171.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -62.57 6.26 0.1 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 127.547 2.339 . . . . 0.0 115.065 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.6 138.09 58.09 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 122.307 1.051 . . . . 0.0 110.612 176.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -92.92 153.6 18.69 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 113.438 -1.71 . . . . 0.0 107.595 164.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -161.16 136.17 5.55 Favored Pre-proline 0 N--CA 1.447 -0.575 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 174.127 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -60.59 165.34 11.64 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 121.331 1.354 . . . . 0.0 109.886 169.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 46.3 t -74.79 -129.79 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.143 0 CA-C-O 122.647 1.213 . . . . 0.0 110.189 170.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 27.4 t 76.19 -45.51 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 128.811 2.844 . . . . 0.0 113.341 168.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . 123.6 1.72 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 131.003 3.721 . . . . 0.0 113.748 177.041 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.6 -176.82 1.08 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.835 0.854 . . . . 0.0 112.133 174.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.473 0.679 0 C-N-CA 123.91 0.884 . . . . 0.0 109.111 169.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.401 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 pp -70.3 -23.78 62.91 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 176.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.93 -55.27 27.4 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.95 0.9 . . . . 0.0 109.982 169.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 24.5 ttm180 -60.07 -40.13 88.44 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 177.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -53.54 -59.27 4.81 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.451 1.1 . . . . 0.0 110.416 176.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' GLY . . . . . 0.436 ' HA3' ' HB2' ' A' ' 19' ' ' ALA . . . -73.26 -21.1 79.99 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-O 118.739 -1.034 . . . . 0.0 113.689 -177.3 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.83 -18.11 53.73 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 126.465 1.906 . . . . 0.0 114.179 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -123.83 -7.58 7.87 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 177.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 3.1 mt -87.56 -37.08 17.17 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 119.429 1.013 . . . . 0.0 110.911 167.113 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.6 77.45 5.67 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.647 1.179 . . . . 0.0 111.676 -177.756 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -163.78 139.16 4.97 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 125.219 1.408 . . . . 0.0 111.598 -171.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -51.46 -50.26 14.5 Favored 'Trans proline' 0 C--N 1.353 0.8 1 C-N-CA 125.677 4.251 . . . . 0.0 114.117 -172.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 45.7 m -91.83 -32.96 15.14 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 119.394 -0.336 . . . . 0.0 110.52 -172.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 74.1 mtm180 -68.74 -34.21 75.22 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 116.571 -1.68 . . . . 0.0 112.691 -177.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 45.9 t -55.13 -55.51 30.32 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 120.755 1.616 . . . . 0.0 110.637 168.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -48.07 -52.27 20.96 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.126 1.37 . . . . 0.0 112.47 172.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.5 mt -51.12 -58.83 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 CA-C-N 119.424 1.011 . . . . 0.0 111.234 174.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 93.4 mt -63.37 -41.84 98.82 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.222 1.009 . . . . 0.0 111.176 -169.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.7 p -75.98 -26.72 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.226 0.611 . . . . 0.0 112.399 178.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.61 -39.09 67.56 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 118.793 -0.622 . . . . 0.0 111.039 169.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.494 ' O ' HG13 ' B' ' 34' ' ' VAL . 2.1 tp -65.32 -26.62 68.13 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 -176.336 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 7.8 mt -45.95 -26.51 0.72 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 125.959 1.704 . . . . 0.0 112.205 168.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -113.64 -31.65 6.42 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 127.658 2.383 . . . . 0.0 111.522 167.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -82.51 15.57 29.26 Favored Glycine 0 C--N 1.335 0.477 0 C-N-CA 129.775 3.559 . . . . 0.0 115.204 -166.049 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 34' ' ' VAL . . . . . 0.494 HG13 ' O ' ' B' ' 30' ' ' LEU . 26.1 m -60.15 28.75 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.038 0 C-N-CA 126.111 1.765 . . . . 0.0 115.565 167.063 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.6 -73.11 0.46 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.434 1.494 . . . . 0.0 111.528 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -159.07 157.35 27.86 Favored Pre-proline 0 N--CA 1.474 0.726 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -169.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -57.29 121.27 9.76 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.628 2.218 . . . . 0.0 109.046 173.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.91 -5.66 83.2 Favored Glycine 0 CA--C 1.531 1.071 0 CA-C-O 117.572 -1.682 . . . . 0.0 115.024 -175.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 39' ' ' GLN . . . . . 0.536 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -57.67 -35.11 70.13 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 120.942 2.371 . . . . 0.0 111.402 172.114 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 23.0 mt -56.96 -25.33 57.69 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 125.216 1.406 . . . . 0.0 111.928 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.85 -32.75 73.12 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 121.883 -0.51 . . . . 0.0 111.461 -174.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.11 -49.12 18.26 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.486 0.714 . . . . 0.0 111.543 172.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 43' ' ' HIS . . . . . 0.536 ' CD2' HE22 ' B' ' 39' ' ' GLN . 2.8 m-70 -56.18 -32.92 64.78 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.217 1.191 . . . . 0.0 114.217 178.187 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 14.1 mt -104.02 -23.87 13.28 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.624 1.17 . . . . 0.0 113.118 -173.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.18 -6.67 49.24 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.533 1.063 . . . . 0.0 114.1 -171.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 10.6 mp -93.19 156.39 16.87 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.44 1.096 . . . . 0.0 109.539 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 71.2 p -71.91 154.7 41.05 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 122.448 1.118 . . . . 0.0 111.745 -170.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 -56.68 -25.34 53.68 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.099 169.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 15.3 m -71.82 -58.28 3.6 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.657 1.183 . . . . 0.0 110.633 169.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -53.27 -58.12 8.17 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.831 1.252 . . . . 0.0 111.676 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 88.7 t -63.33 -22.09 29.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 121.363 -0.836 . . . . 0.0 111.575 -175.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 50.1 m -68.69 -36.32 78.33 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 119.87 1.213 . . . . 0.0 113.93 178.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -56.72 -47.14 80.63 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.98 0.809 . . . . 0.0 111.61 169.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -63.69 -32.24 73.66 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.092 0.957 . . . . 0.0 112.621 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 43.4 mt -75.87 -32.92 59.93 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.084 1.354 . . . . 0.0 113.628 172.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 19.4 m -54.61 -39.02 67.47 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 120.292 1.405 . . . . 0.0 113.323 177.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 42.1 t -69.18 -47.86 63.76 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.524 1.056 . . . . 0.0 112.132 171.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.3 tp -58.25 -37.82 75.67 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.359 1.464 . . . . 0.0 112.0 -171.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 34.3 mtm105 -83.12 -7.03 59.69 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.842 1.657 . . . . 0.0 113.774 178.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -106.6 -37.95 2.32 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 125.558 1.551 . . . . 0.0 114.414 177.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 22.5 m -73.75 -13.54 60.97 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 124.928 1.291 . . . . 0.0 112.288 172.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.33 20.14 42.89 Favored Glycine 0 C--N 1.341 0.837 0 CA-C-O 118.355 -1.247 . . . . 0.0 114.572 172.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.05 -24.09 30.6 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 119.626 1.713 . . . . 0.0 113.825 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 3.5 m -127.72 147.28 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 124.336 1.054 . . . . 0.0 113.003 171.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 24.2 t -130.0 143.05 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.373 1.869 . . . . 0.0 110.808 -176.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.02 152.34 27.98 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.787 1.635 . . . . 0.0 112.936 174.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.9 m -161.02 172.26 17.2 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.393 1.477 . . . . 0.0 109.075 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -100.99 126.05 47.63 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 165.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.34 -14.38 59.02 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 177.189 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 136.12 -26.77 3.08 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 126.201 1.858 . . . . 0.0 114.0 175.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 51.5 ttt-85 -136.42 -6.9 1.99 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.809 2.044 . . . . 0.0 112.977 174.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -150.36 160.23 43.88 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.17 2.188 . . . . 0.0 110.749 -178.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 33.6 m -82.4 148.02 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 O-C-N 121.509 -0.745 . . . . 0.0 110.565 169.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 3.0 ptt180 -132.52 167.99 19.02 Favored 'General case' 0 C--O 1.231 0.116 0 C-N-CA 125.43 1.492 . . . . 0.0 110.745 -171.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -112.16 160.58 17.44 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 164.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -160.28 150.61 18.37 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 120.742 -1.224 . . . . 0.0 111.257 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -49.94 129.65 20.71 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 169.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.23 0.41 2.8 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 -168.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -179.61 161.74 1.05 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 128.123 2.569 . . . . 0.0 110.644 169.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 43.4 m -48.35 -29.99 4.49 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.573 1.549 . . . . 0.0 111.797 168.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -49.08 -53.78 18.96 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 126.226 1.811 . . . . 0.0 113.526 171.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 13.3 mt -79.45 -41.41 27.62 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.919 -0.562 . . . . 0.0 109.818 -175.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.9 -36.11 59.03 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.033 0.533 . . . . 0.0 111.952 170.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 34.5 ttm-85 -75.93 -61.04 2.06 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-O 116.719 -1.61 . . . . 0.0 112.836 174.663 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.04 -20.74 66.28 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 122.5 2.409 . . . . 0.0 113.384 -176.161 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.15 -53.54 8.14 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.672 -0.643 . . . . 0.0 109.28 166.657 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.98 -28.36 70.65 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.374 1.464 . . . . 0.0 115.574 -171.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -78.38 -6.76 56.12 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.681 1.24 . . . . 0.0 112.051 169.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 30.6 tp 60.67 86.36 0.1 Allowed 'General case' 0 C--N 1.345 0.394 0 C-N-CA 127.623 2.369 . . . . 0.0 113.565 167.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.2 m -43.36 147.59 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 CA-C-O 122.667 1.222 . . . . 0.0 112.986 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 91' ' ' GLN . . . . . 0.481 ' C ' ' H ' ' B' ' 93' ' ' VAL . 20.1 mm-40 -68.54 6.62 0.78 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 117.021 2.23 . . . . 0.0 117.021 -163.054 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 6.1 p -66.28 32.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 126.476 1.911 . . . . 0.0 113.243 169.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 93' ' ' VAL . . . . . 0.481 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.4 OUTLIER 63.16 11.63 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 128.6 2.76 . . . . 0.0 114.359 171.499 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.6 tt 102.05 107.62 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 130.519 3.528 . . . . 0.0 105.35 -167.055 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.11 84.28 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.617 1.167 . . . . 0.0 111.812 174.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 4.5 t -55.86 133.15 19.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.138 0.975 . . . . 0.0 109.618 174.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -60.67 12.06 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 127.732 2.413 . . . . 0.0 115.578 176.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 29.8 p -67.27 135.89 54.07 Favored 'General case' 0 CA--C 1.519 -0.241 0 O-C-N 121.157 -0.964 . . . . 0.0 110.654 173.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -99.56 136.02 40.11 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 166.12 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.57 139.67 10.92 Favored Pre-proline 0 C--N 1.32 -0.702 0 N-CA-C 104.318 -2.475 . . . . 0.0 104.318 173.328 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -73.88 -173.12 1.28 Allowed 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.469 2.113 . . . . 0.0 112.059 -169.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 6.5 t -87.92 -161.51 0.73 Allowed 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 124.44 1.096 . . . . 0.0 111.695 177.064 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.6 t 62.58 32.99 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 125.434 1.494 . . . . 0.0 111.88 169.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 104' ' ' ALA . . . . . 0.475 ' HB2' ' HA3' ' A' ' 60' ' ' GLY . . . 71.38 -15.43 0.42 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 118.029 2.603 . . . . 0.0 118.029 169.543 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.55 179.74 0.15 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.306 1.842 . . . . 0.0 115.182 -170.68 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.472 0.641 0 O-C-N 121.307 -0.87 . . . . 0.0 111.556 170.36 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.616 0 CA-C-O 119.378 -0.344 . . . . 0.0 110.893 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.557 HD23 ' H ' ' A' ' 12' ' ' ALA . 1.1 pt? -51.67 -49.67 61.91 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 -169.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.557 ' H ' HD23 ' A' ' 11' ' ' LEU . . . -67.25 -18.72 65.34 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.661 1.584 . . . . 0.0 113.468 177.821 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.473 HH11 ' HG2' ' A' ' 13' ' ' ARG . 0.2 OUTLIER -86.11 -42.81 13.58 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.052 0.842 . . . . 0.0 109.421 167.738 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.55 -46.41 82.94 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.623 1.569 . . . . 0.0 112.25 -171.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.96 -18.39 68.7 Favored Glycine 0 CA--C 1.535 1.333 0 O-C-N 121.182 -0.949 . . . . 0.0 113.073 172.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 81.6 mtp180 -99.16 29.84 3.72 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 127.546 2.339 . . . . 0.0 111.314 170.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.93 -35.47 0.57 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.463 1.905 . . . . 0.0 111.898 169.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mt -95.78 -39.38 9.88 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 178.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -96.26 54.35 1.41 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.656 1.116 . . . . 0.0 109.54 170.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -132.42 138.28 31.82 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 126.933 2.093 . . . . 0.0 108.202 -168.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -52.61 -98.35 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.809 1 C-N-CA 126.66 4.907 . . . . 0.0 115.789 -164.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.95 -27.82 63.76 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 125.571 1.548 . . . . 0.0 111.799 175.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.39 -36.04 63.5 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -174.169 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 14.1 t -65.85 -38.0 87.7 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.519 -1.363 . . . . 0.0 109.921 167.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -57.52 -38.55 74.84 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.056 0.942 . . . . 0.0 112.964 169.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.9 mm -62.11 -49.52 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 O-C-N 120.717 -1.24 . . . . 0.0 110.997 170.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.4 mt -58.61 -48.46 80.9 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.246 0.475 . . . . 0.0 112.157 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.2 p -68.51 -20.39 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 118.986 0.812 . . . . 0.0 112.782 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.51 -16.84 60.24 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.351 1.061 . . . . 0.0 113.069 171.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.432 HD23 ' CG1' ' A' ' 64' ' ' VAL . 0.0 OUTLIER -93.39 -13.55 27.91 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 170.977 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.92 -20.92 64.3 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.211 163.448 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -116.99 -60.39 1.85 Allowed 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 127.456 2.302 . . . . 0.0 115.205 -177.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.37 -83.05 0.43 Allowed Glycine 0 C--N 1.343 0.948 0 C-N-CA 124.989 1.281 . . . . 0.0 114.313 -165.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.8 m 49.58 30.96 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 125.288 1.435 . . . . 0.0 113.768 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.6 m -77.81 -66.52 0.83 Allowed 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 178.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -140.88 156.63 68.57 Favored Pre-proline 0 C--O 1.238 0.465 0 CA-C-O 118.665 -0.683 . . . . 0.0 112.124 -169.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -59.13 115.37 2.52 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 122.509 2.139 . . . . 0.0 109.128 169.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 95.93 -0.88 62.84 Favored Glycine 0 CA--C 1.531 1.084 0 CA-C-O 117.552 -1.693 . . . . 0.0 115.93 -178.339 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.23 -30.47 71.53 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.949 2.374 . . . . 0.0 112.317 172.139 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.74 HD12 ' H ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -56.5 -22.65 34.11 Favored 'General case' 0 C--O 1.222 -0.346 0 C-N-CA 124.431 1.093 . . . . 0.0 111.61 177.833 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.25 -36.99 79.03 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.482 0.713 . . . . 0.0 112.322 176.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.45 -38.06 74.43 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.372 0.533 . . . . 0.0 111.436 175.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -64.57 -38.12 89.92 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 175.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 32.9 mt -99.69 -14.67 18.82 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -172.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 64.8 25.36 70.49 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-O 118.717 -1.046 . . . . 0.0 112.281 -169.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 67.4 mt -126.95 134.53 50.38 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.266 1.027 . . . . 0.0 112.223 -176.212 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.3 p -50.18 156.81 0.75 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.101 1.36 . . . . 0.0 114.311 -168.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.6 ttm180 -53.24 -26.16 16.96 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.07 -1.423 . . . . 0.0 112.049 169.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.6 m -80.04 -47.23 15.2 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.063 -1.023 . . . . 0.0 111.778 175.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -60.07 -52.61 64.62 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.481 1.112 . . . . 0.0 110.266 176.012 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.4 t -58.84 -38.92 75.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 121.018 -1.051 . . . . 0.0 111.955 176.029 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 74.9 m -64.69 -39.72 94.15 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.916 1.234 . . . . 0.0 113.31 174.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -56.51 -52.55 64.32 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.676 0.79 . . . . 0.0 110.771 174.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 20.0 m80 -61.22 -39.77 91.53 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 48.7 mt -68.09 -25.85 65.53 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.171 -0.919 . . . . 0.0 112.968 175.113 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.4 t -59.42 -56.82 17.23 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 120.705 1.593 . . . . 0.0 113.637 -168.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 30.8 t -67.95 -28.78 67.76 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 122.209 -0.307 . . . . 0.0 111.764 172.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.4 tp -60.78 -35.42 76.4 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.915 0.886 . . . . 0.0 111.647 177.176 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 87.0 mtm-85 -74.83 -28.98 60.91 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.188 0.995 . . . . 0.0 112.026 172.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.39 -50.31 6.76 Favored Glycine 0 N--CA 1.472 1.072 0 CA-C-N 119.357 0.981 . . . . 0.0 113.129 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 18.2 m -67.53 -2.01 5.89 Favored 'General case' 0 CA--C 1.562 1.423 0 C-N-CA 126.826 2.05 . . . . 0.0 111.444 168.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.32 -0.62 16.23 Favored Glycine 0 C--N 1.343 0.959 0 C-N-CA 126.884 2.183 . . . . 0.0 115.191 173.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 77.5 mt -53.27 -25.67 15.39 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.13 1.772 . . . . 0.0 112.667 179.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.432 ' CG1' HD23 ' A' ' 30' ' ' LEU . 3.3 m -123.91 153.31 29.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 126.718 2.007 . . . . 0.0 109.641 164.045 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -142.32 155.28 18.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 C-N-CA 126.77 2.028 . . . . 0.0 109.891 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.6 151.93 28.8 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 122.706 1.241 . . . . 0.0 111.009 171.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.624 HG22 ' H ' ' A' ' 68' ' ' TYR . 8.0 m -158.11 -170.85 3.28 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 127.008 2.123 . . . . 0.0 105.959 173.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.624 ' H ' HG22 ' A' ' 67' ' ' THR . 47.6 m-85 -120.91 157.99 28.66 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 119.773 1.17 . . . . 0.0 113.418 174.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -110.49 -151.45 0.48 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 126.641 1.976 . . . . 0.0 109.414 167.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.48 -12.49 56.22 Favored Glycine 0 CA--C 1.539 1.562 0 O-C-N 120.027 -1.671 . . . . 0.0 116.332 -172.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -164.54 -28.71 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.644 1.577 . . . . 0.0 113.307 173.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -99.48 170.64 8.47 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.801 1.64 . . . . 0.0 110.405 -177.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 26.0 m -80.81 160.87 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 O-C-N 121.92 -0.488 . . . . 0.0 111.54 168.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -126.61 171.78 10.83 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.394 1.877 . . . . 0.0 110.455 175.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -123.87 121.96 36.72 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.214 1.406 . . . . 0.0 107.963 167.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.13 167.53 17.44 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.866 1.266 . . . . 0.0 111.552 177.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 69.7 mt -60.61 156.7 15.98 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.573 0.749 . . . . 0.0 111.765 172.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.22 -51.36 68.35 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 125.948 1.699 . . . . 0.0 113.846 179.288 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -164.27 173.55 12.18 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 123.683 1.706 . . . . 0.0 114.258 -167.121 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 43.2 t -47.18 -42.42 19.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 113.168 -1.833 . . . . 0.0 113.308 170.092 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 55.9 m-70 -63.97 -42.47 97.25 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 116.938 -1.506 . . . . 0.0 113.478 -178.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 10.2 mt -71.9 -45.14 62.3 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 121.188 1.813 . . . . 0.0 109.846 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.99 -35.65 59.44 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.814 0.846 . . . . 0.0 111.782 175.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.401 ' HE ' ' CD ' ' A' ' 88' ' ' GLU . 0.4 OUTLIER -70.86 -67.27 0.52 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 128.398 2.679 . . . . 0.0 112.661 175.532 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.74 -30.25 70.43 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -173.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.04 -39.57 60.92 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.723 -0.611 . . . . 0.0 109.642 169.394 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -57.61 -45.06 93.64 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 125.897 1.713 . . . . 0.0 114.347 -178.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.401 ' CD ' ' HE ' ' A' ' 84' ' ' ARG . 2.0 pt-20 -87.84 3.76 47.09 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 174.259 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 39.0 tp 73.5 143.2 0.07 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 129.3 3.04 . . . . 0.0 111.64 177.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 31.2 m -38.25 -20.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 128.992 2.917 . . . . 0.0 116.367 176.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 86.82 -35.83 0.03 OUTLIER 'General case' 0 C--O 1.218 -0.594 0 C-N-CA 126.232 1.813 . . . . 0.0 108.963 161.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.521 HG21 ' CD2' ' B' ' 14' ' ' LEU . 8.7 p -62.62 36.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 128.915 2.886 . . . . 0.0 114.677 168.105 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.5 t 79.07 -25.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 128.7 2.8 . . . . 0.0 113.027 170.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 tt 110.59 99.05 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.636 1 C-N-CA 132.57 4.348 . . . . 0.0 104.582 -169.028 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.99 133.84 56.48 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 119.309 -0.377 . . . . 0.0 110.968 -178.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.1 t -74.76 137.14 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -166.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -60.68 -23.04 64.53 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.26 1.424 . . . . 0.0 114.72 173.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 59.0 p -64.82 117.08 7.01 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.382 1.073 . . . . 0.0 109.098 176.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -69.46 12.77 0.16 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.083 2.153 . . . . 0.0 114.447 -175.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 -74.16 159.29 84.21 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 125.674 1.59 . . . . 0.0 113.424 -167.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.85 135.92 43.23 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.376 2.718 . . . . 0.0 110.965 169.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 20.5 p -55.75 -45.59 78.0 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.833 0.853 . . . . 0.0 110.816 168.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 7.7 p 167.06 -31.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 131.329 3.852 . . . . 0.0 111.513 175.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.32 7.44 2.83 Favored 'General case' 0 CA--C 1.552 1.05 0 N-CA-C 115.262 1.578 . . . . 0.0 115.262 -174.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -142.66 162.0 36.61 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 127.246 2.218 . . . . 0.0 108.744 -177.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.581 0 O-C-N 121.161 -0.962 . . . . 0.0 111.346 169.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.508 0 CA-C-O 119.623 -0.227 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.551 HD23 ' H ' ' B' ' 12' ' ' ALA . 1.2 pt? -50.12 -53.32 28.22 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.687 1.195 . . . . 0.0 113.65 -171.576 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.551 ' H ' HD23 ' B' ' 11' ' ' LEU . . . -63.29 -21.9 66.54 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.541 1.536 . . . . 0.0 114.202 176.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 13' ' ' ARG . . . . . 0.534 HH11 ' HG2' ' B' ' 13' ' ' ARG . 1.3 mmt-85 -84.03 -41.11 17.58 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 119.607 1.094 . . . . 0.0 111.723 170.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.521 ' CD2' HG21 ' A' ' 92' ' ' VAL . 3.1 tm? -57.98 -52.73 64.31 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.709 1.604 . . . . 0.0 111.114 177.532 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.39 -22.48 69.45 Favored Glycine 0 CA--C 1.533 1.177 0 O-C-N 121.884 -0.51 . . . . 0.0 112.715 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 72.3 mtp180 -87.47 14.05 8.89 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 126.212 1.805 . . . . 0.0 112.508 173.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -125.19 -37.58 2.39 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.845 1.258 . . . . 0.0 112.354 168.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 24.5 mt -88.88 -25.75 21.97 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.541 -1.218 . . . . 0.0 113.078 178.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -115.9 55.16 0.8 Allowed 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 120.977 1.717 . . . . 0.0 110.705 168.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -133.43 143.9 49.99 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 127.587 2.355 . . . . 0.0 106.678 -174.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -57.54 -98.98 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.945 1 C-N-CA 125.698 4.266 . . . . 0.0 115.7 -163.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 1.3 p -53.08 -32.92 49.69 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.515 1.926 . . . . 0.0 112.42 172.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.84 -43.85 62.12 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.687 0.795 . . . . 0.0 112.906 -170.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 46.8 t -63.38 -39.26 94.04 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.193 0.906 . . . . 0.0 109.455 168.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -55.92 -33.24 64.5 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 120.582 -1.324 . . . . 0.0 113.973 171.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' ILE . . . . . 0.411 HG23 HD13 ' B' ' 40' ' ' LEU . 1.6 mm -62.06 -48.76 86.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 CA-C-N 120.23 1.377 . . . . 0.0 110.061 169.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 89.6 mt -58.56 -45.01 89.86 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.957 0.799 . . . . 0.0 112.066 176.222 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' VAL . . . . . 0.678 HG22 HD21 ' B' ' 86' ' ' LEU . 51.8 t -61.38 -47.25 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 126.424 1.889 . . . . 0.0 110.847 179.111 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.52 -36.21 63.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.89 0.876 . . . . 0.0 112.298 -177.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 16.6 tp -66.17 -35.35 80.24 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 117.486 -1.245 . . . . 0.0 112.103 -178.023 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -37.14 -45.71 0.64 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 129.492 3.117 . . . . 0.0 113.91 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -105.34 -16.96 14.6 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.065 1.746 . . . . 0.0 113.165 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.28 -71.42 1.23 Allowed Glycine 0 C--N 1.341 0.85 0 C-N-CA 124.658 1.123 . . . . 0.0 112.329 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 34' ' ' VAL . . . . . 0.454 HG12 ' HA ' ' B' ' 76' ' ' ALA . 34.6 m 33.45 36.43 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 -170.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.93 -76.27 0.3 Allowed 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.357 -0.84 . . . . 0.0 111.553 -177.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -145.74 158.15 50.11 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-O 118.648 -0.692 . . . . 0.0 112.82 -168.175 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -58.62 123.14 12.91 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.919 2.413 . . . . 0.0 110.162 172.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 88.19 -3.83 85.52 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 117.575 -1.68 . . . . 0.0 115.449 -174.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -32.82 71.08 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 120.493 2.146 . . . . 0.0 111.87 174.091 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.411 HD13 HG23 ' B' ' 26' ' ' ILE . 2.1 mt -59.52 -15.74 20.05 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 123.716 0.806 . . . . 0.0 112.246 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.9 -41.76 87.98 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.57 0.623 . . . . 0.0 111.159 175.097 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -75.57 -30.35 59.63 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.512 0.725 . . . . 0.0 112.418 176.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -69.01 -33.97 74.5 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 171.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 23.9 mt -106.59 -14.57 15.01 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -170.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.33 16.95 69.85 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-N 119.136 0.88 . . . . 0.0 113.008 -169.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 36.7 mt -117.65 139.63 50.74 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 118.506 1.153 . . . . 0.0 111.6 -175.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.2 p -59.67 161.68 5.92 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.388 0.675 . . . . 0.0 111.933 -172.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 20.7 ttm180 -58.61 -29.08 66.2 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 122.056 -0.403 . . . . 0.0 111.938 175.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 20.3 m -69.81 -46.07 66.5 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.386 0.994 . . . . 0.0 111.622 175.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -61.94 -55.19 32.02 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 122.821 0.449 . . . . 0.0 110.128 173.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.8 t -56.26 -40.73 67.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 121.002 -1.061 . . . . 0.0 112.976 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 49.7 m -66.17 -37.93 86.83 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.663 1.12 . . . . 0.0 112.865 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -55.54 -49.97 71.25 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.93 0.786 . . . . 0.0 110.89 172.193 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 20.6 m80 -64.17 -37.44 87.45 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 26.1 mt -73.27 -27.33 61.5 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 117.599 -1.191 . . . . 0.0 113.441 175.382 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.1 t -50.65 -63.71 1.04 Allowed 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.293 0.951 . . . . 0.0 112.608 -169.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.7 t -66.76 -33.79 76.41 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.541 0.736 . . . . 0.0 111.66 174.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 3.6 tp -53.34 -33.92 55.46 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.29 1.036 . . . . 0.0 112.47 178.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 79.9 mtm-85 -83.16 -21.54 33.51 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 173.278 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -80.73 -47.43 6.71 Favored Glycine 0 N--CA 1.475 1.273 0 CA-C-N 120.228 1.376 . . . . 0.0 111.825 176.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 3.3 m -62.93 -11.29 17.6 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.961 2.104 . . . . 0.0 112.388 168.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 59.65 28.09 64.83 Favored Glycine 0 C--N 1.345 1.083 0 C-N-CA 125.818 1.675 . . . . 0.0 113.477 -178.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 93.0 mt -73.15 -24.73 60.62 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 117.918 0.859 . . . . 0.0 111.167 168.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 4.5 m -130.28 159.68 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 C-N-CA 126.108 1.763 . . . . 0.0 110.284 168.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -145.5 155.44 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 126.016 1.726 . . . . 0.0 110.266 -172.544 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.28 150.77 24.55 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.073 1.349 . . . . 0.0 111.53 172.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 10.6 m -158.99 168.83 25.74 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 176.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -102.67 142.62 33.51 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.349 0.977 . . . . 0.0 111.197 168.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.261 1.6 pp20? -99.52 -155.74 0.52 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.35 1.06 . . . . 0.0 109.435 166.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -67.09 -14.95 64.49 Favored Glycine 0 CA--C 1.535 1.341 0 O-C-N 120.176 -1.577 . . . . 0.0 115.46 -171.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -159.19 -20.85 0.07 Allowed 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.95 1.375 . . . . 0.0 114.433 174.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -111.93 162.36 15.41 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.975 2.11 . . . . 0.0 110.994 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 17.6 m -82.1 152.4 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 O-C-N 121.468 -0.77 . . . . 0.0 109.377 167.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -129.15 168.67 15.8 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 122.594 1.188 . . . . 0.0 109.643 -178.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -113.16 148.2 35.86 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 164.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.454 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -149.55 157.8 43.6 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.307 1.043 . . . . 0.0 110.285 176.099 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -53.14 151.83 4.73 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.988 0.915 . . . . 0.0 110.651 168.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -49.66 -52.35 31.47 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.535 1.134 . . . . 0.0 113.775 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.35 179.81 3.76 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 122.818 1.294 . . . . 0.0 113.896 -167.115 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 24.5 t -49.3 -43.96 43.76 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.054 -1.43 . . . . 0.0 113.25 170.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -62.06 -48.42 80.31 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 117.664 -1.16 . . . . 0.0 112.926 -178.525 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 15.8 mt -68.72 -38.89 80.54 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 120.615 1.552 . . . . 0.0 109.954 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.35 -32.24 73.61 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.535 0.607 . . . . 0.0 110.994 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -69.56 -70.13 0.3 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 128.462 2.705 . . . . 0.0 110.936 171.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.72 -33.44 61.08 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 120.803 1.638 . . . . 0.0 114.555 -178.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.678 HD21 HG22 ' B' ' 28' ' ' VAL . 1.4 tt -77.65 -39.93 43.41 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 121.322 -0.861 . . . . 0.0 111.123 173.077 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.12 -46.77 90.23 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.634 1.588 . . . . 0.0 114.41 -173.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 12.8 pm0 -84.08 -0.49 52.05 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 119.255 1.528 . . . . 0.0 113.499 168.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 33.8 tp 72.85 135.35 0.05 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 129.563 3.145 . . . . 0.0 111.504 177.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 97.5 t -62.79 8.62 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 129.225 3.01 . . . . 0.0 113.716 -176.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 93.4 -35.85 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.611 -1.306 . . . . 0.0 110.82 129.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 7.7 p -56.48 35.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.043 1 C-N-CA 132.628 4.371 . . . . 0.0 115.626 171.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER 67.15 6.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.876 0 C-N-CA 126.698 1.999 . . . . 0.0 112.836 176.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 tt 78.54 105.4 0.07 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.762 2.425 . . . . 0.0 107.631 -168.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.92 128.02 35.01 Favored 'General case' 0 CA--C 1.551 1.007 0 O-C-N 121.563 -0.711 . . . . 0.0 110.336 174.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 2.5 t -84.87 139.43 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -164.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -60.33 -16.68 37.1 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.579 1.552 . . . . 0.0 115.127 173.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 41.7 p -68.75 106.11 2.54 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.495 1.118 . . . . 0.0 109.697 175.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -64.83 13.3 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 128.134 2.574 . . . . 0.0 114.9 178.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 89.8 mm-40 -74.47 161.97 75.77 Favored Pre-proline 0 CA--C 1.547 0.858 0 C-N-CA 127.096 2.158 . . . . 0.0 114.668 -167.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.45 130.73 20.24 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 124.681 3.587 . . . . 0.0 112.527 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 24.2 p -72.01 -41.54 67.45 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.212 1.005 . . . . 0.0 112.369 175.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 8.0 p 155.67 -41.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.066 1 C-N-CA 132.922 4.489 . . . . 0.0 112.234 169.639 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.99 -10.99 59.99 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -177.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.14 137.88 51.46 Favored 'General case' 0 N--CA 1.437 -1.107 0 C-N-CA 124.313 1.045 . . . . 0.0 108.559 168.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.444 0 C-N-CA 124.127 0.971 . . . . 0.0 111.635 178.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.774 0 N-CA-C 114.867 1.432 . . . . 0.0 114.867 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.9 mt -43.26 -54.58 4.49 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.69 1.196 . . . . 0.0 113.862 -168.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.45 -41.62 98.63 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -177.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -53.91 -51.05 64.98 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.668 1.187 . . . . 0.0 110.633 172.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.73 -47.18 73.11 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.759 1.223 . . . . 0.0 113.001 -178.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.61 -40.95 94.23 Favored Glycine 0 N--CA 1.473 1.133 0 CA-C-N 120.301 1.41 . . . . 0.0 111.303 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -40.4 92.18 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.15 1.38 . . . . 0.0 110.763 172.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.6 -3.18 4.21 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.725 1.379 . . . . 0.0 114.725 175.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.9 mp -115.29 -35.63 4.59 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.836 1.254 . . . . 0.0 111.836 166.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.91 98.93 11.89 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 128.113 2.565 . . . . 0.0 111.929 -176.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.66 172.13 5.99 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 127.421 2.288 . . . . 0.0 108.971 -169.262 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -74.27 -119.71 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 124.927 3.751 . . . . 0.0 110.482 172.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 68.4 m -50.15 -28.96 8.19 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.732 2.013 . . . . 0.0 113.227 176.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.94 -24.93 64.33 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 120.093 1.315 . . . . 0.0 113.479 174.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 30.0 t -74.23 -45.0 50.87 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.185 -0.947 . . . . 0.0 109.251 166.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.44 -44.75 76.61 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.498 -0.751 . . . . 0.0 112.726 173.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.2 mm -50.06 -51.24 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 119.984 1.265 . . . . 0.0 110.714 169.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 25.5 mt -59.67 -45.34 92.36 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 117.249 -1.358 . . . . 0.0 112.87 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.5 m -66.55 -28.05 42.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 CA-C-N 121.267 1.849 . . . . 0.0 111.862 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.23 -20.0 45.62 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.057 1.343 . . . . 0.0 112.932 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 77.2 mt -63.02 -49.45 74.6 Favored 'General case' 0 N--CA 1.469 0.489 0 O-C-N 121.075 -1.015 . . . . 0.0 111.017 170.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -46.41 -53.48 10.97 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 129.304 3.042 . . . . 0.0 112.56 -169.476 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -105.72 22.79 14.95 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 127.444 2.298 . . . . 0.0 111.272 177.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.68 -84.7 0.96 Allowed Glycine 0 C--N 1.34 0.758 0 C-N-CA 126.456 1.979 . . . . 0.0 112.633 -178.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.474 HG12 ' HA ' ' A' ' 76' ' ' ALA . 23.7 m 30.71 39.2 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 127.245 2.218 . . . . 0.0 116.557 -171.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 34.6 m -89.52 -76.72 0.41 Allowed 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.236 -0.915 . . . . 0.0 112.718 -177.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -137.51 164.24 42.94 Favored Pre-proline 0 CA--C 1.546 0.813 0 CA-C-O 118.454 -0.784 . . . . 0.0 111.515 -174.28 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -66.3 -20.23 55.54 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.583 2.188 . . . . 0.0 114.379 -167.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.55 8.24 43.57 Favored Glycine 0 CA--C 1.535 1.302 0 CA-C-O 118.388 -1.229 . . . . 0.0 115.028 171.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -28.97 67.25 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 120.189 1.995 . . . . 0.0 113.899 -170.317 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.74 -18.38 59.52 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.359 0.664 . . . . 0.0 111.723 -177.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.52 -32.96 71.96 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.133 0.973 . . . . 0.0 112.249 174.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.5 -41.49 46.8 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.209 0.604 . . . . 0.0 111.478 176.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -63.63 -40.13 96.1 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 175.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 28.6 mt -92.62 -22.83 19.25 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -174.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.81 8.72 82.54 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 123.961 0.791 . . . . 0.0 112.644 -169.159 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 86.3 mt -103.73 152.01 22.34 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.305 1.442 . . . . 0.0 110.919 -171.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.5 p -63.94 154.53 33.66 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.543 0.737 . . . . 0.0 111.442 -171.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -56.88 -31.36 64.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 176.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.9 m -69.42 -49.69 52.8 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 123.883 0.873 . . . . 0.0 111.473 172.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -63.32 -37.11 86.0 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 119.133 0.879 . . . . 0.0 113.099 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.3 t -63.64 -50.78 76.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 C-N-CA 123.907 0.883 . . . . 0.0 111.381 169.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.3 m -63.48 -35.65 81.14 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 119.225 0.921 . . . . 0.0 113.212 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 43.8 m-20 -49.21 -37.15 21.93 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 125.726 1.611 . . . . 0.0 111.998 170.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 53.1 m-70 -100.58 2.99 42.32 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 115.505 1.668 . . . . 0.0 115.505 176.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 87.4 mt -92.07 -31.65 15.46 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.807 1.185 . . . . 0.0 111.754 165.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.8 t -45.98 -59.27 2.94 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -170.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 10.6 t -76.45 -21.08 56.37 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.6 tp -61.18 -36.36 79.65 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.613 1.165 . . . . 0.0 110.931 177.114 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 55.6 mtm180 -79.94 -20.29 46.0 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.147 1.379 . . . . 0.0 112.41 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.8 -41.39 4.7 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.984 1.278 . . . . 0.0 114.227 -177.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 58.5 m -74.8 -3.48 31.99 Favored 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 124.615 1.166 . . . . 0.0 112.305 170.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 92.04 -4.03 77.6 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 126.008 1.766 . . . . 0.0 116.312 169.065 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 78.4 mt -64.25 -28.99 70.11 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 120.582 2.191 . . . . 0.0 114.77 -173.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -122.12 132.45 70.97 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.406 0 C-N-CA 124.629 1.172 . . . . 0.0 110.455 175.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.8 t -120.66 133.23 68.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 C-N-CA 125.828 1.651 . . . . 0.0 107.971 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.98 144.5 50.47 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 122.953 1.359 . . . . 0.0 112.16 172.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 m -156.98 157.7 35.23 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 126.47 1.908 . . . . 0.0 106.405 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -91.83 135.33 34.0 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.929 1.241 . . . . 0.0 112.458 176.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.69 -11.95 59.83 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.156 0.582 . . . . 0.0 110.773 164.257 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 126.68 -44.45 1.24 Allowed Glycine 0 C--N 1.346 1.09 0 C-N-CA 126.831 2.158 . . . . 0.0 112.859 169.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.0 mtp-105 -92.6 -22.11 19.67 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.85 2.86 . . . . 0.0 111.502 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -156.66 168.48 27.29 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 127.525 2.33 . . . . 0.0 109.087 -169.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 33.3 m -85.15 158.08 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 123.436 0.694 . . . . 0.0 110.828 168.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -129.57 162.39 28.33 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 128.518 2.727 . . . . 0.0 109.0 172.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -108.06 110.95 22.77 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 168.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.474 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -109.88 145.98 35.9 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.901 0.88 . . . . 0.0 110.399 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.6 mt -56.11 145.34 26.21 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 123.17 0.294 . . . . 0.0 110.208 169.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.2 -32.77 73.22 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -167.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -155.82 159.81 39.71 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.639 1.976 . . . . 0.0 111.033 168.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.2 p -45.27 -30.47 1.25 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 128.534 2.733 . . . . 0.0 114.176 168.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -54.41 -45.97 73.07 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 125.01 1.324 . . . . 0.0 112.652 172.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 11.2 mt -74.08 -45.36 49.81 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 118.527 -0.749 . . . . 0.0 109.645 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.97 -31.53 60.81 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.157 0.983 . . . . 0.0 112.459 175.162 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.5 mtt-85 -72.44 -64.03 1.03 Allowed 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 125.194 1.398 . . . . 0.0 113.379 174.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.56 -12.23 59.9 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 120.429 1.468 . . . . 0.0 112.592 -176.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 60.2 tp -75.78 -53.27 8.76 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.245 1.818 . . . . 0.0 110.155 164.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.22 -41.15 8.13 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 128.183 2.802 . . . . 0.0 117.947 -168.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.47 -22.39 66.86 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.105 1.453 . . . . 0.0 111.274 169.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 35.6 tp 68.94 128.48 0.03 OUTLIER 'General case' 0 C--N 1.344 0.363 0 C-N-CA 129.657 3.183 . . . . 0.0 114.223 165.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.492 HG23 HG12 ' A' ' 92' ' ' VAL . 3.6 m -53.19 140.86 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-O 122.566 1.174 . . . . 0.0 109.849 174.212 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -74.78 -4.95 40.69 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -162.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.492 HG12 HG23 ' A' ' 90' ' ' VAL . 2.4 p -62.31 23.89 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 C-N-CA 127.585 2.354 . . . . 0.0 115.722 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.7 t 73.85 8.51 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 C-N-CA 126.7 2.0 . . . . 0.0 112.23 167.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 tt 82.56 93.52 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 128.676 2.79 . . . . 0.0 108.609 -170.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.77 160.29 32.87 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.595 0.758 . . . . 0.0 112.616 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 58.4 t -65.29 144.94 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 124.648 1.179 . . . . 0.0 111.914 173.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -66.28 49.53 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 127.22 2.208 . . . . 0.0 114.773 169.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.8 p -122.49 165.39 16.45 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.853 1.661 . . . . 0.0 112.422 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -118.59 138.38 52.61 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 112.906 -1.952 . . . . 0.0 106.366 163.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 70.0 mm-40 -155.53 150.64 20.89 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 127.581 2.352 . . . . 0.0 107.476 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.47 149.33 84.57 Favored 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 122.481 2.12 . . . . 0.0 116.025 -167.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 34.5 t -110.87 105.48 14.3 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 127.29 2.236 . . . . 0.0 108.475 175.015 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 12.0 p -178.71 -44.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 126.955 2.102 . . . . 0.0 111.94 -169.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . 65.13 -10.51 0.17 Allowed 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 117.711 2.486 . . . . 0.0 117.711 177.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.5 tm-20 -77.42 -35.61 53.97 Favored 'General case' 0 N--CA 1.442 -0.86 0 O-C-N 123.086 0.241 . . . . 0.0 111.358 166.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.227 -0.102 0 O-C-N 121.621 -0.675 . . . . 0.0 112.406 -177.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.809 0 N-CA-C 114.833 1.419 . . . . 0.0 114.833 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 12.1 mt -45.16 -47.47 12.34 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.137 1.375 . . . . 0.0 114.168 -169.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.02 -48.35 76.66 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.98 0.912 . . . . 0.0 111.901 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 -51.35 -50.06 60.23 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.022 1.329 . . . . 0.0 110.996 177.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -65.34 -52.59 52.82 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.395 1.078 . . . . 0.0 111.955 -175.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.81 -29.73 73.94 Favored Glycine 0 CA--C 1.527 0.823 0 CA-C-O 119.098 -0.834 . . . . 0.0 112.806 -178.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.73 -37.65 73.49 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 118.495 1.148 . . . . 0.0 110.758 174.182 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.31 -29.36 70.7 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 118.174 -0.917 . . . . 0.0 112.749 176.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 mp -93.0 -34.69 13.63 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 175.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -90.77 92.02 8.62 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.723 1.209 . . . . 0.0 110.606 -178.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -169.11 141.12 2.07 Favored Pre-proline 0 N--CA 1.47 0.575 0 C-N-CA 127.487 2.315 . . . . 0.0 107.361 -169.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' PRO . . . . . 0.414 ' HG2' ' H ' ' B' ' 22' ' ' THR . 58.8 Cg_endo -45.74 -82.07 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.848 1 C-N-CA 125.475 4.117 . . . . 0.0 113.272 -167.647 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.43 ' HB ' ' CD2' ' B' ' 54' ' ' HIS . 29.5 m -85.32 -22.39 28.53 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.777 1.231 . . . . 0.0 111.179 -173.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.47 ' HG2' HD13 ' B' ' 58' ' ' LEU . 24.5 ttp-105 -68.38 -37.35 80.32 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 120.779 1.627 . . . . 0.0 112.274 176.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 40.2 t -57.52 -46.84 83.34 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 167.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.29 -41.06 96.32 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 117.895 -1.05 . . . . 0.0 113.47 178.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 5.4 mm -57.47 -45.7 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 CA-C-N 120.903 1.683 . . . . 0.0 110.767 171.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 85.6 mt -60.78 -49.83 75.91 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 118.008 -0.996 . . . . 0.0 111.378 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 m -65.36 -31.04 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 CA-C-N 119.481 1.037 . . . . 0.0 111.951 -177.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.07 -26.67 48.3 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.412 1.085 . . . . 0.0 111.611 178.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 tp -66.49 -40.67 89.4 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 117.647 -1.168 . . . . 0.0 112.712 168.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.49 -53.42 11.26 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.357 2.263 . . . . 0.0 112.168 -179.284 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -102.76 25.69 8.92 Favored 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 127.903 2.481 . . . . 0.0 111.334 177.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -126.01 -91.43 0.82 Allowed Glycine 0 N--CA 1.465 0.596 0 C-N-CA 127.52 2.486 . . . . 0.0 111.676 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 34' ' ' VAL . . . . . 0.525 HG12 ' HA ' ' B' ' 76' ' ' ALA . 23.6 m 39.25 30.27 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 126.272 1.829 . . . . 0.0 114.12 -165.601 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 80.6 m -82.46 -150.83 0.09 Allowed 'General case' 0 N--CA 1.438 -1.059 0 CA-C-O 123.872 1.796 . . . . 0.0 107.617 168.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.64 162.2 75.4 Favored Pre-proline 0 C--N 1.311 -1.068 0 O-C-N 120.801 -1.187 . . . . 0.0 113.846 -166.203 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -61.1 -15.78 41.67 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.261 2.641 . . . . 0.0 114.9 -177.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.66 0.97 45.59 Favored Glycine 0 CA--C 1.536 1.396 0 CA-C-O 118.663 -1.076 . . . . 0.0 115.356 170.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 3.3 pp0? -63.5 -31.51 72.7 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.353 1.577 . . . . 0.0 113.783 -169.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mt -64.48 -16.98 63.41 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.803 0.841 . . . . 0.0 111.692 -176.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.89 -28.17 69.66 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.279 0.49 . . . . 0.0 112.22 173.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.04 -52.1 9.92 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.352 0.661 . . . . 0.0 111.069 171.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 28.7 m170 -58.77 -36.33 74.22 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 22.3 mt -98.11 -15.88 19.78 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -175.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.34 6.06 31.83 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-N 119.252 0.933 . . . . 0.0 113.345 -170.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 79.9 mt -102.2 156.6 17.46 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.81 1.244 . . . . 0.0 111.163 -172.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 31.0 p -65.48 154.69 37.82 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.034 0.534 . . . . 0.0 110.939 -170.065 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -55.34 -27.8 49.53 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.206 0.602 . . . . 0.0 112.181 171.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 4.1 m -70.42 -53.63 15.68 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.056 0.943 . . . . 0.0 111.032 171.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -58.2 -43.65 87.71 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 124.227 1.011 . . . . 0.0 112.232 177.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 7.7 t -60.68 -44.27 96.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 124.847 1.259 . . . . 0.0 111.947 170.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 65.0 m -64.19 -38.44 91.05 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 120.49 1.495 . . . . 0.0 112.968 175.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -57.01 -57.99 10.12 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.32 1.448 . . . . 0.0 110.611 176.052 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 54' ' ' HIS . . . . . 0.43 ' CD2' ' HB ' ' B' ' 22' ' ' THR . 63.4 m-70 -74.39 -18.81 60.61 Favored 'General case' 0 CA--C 1.553 1.068 0 CA-C-O 118.219 -0.896 . . . . 0.0 113.099 -179.4 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 28.7 mt -71.53 -37.92 71.12 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 121.059 1.754 . . . . 0.0 113.009 167.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 18.9 m -53.32 -52.66 58.44 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 120.652 1.569 . . . . 0.0 114.708 -171.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 3.3 t -68.56 -24.44 64.62 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 119.635 1.107 . . . . 0.0 112.924 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.47 HD13 ' HG2' ' B' ' 23' ' ' ARG . 5.4 tp -70.08 -43.06 71.91 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 127.057 2.143 . . . . 0.0 110.845 177.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 70.4 mtm180 -81.83 -9.67 59.54 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.934 1.694 . . . . 0.0 112.255 176.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.61 -52.68 2.42 Favored Glycine 0 C--N 1.34 0.776 0 C-N-CA 124.583 1.087 . . . . 0.0 111.314 174.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 91.0 m -76.53 0.45 19.92 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 125.635 1.574 . . . . 0.0 115.124 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.22 29.6 49.56 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.414 1.007 . . . . 0.0 114.666 174.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 86.9 mt -89.06 -24.52 22.28 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.251 -1.146 . . . . 0.0 113.007 172.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 5.8 m -136.71 150.39 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.221 1.409 . . . . 0.0 111.618 176.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 60.0 t -141.43 140.81 31.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.182 1.393 . . . . 0.0 110.381 -169.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -77.75 141.42 39.3 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.136 0.969 . . . . 0.0 112.146 175.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.8 m -162.33 167.3 24.03 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.689 1.996 . . . . 0.0 107.262 -173.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -90.91 149.04 22.06 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.885 1.675 . . . . 0.0 113.143 172.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -99.55 11.27 39.61 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 125.687 1.595 . . . . 0.0 110.078 165.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.76 -56.05 4.91 Favored Glycine 0 C--N 1.343 0.926 0 C-N-CA 126.061 1.791 . . . . 0.0 111.196 -176.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 22.5 mtp-105 -69.51 -21.14 63.69 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.845 1.658 . . . . 0.0 113.523 178.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -174.43 173.33 2.98 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.243 2.617 . . . . 0.0 108.788 -167.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 3.4 m -79.13 162.04 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 C-N-CA 123.616 0.766 . . . . 0.0 109.736 166.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 22.1 ptt180 -147.35 164.7 32.45 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.88 1.272 . . . . 0.0 111.694 -178.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -106.11 120.89 42.98 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 165.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.525 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -114.1 153.17 29.95 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.008 1.323 . . . . 0.0 110.947 177.495 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 77.9 mt -59.06 148.81 29.64 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.477 0.58 . . . . 0.0 110.02 169.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.52 -9.57 58.71 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 115.91 1.819 . . . . 0.0 115.91 -169.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -177.32 157.91 1.39 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.897 2.879 . . . . 0.0 110.865 168.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 98.0 p -44.78 -32.51 1.57 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 128.517 2.727 . . . . 0.0 114.065 166.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -54.96 -47.05 75.04 Favored 'General case' 0 C--N 1.343 0.288 0 C-N-CA 124.361 1.064 . . . . 0.0 112.202 171.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 16.4 mt -70.83 -44.3 66.78 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 118.402 -0.809 . . . . 0.0 109.135 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.9 -35.24 57.84 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.557 0.743 . . . . 0.0 112.501 177.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 3.5 mtt-85 -71.74 -63.26 1.16 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.25 1.02 . . . . 0.0 113.624 174.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.63 -19.07 65.48 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.474 1.488 . . . . 0.0 112.852 -175.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 56.0 tp -72.86 -49.37 30.5 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.177 1.791 . . . . 0.0 111.005 167.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -82.24 -40.74 9.88 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 128.221 2.82 . . . . 0.0 116.758 -168.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -64.51 -23.48 67.29 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.429 1.614 . . . . 0.0 111.48 169.414 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 37.2 tp 70.56 132.03 0.03 OUTLIER 'General case' 0 C--N 1.344 0.354 0 C-N-CA 129.719 3.208 . . . . 0.0 113.675 167.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 90' ' ' VAL . . . . . 0.458 HG23 HG12 ' B' ' 92' ' ' VAL . 3.2 m -53.38 138.12 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-O 122.61 1.195 . . . . 0.0 110.173 176.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -69.72 -10.46 58.39 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 -163.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.458 HG12 HG23 ' B' ' 90' ' ' VAL . 2.6 p -62.79 24.35 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 127.244 2.218 . . . . 0.0 115.632 -177.402 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.7 t 71.23 11.47 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 C-N-CA 125.073 1.349 . . . . 0.0 111.622 168.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.8 tt 77.99 99.89 0.07 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 128.859 2.863 . . . . 0.0 109.342 -170.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -76.48 160.03 29.86 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.785 0.834 . . . . 0.0 112.732 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 57.5 t -57.22 143.96 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 124.795 1.238 . . . . 0.0 110.32 170.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 22.8 p30 -76.3 50.17 0.62 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.989 1.716 . . . . 0.0 112.904 173.086 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 6.3 p -119.22 163.38 17.18 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.147 1.779 . . . . 0.0 111.96 174.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -113.62 137.35 51.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 112.818 -1.992 . . . . 0.0 106.915 164.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -155.94 150.92 20.77 Favored Pre-proline 0 CA--C 1.545 0.754 0 C-N-CA 127.023 2.129 . . . . 0.0 109.051 -173.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -70.7 154.35 64.06 Favored 'Trans proline' 0 CA--C 1.534 0.481 0 C-N-CA 123.374 2.716 . . . . 0.0 116.353 -166.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 33.7 t -106.02 124.13 49.09 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 127.438 2.295 . . . . 0.0 106.707 168.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 6.5 p 166.21 -38.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 C-N-CA 127.242 2.217 . . . . 0.0 111.261 -168.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . 73.19 -48.67 0.69 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 127.565 2.346 . . . . 0.0 114.375 -177.055 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -81.91 -32.57 30.87 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -166.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? . . . . . 0 N--CA 1.465 0.299 0 O-C-N 121.402 -0.811 . . . . 0.0 109.573 169.289 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.723 0 CA-C-O 118.766 -0.635 . . . . 0.0 109.452 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 88.7 mt -35.89 -39.34 0.15 Allowed 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 127.601 2.361 . . . . 0.0 115.297 -178.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -45.89 -30.38 1.71 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.229 1.812 . . . . 0.0 114.824 174.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.5 mmt85 -68.09 -36.11 79.25 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 116.253 -1.832 . . . . 0.0 113.428 174.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -62.27 -48.29 80.59 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 121.807 2.094 . . . . 0.0 111.043 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.27 -40.03 98.55 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 111.728 -0.549 . . . . 0.0 111.728 176.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.2 ttt180 -62.55 -33.93 75.91 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.737 0.815 . . . . 0.0 111.413 170.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.05 -19.31 64.87 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.29 1.405 . . . . 0.0 112.302 175.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 mp -92.21 -28.07 17.27 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.417 1.008 . . . . 0.0 112.964 169.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -100.53 -12.57 19.18 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 -172.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -56.77 140.55 75.59 Favored Pre-proline 0 CA--C 1.549 0.93 0 CA-C-N 119.922 1.237 . . . . 0.0 107.989 168.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -52.83 -77.2 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.432 1 C-N-CA 126.36 4.707 . . . . 0.0 112.076 -167.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.9 m -58.84 -26.35 64.1 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-O 117.513 -1.232 . . . . 0.0 111.775 177.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.6 mtt85 -65.96 -44.34 85.25 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.693 1.588 . . . . 0.0 112.604 177.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.7 t -54.1 -51.16 65.05 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.173 1.351 . . . . 0.0 110.347 171.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.4 ttt85 -62.67 -40.7 97.9 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.921 -178.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.0 mm -53.14 -56.88 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 125.413 1.485 . . . . 0.0 109.22 168.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.33 -45.38 93.46 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.886 -0.578 . . . . 0.0 111.965 -172.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.1 p -69.85 -24.65 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 CA-C-N 119.333 0.97 . . . . 0.0 113.41 176.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.48 -8.56 59.74 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 121.153 -0.967 . . . . 0.0 113.441 170.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.468 HD23 ' HA ' ' A' ' 30' ' ' LEU . 11.4 mt -94.66 -9.53 34.64 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 172.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.37 -13.14 61.4 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 128.724 2.81 . . . . 0.0 111.902 165.545 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -141.08 -46.8 0.39 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.773 2.029 . . . . 0.0 113.963 -169.064 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.98 -66.17 2.31 Favored Glycine 0 C--N 1.339 0.746 0 C-N-CA 125.254 1.407 . . . . 0.0 112.955 -167.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 34.9 m 41.15 20.8 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 128.353 2.661 . . . . 0.0 117.418 171.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 67.0 m -85.28 -63.4 1.33 Allowed 'General case' 0 C--O 1.223 -0.31 0 O-C-N 120.486 -1.384 . . . . 0.0 111.899 -178.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -151.49 159.88 32.68 Favored Pre-proline 0 N--CA 1.473 0.723 0 N-CA-C 115.031 1.493 . . . . 0.0 115.031 -172.357 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -57.82 119.99 7.6 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.091 1.861 . . . . 0.0 107.56 168.032 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.57 0.17 84.48 Favored Glycine 0 CA--C 1.533 1.167 0 CA-C-O 117.297 -1.835 . . . . 0.0 115.483 -173.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -37.77 85.91 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 121.209 2.505 . . . . 0.0 109.971 168.732 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.9 mt -55.42 -27.29 46.91 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 125.962 1.705 . . . . 0.0 110.648 176.025 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.87 -30.3 68.9 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.301 -0.874 . . . . 0.0 113.071 -174.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.55 -53.68 7.73 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.661 0.784 . . . . 0.0 111.172 170.106 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -50.6 -35.39 30.03 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.2 mt -101.08 -13.87 18.02 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.86 1.264 . . . . 0.0 113.389 -173.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.15 13.05 66.61 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.337 0.97 . . . . 0.0 113.724 -173.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 53.9 mt -123.9 141.28 52.17 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.577 1.151 . . . . 0.0 110.114 -168.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.8 p -59.2 157.57 10.37 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -168.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -52.95 -28.63 24.51 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.909 0.884 . . . . 0.0 112.279 171.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.5 t -79.12 -36.68 40.23 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.06 -1.025 . . . . 0.0 112.832 175.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -68.33 -38.67 81.75 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.335 0.971 . . . . 0.0 111.888 171.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.8 t -57.12 -44.84 83.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.518 174.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.79 -39.17 93.16 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-N 120.483 1.492 . . . . 0.0 114.081 173.307 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -56.18 -32.96 64.84 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.214 1.005 . . . . 0.0 112.612 176.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 19.2 m-70 -94.56 -19.64 20.32 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 115.146 1.535 . . . . 0.0 115.146 172.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 47.1 mt -70.47 -28.67 65.18 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 121.159 1.8 . . . . 0.0 113.948 169.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 p -52.0 -59.42 4.37 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 -169.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 2.9 t -64.95 -39.39 93.42 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 118.557 0.617 . . . . 0.0 110.901 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.2 tp -51.76 -32.44 30.83 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.499 1.92 . . . . 0.0 112.266 -178.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.2 mtm105 -72.63 -45.67 57.85 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 118.824 0.738 . . . . 0.0 112.915 174.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.34 -28.08 62.51 Favored Glycine 0 N--CA 1.474 1.203 0 C-N-CA 125.348 1.452 . . . . 0.0 112.433 -176.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.1 m -66.93 -5.57 13.14 Favored 'General case' 0 CA--C 1.566 1.568 0 C-N-CA 127.414 2.285 . . . . 0.0 111.115 165.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.02 -24.92 1.91 Allowed Glycine 0 C--N 1.343 0.924 0 C-N-CA 128.711 3.053 . . . . 0.0 113.809 -172.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 69.9 mt -43.27 -39.55 3.08 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 128.519 2.728 . . . . 0.0 115.549 -170.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -115.4 133.68 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 124.922 1.289 . . . . 0.0 113.231 173.21 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 71.7 t -124.59 136.99 58.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 126.369 1.868 . . . . 0.0 109.549 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.33 141.4 30.94 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.797 1.239 . . . . 0.0 111.095 169.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.0 m -164.0 163.56 23.36 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.947 1.699 . . . . 0.0 107.244 -169.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -84.34 148.43 26.65 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.222 1.374 . . . . 0.0 114.177 174.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -91.76 -18.54 23.75 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.453 0.701 . . . . 0.0 110.24 163.609 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 128.8 -37.81 2.16 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 127.188 2.328 . . . . 0.0 113.252 173.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 23.1 ttm180 -93.97 -34.49 13.04 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 128.646 2.778 . . . . 0.0 111.841 170.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -144.43 164.07 31.93 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.745 2.018 . . . . 0.0 110.166 -170.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 32.9 m -84.56 150.3 4.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 CA-C-O 121.585 0.707 . . . . 0.0 111.298 168.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -135.63 162.27 33.18 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 126.872 2.069 . . . . 0.0 109.304 -171.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -97.57 153.74 17.98 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 164.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -158.83 161.52 36.91 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.164 1.386 . . . . 0.0 109.366 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 57.3 mt -72.35 152.76 41.87 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.363 0.665 . . . . 0.0 111.479 175.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.09 -40.21 95.07 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 115.13 1.53 . . . . 0.0 115.13 -173.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -162.57 161.19 26.7 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 125.411 1.484 . . . . 0.0 110.553 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.58 -37.69 0.14 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 129.515 3.126 . . . . 0.0 112.766 165.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -56.23 -52.11 65.63 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 125.563 1.545 . . . . 0.0 113.398 178.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.9 mt -70.5 -45.7 65.12 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.182 0.901 . . . . 0.0 109.23 -178.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -51.79 -42.11 62.18 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.453 1.101 . . . . 0.0 111.059 177.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 -65.59 -59.74 3.64 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.689 1.196 . . . . 0.0 113.321 171.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.28 -24.46 55.04 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 119.551 1.069 . . . . 0.0 113.329 -178.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.22 -41.5 16.88 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.077 -1.014 . . . . 0.0 112.937 169.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.01 -55.46 4.83 Favored Glycine 0 N--CA 1.471 1.014 0 C-N-CA 126.485 1.993 . . . . 0.0 114.259 -173.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -72.1 -10.34 59.65 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 119.196 1.498 . . . . 0.0 110.895 167.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.5 tp 74.88 138.9 0.06 Allowed 'General case' 0 C--N 1.345 0.409 0 C-N-CA 129.568 3.147 . . . . 0.0 110.554 169.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 32.6 m -66.74 21.05 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 124.923 1.289 . . . . 0.0 113.584 176.138 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 48.0 mm-40 78.14 -12.3 1.09 Allowed 'General case' 0 N--CA 1.443 -0.782 0 O-C-N 120.238 -1.539 . . . . 0.0 112.058 161.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.6 p -65.84 34.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 128.881 2.872 . . . . 0.0 115.24 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . 0.271 34.8 m 51.27 15.49 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 130.028 3.331 . . . . 0.0 115.832 175.119 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 38.7 tp 107.25 101.88 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.659 1 C-N-CA 131.759 4.024 . . . . 0.0 110.501 178.116 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.36 76.49 0.26 Allowed 'General case' 0 CA--C 1.553 1.074 0 O-C-N 121.262 -0.899 . . . . 0.0 111.89 168.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.92 162.02 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 C-N-CA 126.818 2.047 . . . . 0.0 113.178 175.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -63.6 -1.37 1.23 Allowed 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 126.914 2.086 . . . . 0.0 115.008 173.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.2 p -62.61 111.44 2.07 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 126.178 1.791 . . . . 0.0 111.323 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -66.21 140.75 58.19 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 171.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -157.47 127.06 3.2 Favored Pre-proline 0 N--CA 1.443 -0.811 0 N-CA-C 106.125 -1.805 . . . . 0.0 106.125 174.033 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . 0.27 59.5 Cg_endo -73.42 117.13 4.95 Favored 'Trans proline' 0 C--N 1.352 0.713 0 CA-C-N 121.399 1.535 . . . . 0.0 114.149 -166.349 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 50.5 t 63.62 -65.59 0.11 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 130.221 3.408 . . . . 0.0 106.946 -160.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 1.9 p 160.13 -45.45 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.646 1 C-N-CA 132.439 4.296 . . . . 0.0 109.18 -173.003 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.02 -19.3 60.68 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 -170.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.11 -178.14 3.44 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.428 1.891 . . . . 0.0 112.579 -166.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 115.738 1.755 . . . . 0.0 115.738 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.898 0 CA-C-O 119.391 -0.338 . . . . 0.0 111.338 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 72.2 mt -29.09 -43.03 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 130.393 3.477 . . . . 0.0 116.33 -172.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -39.22 -33.86 0.16 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.302 2.241 . . . . 0.0 114.485 172.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 1.8 mmm-85 -63.09 -31.21 72.29 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.795 2.038 . . . . 0.0 114.482 178.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -60.93 -51.88 67.38 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 120.41 1.459 . . . . 0.0 111.033 173.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.61 -35.52 74.61 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.106 -0.798 . . . . 0.0 111.106 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 52.7 ttt180 -64.55 -31.84 73.23 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 123.76 0.824 . . . . 0.0 111.057 171.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.28 -27.51 65.48 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 120.714 1.597 . . . . 0.0 111.99 174.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 mp -87.95 -7.57 56.93 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 172.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -125.2 -14.55 6.49 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 117.235 2.309 . . . . 0.0 117.235 -175.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -54.93 143.8 50.48 Favored Pre-proline 0 CA--C 1.546 0.821 0 CA-C-N 120.671 1.578 . . . . 0.0 108.582 170.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -43.64 -80.69 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 1 C-N-CA 127.453 5.436 . . . . 0.0 113.992 -166.712 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.5 ' HB ' ' CD2' ' B' ' 54' ' ' HIS . 7.3 m -67.74 -14.23 62.78 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.664 -0.647 . . . . 0.0 111.553 176.102 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.68 -47.06 42.56 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.768 1.167 . . . . 0.0 112.712 -171.536 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 54.1 t -51.83 -47.33 64.41 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 167.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 13.9 ttt85 -61.22 -42.56 98.83 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 118.059 -0.972 . . . . 0.0 112.862 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -56.62 -47.78 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 CA-C-N 121.176 1.807 . . . . 0.0 111.176 171.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 40.7 mt -66.94 -50.68 61.59 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 118.919 -0.562 . . . . 0.0 111.397 -178.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 p -70.14 -25.38 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 CA-C-N 119.163 0.892 . . . . 0.0 111.265 -177.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.33 -43.87 63.47 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-O 117.566 -1.207 . . . . 0.0 110.414 167.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.432 ' HA ' HD23 ' B' ' 30' ' ' LEU . 9.7 mt -60.08 -27.09 66.71 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.539 1.518 . . . . 0.0 115.042 -178.808 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -44.71 -28.84 0.67 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 126.717 2.007 . . . . 0.0 111.925 168.121 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -120.08 -31.27 4.47 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 129.556 3.142 . . . . 0.0 113.784 169.091 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.79 16.43 4.23 Favored Glycine 0 N--CA 1.468 0.793 0 C-N-CA 130.019 3.676 . . . . 0.0 115.999 -163.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 20.0 m -58.49 30.39 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 127.609 2.364 . . . . 0.0 117.361 170.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 71.1 m -87.64 -69.06 0.71 Allowed 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.793 -1.192 . . . . 0.0 113.442 178.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -159.54 158.3 27.51 Favored Pre-proline 0 N--CA 1.475 0.781 0 CA-C-N 120.266 1.394 . . . . 0.0 114.341 -172.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -57.07 115.31 2.41 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 122.451 2.101 . . . . 0.0 109.28 170.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 93.66 1.45 65.92 Favored Glycine 0 CA--C 1.532 1.143 0 CA-C-O 117.348 -1.807 . . . . 0.0 115.313 -174.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 39' ' ' GLN . . . . . 0.471 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -63.56 -39.5 94.57 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 120.566 2.183 . . . . 0.0 110.007 168.91 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 9.9 mt -56.52 -24.29 45.51 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 124.69 1.196 . . . . 0.0 110.986 -177.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.8 -31.62 62.8 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.289 -0.882 . . . . 0.0 112.219 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.45 -55.97 5.05 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.96 0.904 . . . . 0.0 111.198 171.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 43' ' ' HIS . . . . . 0.471 ' CD2' HE22 ' B' ' 39' ' ' GLN . 3.2 m-70 -54.51 -29.27 49.95 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.436 HD12 HG22 ' B' ' 51' ' ' VAL . 19.5 mt -105.34 -14.58 15.29 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.197 1.399 . . . . 0.0 112.887 -175.083 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 65.51 14.17 59.68 Favored Glycine 0 CA--C 1.53 0.978 0 C-N-CA 124.323 0.963 . . . . 0.0 113.2 -173.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 39.9 mt -120.3 158.66 26.59 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.184 0.992 . . . . 0.0 112.214 -168.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 20.4 p -66.03 154.65 38.93 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.468 0.651 . . . . 0.0 111.151 -169.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -60.99 -19.76 61.62 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.701 -0.624 . . . . 0.0 111.806 173.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 13.6 m -72.27 -53.55 12.15 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.841 1.256 . . . . 0.0 110.931 168.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -59.22 -37.23 77.0 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.616 1.166 . . . . 0.0 112.024 176.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 51' ' ' VAL . . . . . 0.436 HG22 HD12 ' B' ' 44' ' ' LEU . 10.5 t -63.79 -43.3 97.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 124.293 1.037 . . . . 0.0 112.348 169.751 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 18.1 m -61.02 -45.12 96.1 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 120.462 1.483 . . . . 0.0 112.069 173.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 -57.41 -28.11 62.97 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 127.31 2.244 . . . . 0.0 113.089 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 54' ' ' HIS . . . . . 0.5 ' CD2' ' HB ' ' B' ' 22' ' ' THR . 35.3 m-70 -99.29 -20.12 16.72 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 173.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 50.0 mt -77.71 -22.52 50.3 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 117.039 -1.458 . . . . 0.0 114.875 170.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -44.97 -69.89 0.12 Allowed 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 121.987 2.176 . . . . 0.0 113.888 175.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.5 t -63.9 -42.97 97.3 Favored 'General case' 0 C--O 1.215 -0.76 0 C-N-CA 124.384 1.074 . . . . 0.0 109.916 -178.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.04 -39.63 28.08 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.994 1.318 . . . . 0.0 113.531 176.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 49.1 mtm180 -87.36 -19.91 27.47 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.57 -31.46 10.32 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 125.323 1.439 . . . . 0.0 114.902 175.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 85.1 m -67.27 -10.77 54.04 Favored 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 128.365 2.666 . . . . 0.0 112.501 169.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.31 19.16 78.6 Favored Glycine 0 CA--C 1.529 0.952 0 C-N-CA 124.685 1.136 . . . . 0.0 113.54 -174.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 83.0 mt -78.3 -30.71 48.49 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.401 1.1 . . . . 0.0 112.704 175.095 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 19.6 t -133.5 137.0 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 125.485 1.514 . . . . 0.0 111.259 -170.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 42.4 t -133.97 144.84 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.034 1.334 . . . . 0.0 110.825 -169.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -86.81 137.85 32.07 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.124 1.37 . . . . 0.0 111.38 173.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 18.2 m -161.45 170.04 20.75 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.891 1.676 . . . . 0.0 107.652 -171.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -91.3 145.49 24.61 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 120.419 1.463 . . . . 0.0 113.434 171.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.262 0.0 OUTLIER -88.16 -16.81 32.38 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.492 0.717 . . . . 0.0 110.928 164.667 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 128.28 -35.55 2.68 Favored Glycine 0 CA--C 1.535 1.308 0 C-N-CA 127.407 2.432 . . . . 0.0 113.201 172.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 13.1 ttm180 -96.36 -35.75 11.09 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 129.07 2.948 . . . . 0.0 111.62 170.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -143.62 163.23 33.81 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 127.171 2.188 . . . . 0.0 109.827 -169.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 33.7 m -82.81 153.2 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-O 121.309 0.576 . . . . 0.0 111.652 169.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -136.35 159.02 43.03 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 127.071 2.148 . . . . 0.0 109.845 -171.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -99.54 147.37 25.4 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 162.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -147.42 156.12 42.58 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 123.679 0.792 . . . . 0.0 109.133 178.08 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 40.5 mt -60.58 154.13 21.87 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 168.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.59 -26.81 68.01 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -171.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -174.79 164.43 3.53 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.108 2.163 . . . . 0.0 110.673 169.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.2 m -35.59 -34.78 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 129.749 3.22 . . . . 0.0 113.213 165.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -61.88 -43.32 99.08 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.03 1.332 . . . . 0.0 111.767 -179.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 11.6 mt -74.31 -44.3 53.16 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.985 1.266 . . . . 0.0 110.045 172.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.08 -28.11 16.35 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.661 1.184 . . . . 0.0 112.313 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 39.5 mtt180 -72.23 -63.32 1.17 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.013 1.725 . . . . 0.0 114.682 170.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.33 -13.93 9.89 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 120.129 -1.607 . . . . 0.0 113.303 175.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 5.3 tp -86.09 -44.34 12.34 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 127.5 2.32 . . . . 0.0 112.824 168.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -83.83 -58.26 2.28 Favored Glycine 0 N--CA 1.476 1.305 0 C-N-CA 127.428 2.442 . . . . 0.0 114.428 -174.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 9.4 pm0 -67.89 -14.73 63.19 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 119.882 1.841 . . . . 0.0 110.232 165.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 89' ' ' LEU . . . . . 0.405 ' C ' ' H ' ' B' ' 91' ' ' GLN . 43.3 tp 76.55 160.0 0.22 Allowed 'General case' 0 C--N 1.346 0.437 0 C-N-CA 129.63 3.172 . . . . 0.0 110.558 169.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 28.9 m -66.79 18.8 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 120.856 -1.152 . . . . 0.0 112.401 168.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 91' ' ' GLN . . . . . 0.405 ' H ' ' C ' ' B' ' 89' ' ' LEU . 33.3 mm-40 72.48 -0.91 3.13 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.815 1.246 . . . . 0.0 113.268 166.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.9 p -60.57 34.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 130.107 3.363 . . . . 0.0 115.455 173.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.263 30.0 m 52.03 14.6 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 130.266 3.426 . . . . 0.0 116.201 175.481 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 41.9 tp 109.93 101.92 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 130.45 3.5 . . . . 0.0 109.697 -174.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.45 69.46 0.15 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.675 1.19 . . . . 0.0 111.592 168.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -63.56 161.9 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 125.715 1.606 . . . . 0.0 112.353 174.186 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -70.16 -0.65 8.22 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 127.026 2.13 . . . . 0.0 114.331 173.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 18.4 p -60.97 112.51 2.1 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.541 1.936 . . . . 0.0 110.872 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -72.26 137.21 46.62 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 172.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -156.79 130.3 4.63 Favored Pre-proline 0 N--CA 1.446 -0.638 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 175.057 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . 0.282 51.7 Cg_endo -70.21 114.29 3.73 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 CA-C-N 121.489 1.568 . . . . 0.0 114.776 -165.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 37.9 t 66.38 -63.45 0.25 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 130.562 3.545 . . . . 0.0 108.164 -163.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.1 p 153.17 -40.25 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.845 1 C-N-CA 134.995 5.318 . . . . 0.0 108.294 -168.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -75.12 4.91 5.99 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 116.947 2.202 . . . . 0.0 116.947 -168.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.07 -173.62 3.51 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 120.02 1.282 . . . . 0.0 110.656 -169.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.3 ttm-85 . . . . . 0 N--CA 1.467 0.415 0 N-CA-C 116.118 1.896 . . . . 0.0 116.118 -173.204 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.45 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.0 mp -62.03 -27.09 68.64 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.596 1.558 . . . . 0.0 113.117 -167.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.74 -50.07 33.47 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.421 -0.799 . . . . 0.0 111.139 169.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.4 mmt85 -60.13 -35.55 75.52 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.236 -1.54 . . . . 0.0 112.566 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -56.27 -56.92 15.03 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 126.55 1.94 . . . . 0.0 110.72 178.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -75.02 -30.76 58.7 Favored Glycine 0 CA--C 1.531 1.084 0 CA-C-N 119.28 0.946 . . . . 0.0 112.54 -178.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -61.62 -28.84 69.65 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 118.501 1.151 . . . . 0.0 112.027 169.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.514 ' CB ' HH21 ' A' ' 23' ' ' ARG . . . -85.77 -21.48 28.17 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.285 2.234 . . . . 0.0 114.356 173.182 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.9 tp -78.45 -28.84 46.68 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.101 1.76 . . . . 0.0 110.005 177.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -108.04 62.81 0.61 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.599 1.16 . . . . 0.0 112.197 168.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -125.46 141.58 39.34 Favored Pre-proline 0 CA--C 1.557 1.232 0 C-N-CA 127.686 2.394 . . . . 0.0 107.047 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -45.84 -90.46 0.0 OUTLIER 'Trans proline' 0 C--N 1.356 0.944 1 C-N-CA 127.634 5.556 . . . . 0.0 117.073 -163.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.2 m -46.96 -27.43 1.27 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.437 1.895 . . . . 0.0 111.987 169.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.514 HH21 ' CB ' ' A' ' 17' ' ' ALA . 1.8 ttp180 -73.3 -45.89 52.82 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 126.012 1.725 . . . . 0.0 113.644 -168.318 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.9 t -54.35 -48.82 71.01 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 120.229 1.377 . . . . 0.0 110.324 168.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 -52.45 -52.38 54.42 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-O 117.945 -1.026 . . . . 0.0 112.127 173.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.462 ' HA ' HD11 ' A' ' 44' ' ' LEU . 1.3 mt -50.52 -50.17 22.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 CA-C-N 121.03 1.741 . . . . 0.0 111.767 172.354 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 93.6 mt -69.55 -37.58 77.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 118.28 -0.866 . . . . 0.0 112.608 -170.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.3 p -74.74 -21.34 17.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 CA-C-N 119.19 0.904 . . . . 0.0 111.985 174.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.9 -44.29 27.53 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 118.077 -0.963 . . . . 0.0 110.764 168.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 30' ' ' LEU . 12.4 mt -62.18 -18.96 62.52 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -176.28 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.6 mt -53.29 -22.11 6.57 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 124.528 1.131 . . . . 0.0 111.665 166.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -129.17 -29.11 2.29 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 128.815 2.846 . . . . 0.0 113.564 169.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.25 11.21 2.98 Favored Glycine 0 N--CA 1.473 1.156 0 C-N-CA 128.941 3.162 . . . . 0.0 116.057 -165.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.626 HG12 ' HA ' ' A' ' 76' ' ' ALA . 27.7 m -66.46 39.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 C-N-CA 128.21 2.604 . . . . 0.0 115.721 172.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 5.1 t -100.81 -60.42 1.53 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.416 1.086 . . . . 0.0 113.033 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 53.6 p90 -158.21 154.97 25.09 Favored Pre-proline 0 N--CA 1.478 0.927 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -178.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -61.01 116.88 3.65 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.525 2.15 . . . . 0.0 109.538 175.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.41 -12.19 59.94 Favored Glycine 0 C--O 1.22 -0.772 0 CA-C-O 115.986 -2.563 . . . . 0.0 114.75 -175.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -29.26 68.96 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-N 120.629 2.214 . . . . 0.0 111.838 175.395 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.413 HD13 HG23 ' A' ' 26' ' ' ILE . 17.9 mt -63.13 -18.97 64.02 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.311 0.644 . . . . 0.0 110.775 177.483 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.52 -42.37 96.31 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 119.444 1.02 . . . . 0.0 110.472 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.45 -51.16 66.86 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.517 1.053 . . . . 0.0 112.348 173.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -57.27 -36.69 71.32 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.462 HD11 ' HA ' ' A' ' 26' ' ' ILE . 19.6 mt -101.82 -14.49 17.26 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -170.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.08 10.97 36.24 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 114.676 0.63 . . . . 0.0 114.676 -172.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.0 mp -101.16 141.52 33.92 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 173.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.3 t -59.1 147.8 33.63 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 121.909 -0.495 . . . . 0.0 111.277 -176.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -57.09 -27.99 62.23 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.253 1.021 . . . . 0.0 113.439 -171.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.8 p -69.41 -55.44 10.32 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.261 -0.9 . . . . 0.0 112.767 170.274 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -54.57 -49.06 71.26 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.08 0.952 . . . . 0.0 112.12 177.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 84.9 t -59.56 -40.69 82.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 O-C-N 121.803 -0.561 . . . . 0.0 111.065 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 46.5 m -69.99 -27.24 64.54 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 178.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 32.0 t-20 -58.93 -45.36 90.57 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.019 0.827 . . . . 0.0 110.94 170.164 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 40.0 m-70 -71.65 -22.65 61.66 Favored 'General case' 0 CA--C 1.551 1.019 0 O-C-N 120.146 -1.596 . . . . 0.0 114.268 170.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 73.6 mt -70.55 -25.35 63.05 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 120.62 1.555 . . . . 0.0 111.697 168.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.14 -42.1 63.07 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.121 0.873 . . . . 0.0 111.736 170.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 2.4 t -83.68 -39.45 20.18 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 119.483 1.038 . . . . 0.0 111.886 -178.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.441 ' CD1' ' HG2' ' A' ' 23' ' ' ARG . 1.1 tp -52.31 -42.33 63.71 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.609 1.564 . . . . 0.0 113.408 175.058 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.8 mtm180 -85.19 -1.07 56.49 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.493 1.117 . . . . 0.0 112.025 -179.115 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -109.17 -41.84 1.35 Allowed Glycine 0 N--CA 1.477 1.413 0 C-N-CA 126.159 1.838 . . . . 0.0 113.201 175.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.7 m -59.49 -16.62 25.45 Favored 'General case' 0 CA--C 1.561 1.394 0 C-N-CA 127.515 2.326 . . . . 0.0 112.785 169.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.98 20.0 74.02 Favored Glycine 0 C--N 1.343 0.953 0 C-N-CA 125.714 1.626 . . . . 0.0 113.987 -176.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.6 mt -71.12 -23.98 62.19 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.303 1.441 . . . . 0.0 113.13 171.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 13.7 t -142.6 144.97 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -166.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 9.6 t -133.42 141.63 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 C-N-CA 125.276 1.43 . . . . 0.0 109.479 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -96.67 148.52 22.78 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.377 1.071 . . . . 0.0 112.526 175.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.9 p -133.91 144.85 49.11 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.634 0.774 . . . . 0.0 109.674 172.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -94.96 107.97 20.02 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 125.376 1.47 . . . . 0.0 108.978 169.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.78 14.24 0.22 Allowed 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -176.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.2 -17.48 26.61 Favored Glycine 0 CA--C 1.529 0.933 0 C-N-CA 126.008 1.766 . . . . 0.0 113.189 -177.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 20.3 ttp-105 -158.17 -48.15 0.06 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.658 1.183 . . . . 0.0 112.103 -169.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -93.75 173.76 7.52 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.096 1.758 . . . . 0.0 110.317 171.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 20.6 m -122.77 149.28 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 125.014 1.325 . . . . 0.0 108.664 167.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.5 ptt85 -138.14 177.12 8.12 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.877 1.671 . . . . 0.0 109.372 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -117.03 174.69 5.96 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.035 0.934 . . . . 0.0 110.893 168.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.626 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -168.87 145.97 3.7 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 126.385 1.874 . . . . 0.0 109.859 177.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 91.0 mt -56.23 148.76 17.61 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 123.505 0.503 . . . . 0.0 110.589 169.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.15 -28.5 60.16 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.875 1.806 . . . . 0.0 115.875 -168.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -156.16 160.12 39.6 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 124.195 1.95 . . . . 0.0 112.988 170.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -40.32 -28.85 0.07 Allowed 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 130.49 3.516 . . . . 0.0 113.831 165.502 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -60.15 -62.16 2.07 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 126.484 1.914 . . . . 0.0 110.653 171.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.8 mt -62.31 -47.65 83.34 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -176.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.69 -48.06 66.82 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.7 ptp180 -75.55 -37.2 60.17 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -175.009 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -76.7 -39.41 52.07 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.455 1.025 . . . . 0.0 110.69 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.99 -32.32 70.74 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.216 -0.928 . . . . 0.0 110.163 169.177 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.86 -18.56 76.21 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 125.712 1.625 . . . . 0.0 115.401 171.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.38 -20.36 63.83 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 120.04 1.92 . . . . 0.0 110.259 166.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 13.5 tp 66.91 61.86 0.5 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 128.101 2.56 . . . . 0.0 109.877 -169.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 61.9 t -25.88 128.17 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 128.035 2.534 . . . . 0.0 114.557 -172.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.417 ' C ' ' H ' ' A' ' 93' ' ' VAL . 0.8 OUTLIER -94.3 6.86 47.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 112.758 -2.019 . . . . 0.0 111.269 -109.688 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.8 p -63.71 34.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 130.239 3.416 . . . . 0.0 113.382 169.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.417 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.5 t 69.63 18.18 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.983 0 C-N-CA 125.534 1.534 . . . . 0.0 112.004 168.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 5.4 tt 103.0 102.93 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 131.342 3.857 . . . . 0.0 108.749 -173.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.46 76.22 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 115.34 1.608 . . . . 0.0 115.34 176.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 99.2 t -58.73 153.51 3.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 127.419 2.288 . . . . 0.0 111.241 169.125 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -59.48 -0.24 0.15 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 127.752 2.421 . . . . 0.0 116.813 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 31.3 p -49.01 101.53 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.214 1.406 . . . . 0.0 113.394 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -99.21 141.08 32.44 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 164.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -138.34 141.8 32.86 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 -169.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -54.85 -29.44 63.22 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 123.325 2.684 . . . . 0.0 114.779 -171.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 10.4 t 74.74 -161.33 0.07 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 126.829 2.052 . . . . 0.0 112.189 169.173 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 2.6 t 54.21 28.03 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 C-N-CA 125.545 1.538 . . . . 0.0 111.02 -173.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . 0.271 . . 90.97 9.14 0.06 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 128.89 2.876 . . . . 0.0 114.951 -177.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -96.19 151.0 19.9 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.271 1.429 . . . . 0.0 111.67 168.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.547 0.836 0 C-N-CA 127.484 2.314 . . . . 0.0 110.715 -177.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.459 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 5.0 mp -72.88 -19.17 61.34 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -167.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -81.67 -43.96 17.8 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.945 0.793 . . . . 0.0 110.736 166.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 12.0 mmt85 -62.32 -32.06 72.77 Favored 'General case' 0 N--CA 1.473 0.7 0 O-C-N 120.394 -1.441 . . . . 0.0 112.394 178.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -46.04 -63.9 0.87 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 127.896 2.478 . . . . 0.0 110.725 170.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.76 -31.33 62.6 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 119.758 -1.211 . . . . 0.0 112.491 -174.019 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -66.79 -27.72 67.81 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.448 1.099 . . . . 0.0 112.285 174.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -86.43 -21.58 27.02 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 127.556 2.342 . . . . 0.0 113.727 175.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.0 mp -84.37 -45.19 13.0 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.045 0.838 . . . . 0.0 109.901 173.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.91 49.16 1.32 Allowed 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.204 -0.935 . . . . 0.0 112.162 169.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -117.75 134.57 23.22 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 128.587 2.755 . . . . 0.0 106.567 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -46.3 -90.13 0.0 OUTLIER 'Trans proline' 0 CA--C 1.537 0.672 1 C-N-CA 126.545 4.83 . . . . 0.0 115.682 -164.228 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 91.3 m -54.63 -26.79 35.1 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.764 1.226 . . . . 0.0 111.251 174.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.636 ' HG2' HD13 ' B' ' 58' ' ' LEU . 6.6 mtp180 -74.13 -36.7 64.2 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 117.062 -1.447 . . . . 0.0 114.355 -171.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 41.4 t -58.04 -51.15 70.85 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.521 1.509 . . . . 0.0 109.364 168.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 38.8 mtp180 -51.89 -45.37 64.15 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 124.854 1.261 . . . . 0.0 111.825 173.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 7.0 mt -52.8 -67.05 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 CA-C-N 120.167 1.349 . . . . 0.0 110.099 169.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 87.4 mt -53.68 -37.99 63.75 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -168.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 7.2 p -72.29 -24.28 22.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-N 119.484 1.038 . . . . 0.0 113.75 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -95.35 -18.58 20.64 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.017 1.327 . . . . 0.0 113.461 173.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.04 -50.3 71.19 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.901 1.681 . . . . 0.0 109.102 175.046 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -39.11 -53.12 1.86 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 130.514 3.526 . . . . 0.0 113.639 -174.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -101.55 -15.48 17.09 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.556 1.942 . . . . 0.0 112.619 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.62 -65.31 2.17 Favored Glycine 0 C--N 1.341 0.808 0 C-N-CA 125.501 1.524 . . . . 0.0 112.005 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 34' ' ' VAL . . . . . 0.441 HG12 ' HA ' ' B' ' 76' ' ' ALA . 29.6 m 27.21 40.14 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 N-CA-C 116.664 2.098 . . . . 0.0 116.664 -173.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -92.11 -73.71 0.54 Allowed 'General case' 0 N--CA 1.465 0.302 0 O-C-N 121.394 -0.816 . . . . 0.0 112.365 -167.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 36' ' ' TYR . . . . . 0.495 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 34.7 p90 -151.18 163.53 23.33 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 124.168 0.987 . . . . 0.0 113.441 -178.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -51.76 117.2 3.3 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 122.507 2.138 . . . . 0.0 110.953 170.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.06 -4.57 84.72 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-O 118.383 -1.232 . . . . 0.0 115.16 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 39' ' ' GLN . . . . . 0.495 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 0.0 OUTLIER -56.29 -18.53 10.91 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 120.371 2.085 . . . . 0.0 114.848 175.966 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.401 ' HB2' HG11 ' B' ' 51' ' ' VAL . 1.8 mt -75.46 -15.97 60.37 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 124.325 1.05 . . . . 0.0 110.894 178.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.76 -39.16 87.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 119.398 0.999 . . . . 0.0 112.698 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.77 -42.06 77.96 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.803 170.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -62.19 -36.79 82.98 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 176.308 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 27.0 mt -101.69 -17.37 16.32 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 -169.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.1 13.15 47.4 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-O 121.961 0.756 . . . . 0.0 113.844 -169.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mp -99.44 131.14 45.65 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 169.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 11.8 t -56.38 148.83 18.01 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -176.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -55.19 -23.87 24.08 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.482 1.513 . . . . 0.0 114.382 -175.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 60.7 p -72.98 -53.17 11.87 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.292 1.405 . . . . 0.0 112.339 169.103 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 63.7 t-20 -57.52 -47.19 82.64 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.357 1.063 . . . . 0.0 111.916 -178.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 51' ' ' VAL . . . . . 0.401 HG11 ' HB2' ' B' ' 40' ' ' LEU . 27.4 t -63.11 -36.59 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 O-C-N 121.203 -0.935 . . . . 0.0 111.54 177.072 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 55.3 m -71.87 -29.72 64.67 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -55.48 -45.85 76.92 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 122.089 0.947 . . . . 0.0 110.54 170.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 -71.73 -23.16 61.57 Favored 'General case' 0 CA--C 1.556 1.199 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 171.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 65.9 mt -74.85 -18.71 60.4 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-N 121.192 1.814 . . . . 0.0 112.175 168.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.36 -50.17 70.38 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.21 0.914 . . . . 0.0 110.581 172.783 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 6.1 t -76.01 -39.45 55.73 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 118.554 0.615 . . . . 0.0 112.236 -177.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.636 HD13 ' HG2' ' B' ' 23' ' ' ARG . 4.8 tp -56.05 -40.87 74.15 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.845 1.658 . . . . 0.0 112.361 -175.385 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 -81.32 -9.75 59.69 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.717 1.207 . . . . 0.0 112.33 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -93.17 -39.42 5.13 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 125.076 1.322 . . . . 0.0 111.827 169.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 43.5 m -58.07 -18.18 22.96 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 127.528 2.331 . . . . 0.0 113.216 169.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 81.51 -9.52 54.8 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 125.709 1.624 . . . . 0.0 113.838 -176.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 92.5 mt -51.41 -31.63 23.4 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 128.079 2.551 . . . . 0.0 114.315 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -129.91 138.87 52.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 C-N-CA 126.376 1.87 . . . . 0.0 109.44 177.067 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 51.2 t -122.02 135.9 60.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 C-N-CA 127.153 2.181 . . . . 0.0 108.713 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -87.54 136.05 33.1 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.589 0.756 . . . . 0.0 112.42 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 14.1 p -136.74 148.08 47.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.492 0.717 . . . . 0.0 110.566 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -100.09 107.25 19.1 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.964 1.306 . . . . 0.0 110.198 175.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.83 9.46 0.38 Allowed 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 116.2 1.926 . . . . 0.0 116.2 -177.405 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 116.24 -17.93 14.24 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.921 1.724 . . . . 0.0 113.083 -177.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 20.0 ttp-105 -157.88 -42.99 0.06 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.447 1.499 . . . . 0.0 111.957 -169.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -102.27 171.64 7.35 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.259 1.824 . . . . 0.0 111.136 175.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 23.8 m -120.01 143.06 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.017 1.327 . . . . 0.0 110.377 168.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.2 ptt180 -131.98 175.1 9.51 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.041 1.336 . . . . 0.0 110.808 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -122.65 125.65 46.03 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.556 1.142 . . . . 0.0 108.588 167.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.441 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -123.61 150.42 44.15 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.451 1.1 . . . . 0.0 110.365 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 tp -53.02 145.26 13.34 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.585 1.154 . . . . 0.0 110.326 172.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.27 -37.9 84.83 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 -173.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -169.11 161.41 10.37 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 123.698 1.713 . . . . 0.0 112.592 -174.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -34.96 -39.45 0.1 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 130.662 3.585 . . . . 0.0 113.162 165.395 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -50.79 -67.39 0.26 Allowed 'General case' 0 C--N 1.345 0.386 0 C-N-CA 127.033 2.133 . . . . 0.0 111.877 173.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 16.8 mt -62.35 -37.46 85.75 Favored 'General case' 0 C--O 1.223 -0.336 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.6 -41.89 98.3 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 118.471 -0.776 . . . . 0.0 112.276 -174.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -71.45 -52.06 20.49 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-O 117.878 -1.058 . . . . 0.0 111.772 174.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.79 -38.01 89.5 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 120.109 1.322 . . . . 0.0 112.311 -173.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' B' ' 86' ' ' LEU . 0.3 OUTLIER -71.85 -29.16 64.09 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.39 -0.819 . . . . 0.0 112.109 173.445 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -87.09 -29.75 21.97 Favored Glycine 0 CA--C 1.543 1.796 0 C-N-CA 124.847 1.213 . . . . 0.0 116.022 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -89.04 -8.68 53.5 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.971 1.709 . . . . 0.0 112.82 171.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 13.7 tp 85.69 84.94 0.02 OUTLIER 'General case' 0 C--O 1.239 0.521 0 C-N-CA 128.801 2.84 . . . . 0.0 114.18 166.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 55.4 t -46.89 131.3 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-O 124.624 2.155 . . . . 0.0 110.172 169.06 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 91' ' ' GLN . . . . . 0.404 ' C ' ' H ' ' B' ' 93' ' ' VAL 0.288 2.0 tp-100 -100.19 10.76 40.76 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 111.902 -2.408 . . . . 0.0 112.501 -120.021 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 6.7 p -67.32 42.39 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.71 1 C-N-CA 132.674 4.389 . . . . 0.0 110.853 166.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 93' ' ' VAL . . . . . 0.404 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.2 OUTLIER 56.73 9.24 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 C-N-CA 129.326 3.05 . . . . 0.0 116.247 177.767 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 7.3 tt 97.41 106.06 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 129.902 3.281 . . . . 0.0 104.415 -165.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.28 86.15 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 -177.098 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 57.1 t -64.47 147.3 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 125.608 1.563 . . . . 0.0 108.073 167.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -59.47 -3.28 0.42 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.852 2.061 . . . . 0.0 116.346 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 12.2 p -44.17 95.11 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.012 1.725 . . . . 0.0 113.201 176.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -99.88 145.1 28.17 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 168.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -148.12 144.3 18.69 Favored Pre-proline 0 C--N 1.322 -0.616 0 C-N-CA 125.878 1.671 . . . . 0.0 107.105 -168.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.7 -28.94 39.7 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 123.652 2.901 . . . . 0.0 115.793 -171.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 47.9 t 72.86 -161.24 0.1 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 127.296 2.239 . . . . 0.0 111.886 174.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.2 t 56.51 22.43 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 126.304 1.841 . . . . 0.0 111.661 -170.029 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . 0.278 . . 89.45 8.09 0.1 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 128.548 2.739 . . . . 0.0 115.251 -174.6 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -86.87 146.89 26.02 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.43 1.092 . . . . 0.0 111.252 169.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.558 0 C-N-CA 126.152 1.781 . . . . 0.0 110.23 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.651 0 CA-C-O 120.672 0.273 . . . . 0.0 111.72 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.561 ' HG ' HG11 ' B' ' 92' ' ' VAL . 0.7 OUTLIER -65.98 -46.54 77.67 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -169.06 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.97 -60.3 3.5 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 118.249 -0.881 . . . . 0.0 112.43 -177.242 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.5 ptp85 -61.33 -35.41 77.31 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.658 1.117 . . . . 0.0 112.69 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -59.55 -63.11 1.42 Allowed 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.805 0.842 . . . . 0.0 110.793 174.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.83 -31.34 62.42 Favored Glycine 0 C--N 1.337 0.588 0 CA-C-O 118.222 -1.321 . . . . 0.0 112.388 -169.419 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.77 -8.1 32.86 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.032 1.916 . . . . 0.0 114.269 173.102 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.47 -6.23 14.47 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.153 1.381 . . . . 0.0 112.753 169.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.492 HD12 ' HA ' ' A' ' 18' ' ' LEU . 3.7 tp -96.07 -37.71 10.5 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.227 1.411 . . . . 0.0 110.381 176.515 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.61 34.69 0.33 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 128.149 2.58 . . . . 0.0 115.469 -172.498 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -103.0 165.76 13.06 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 129.785 3.234 . . . . 0.0 113.209 -168.79 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -69.57 -104.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.549 1.258 1 C-N-CA 126.206 4.604 . . . . 0.0 110.832 168.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -46.9 -37.99 9.77 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 127.346 2.259 . . . . 0.0 112.877 176.736 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.515 ' CD ' HD13 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -67.18 -32.7 73.95 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 117.964 -1.017 . . . . 0.0 113.505 -176.523 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 40.6 t -60.74 -52.14 66.36 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 119.041 0.837 . . . . 0.0 109.826 169.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 78.7 mtt-85 -52.61 -45.43 66.57 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.175 1.39 . . . . 0.0 113.239 175.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.8 mt -45.27 -63.94 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 C-N-CA 124.028 0.931 . . . . 0.0 110.887 169.619 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.9 mt -60.9 -42.23 97.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.774 -1.103 . . . . 0.0 112.462 -170.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -63.02 -25.61 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 CA-C-N 119.016 0.826 . . . . 0.0 112.354 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.448 ' HB1' ' CD2' ' A' ' 43' ' ' HIS . . . -89.2 -26.4 21.26 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.505 0.722 . . . . 0.0 112.867 175.317 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.31 -39.46 94.62 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.278 1.431 . . . . 0.0 112.639 -175.632 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 mt -41.13 -44.36 2.49 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 128.119 2.568 . . . . 0.0 111.809 173.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -112.59 11.63 19.68 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 126.966 2.106 . . . . 0.0 112.251 173.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.29 -4.91 19.94 Favored Glycine 0 N--CA 1.47 0.949 0 C-N-CA 127.61 2.528 . . . . 0.0 114.357 -170.073 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.6 m -40.95 67.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 C-N-CA 127.85 2.46 . . . . 0.0 117.344 166.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 52.0 m -133.25 -61.16 0.83 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.844 1.257 . . . . 0.0 114.168 -178.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -161.69 163.02 20.2 Favored Pre-proline 0 N--CA 1.479 0.993 0 CA-C-N 120.647 1.567 . . . . 0.0 115.143 -177.159 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -57.65 131.33 43.59 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.633 2.222 . . . . 0.0 108.159 168.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.87 1.72 59.69 Favored Glycine 0 CA--C 1.528 0.896 0 CA-C-O 116.993 -2.004 . . . . 0.0 114.928 -176.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -35.96 73.33 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 121.143 2.471 . . . . 0.0 110.766 170.373 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 mt -59.32 -20.9 58.3 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 125.838 1.655 . . . . 0.0 112.071 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.5 -35.09 76.7 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.931 -0.481 . . . . 0.0 111.833 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.71 -45.62 61.26 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.586 0.754 . . . . 0.0 111.18 171.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.448 ' CD2' ' HB1' ' A' ' 29' ' ' ALA . 5.4 m-70 -59.21 -37.39 77.34 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 177.529 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 21.0 mt -99.33 -16.47 18.44 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.441 1.096 . . . . 0.0 113.676 -173.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.68 8.02 71.05 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-N 119.105 0.866 . . . . 0.0 113.803 -170.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.7 mt -110.91 147.75 33.95 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.695 1.198 . . . . 0.0 111.276 -173.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.8 t -58.37 136.77 57.49 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.568 0.699 . . . . 0.0 112.089 -173.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 38.6 ptt180 -57.73 -33.66 68.68 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.428 1.091 . . . . 0.0 112.912 -176.276 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.8 m -61.88 -43.08 99.58 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.606 0.762 . . . . 0.0 111.509 174.231 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -80.08 -39.42 29.7 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 59.9 t -60.33 -38.63 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-N 119.521 1.055 . . . . 0.0 110.773 173.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 14.9 m -70.02 -21.11 63.23 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 177.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -57.01 -45.22 83.2 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-O 123.301 1.524 . . . . 0.0 110.806 174.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -69.94 -14.16 62.58 Favored 'General case' 0 CA--C 1.561 1.388 0 C-N-CA 125.857 1.663 . . . . 0.0 114.63 170.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 95.5 mt -81.11 -26.98 35.77 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 120.662 -1.274 . . . . 0.0 112.353 172.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.8 t -47.23 -50.89 20.19 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.204 0.911 . . . . 0.0 111.94 -178.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 41.5 t -86.8 -23.29 25.43 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 178.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.515 HD13 ' CD ' ' A' ' 23' ' ' ARG . 5.6 tp -58.49 -39.33 79.7 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 121.031 1.741 . . . . 0.0 111.199 171.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -77.88 -24.93 48.33 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.526 1.53 . . . . 0.0 112.021 176.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.55 -52.22 4.27 Favored Glycine 0 CA--C 1.534 1.264 0 C-N-CA 124.951 1.263 . . . . 0.0 113.462 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 17.5 m -64.75 -2.05 2.28 Favored 'General case' 0 CA--C 1.562 1.415 0 C-N-CA 125.903 1.681 . . . . 0.0 113.278 171.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.26 6.67 87.81 Favored Glycine 0 C--N 1.344 1.011 0 C-N-CA 124.987 1.279 . . . . 0.0 114.375 170.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.6 mt -66.68 -36.89 83.6 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 118.175 0.988 . . . . 0.0 111.818 -177.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.5 m -113.22 135.8 51.59 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.101 0 C-N-CA 125.881 1.672 . . . . 0.0 110.818 170.025 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 46.9 t -116.71 141.84 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 125.614 1.566 . . . . 0.0 108.784 176.041 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.11 142.32 49.16 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.753 0.821 . . . . 0.0 113.063 174.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.0 m -134.21 144.81 48.66 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 169.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -83.54 103.84 13.2 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 118.697 0.68 . . . . 0.0 109.536 168.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.269 1.3 pp20? -70.79 -161.11 0.05 OUTLIER 'General case' 0 CA--C 1.558 1.267 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 168.724 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -60.59 -28.32 67.54 Favored Glycine 0 CA--C 1.535 1.31 0 O-C-N 119.695 -1.878 . . . . 0.0 115.801 -169.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.0 tpt85 -158.03 14.5 0.21 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 174.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.29 174.0 11.28 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.618 1.567 . . . . 0.0 110.075 -177.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 9.1 p -87.49 139.16 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 167.324 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.25 165.41 16.24 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 125.334 1.453 . . . . 0.0 109.002 173.174 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -114.35 152.91 30.71 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 123.116 0.566 . . . . 0.0 109.735 170.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -144.38 143.32 30.88 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 125.777 1.631 . . . . 0.0 109.552 -177.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.01 143.28 22.36 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 168.08 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.12 -60.94 2.69 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.589 0.631 . . . . 0.0 112.479 -175.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -146.87 165.66 29.06 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.971 1.367 . . . . 0.0 112.02 -175.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -31.91 -36.29 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 130.736 3.614 . . . . 0.0 113.139 166.33 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -48.59 -66.26 0.43 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 127.208 2.203 . . . . 0.0 113.608 172.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 10.7 mt -70.24 -31.9 69.52 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 119.434 1.015 . . . . 0.0 110.179 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.49 -40.64 97.62 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.894 0.77 . . . . 0.0 111.123 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -68.99 -55.46 10.81 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 117.664 -1.16 . . . . 0.0 111.585 169.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.93 -31.6 72.72 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 120.64 1.564 . . . . 0.0 113.36 -172.239 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.5 tt -71.8 -54.76 9.17 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.765 0.826 . . . . 0.0 109.307 168.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.39 -24.48 75.01 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 124.708 1.147 . . . . 0.0 115.475 -167.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 -74.33 -25.17 59.38 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 126.713 2.005 . . . . 0.0 111.908 168.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.3 tp 76.73 108.71 0.08 Allowed 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 129.336 3.054 . . . . 0.0 110.553 -178.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.721 HG23 HG12 ' A' ' 92' ' ' VAL . 14.8 m -54.17 2.79 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 129.016 2.926 . . . . 0.0 117.099 -176.002 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 74.73 -5.3 2.16 Favored 'General case' 0 C--O 1.218 -0.577 0 O-C-N 120.21 -1.556 . . . . 0.0 113.217 162.307 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.721 HG12 HG23 ' A' ' 90' ' ' VAL . 7.4 p -64.88 43.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 127.951 2.501 . . . . 0.0 113.424 168.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER 59.55 10.34 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.887 0 C-N-CA 128.332 2.653 . . . . 0.0 113.882 174.318 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 18.9 tp 77.47 107.0 0.08 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 127.254 2.222 . . . . 0.0 107.639 -165.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.401 ' CB ' HD12 ' B' ' 11' ' ' LEU . . . -51.4 141.87 14.65 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.834 0.854 . . . . 0.0 112.872 172.534 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.4 m -149.92 165.01 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 127.693 2.397 . . . . 0.0 108.79 -176.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -75.2 26.97 0.09 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.707 2.403 . . . . 0.0 114.593 -172.37 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 18.2 p -114.46 44.54 1.7 Allowed 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.581 1.953 . . . . 0.0 109.967 168.129 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 16.4 p30 -68.59 38.93 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 129.232 3.013 . . . . 0.0 113.668 176.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.22 135.81 68.57 Favored Pre-proline 0 CA--C 1.556 1.198 0 C-N-CA 125.778 1.631 . . . . 0.0 110.788 172.301 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -75.58 -156.11 0.05 OUTLIER 'Trans proline' 0 CA--C 1.544 0.984 1 C-N-CA 126.155 4.57 . . . . 0.0 115.587 -164.662 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 16.5 t -69.86 -161.18 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 127.825 2.45 . . . . 0.0 114.341 -177.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 45.4 t -153.94 -78.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 128.2 2.6 . . . . 0.0 109.439 -169.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -85.77 40.17 0.84 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.501 1.52 . . . . 0.0 113.967 -176.463 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -172.98 -176.54 1.43 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.523 2.329 . . . . 0.0 110.708 179.028 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.6 ptt180 . . . . . 0 N--CA 1.476 0.861 0 C-N-CA 125.462 1.505 . . . . 0.0 113.788 172.274 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.544 0 CA-C-O 120.877 0.37 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.593 ' HG ' HG11 ' A' ' 92' ' ' VAL . 0.6 OUTLIER -65.78 -46.23 79.5 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-O 118.148 -0.93 . . . . 0.0 113.496 -169.644 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.77 -61.08 2.53 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.923 -178.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 7.4 ptp85 -61.31 -33.3 73.35 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.613 1.097 . . . . 0.0 112.889 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.54 -65.87 0.62 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.605 0.762 . . . . 0.0 110.233 174.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.57 -28.37 69.53 Favored Glycine 0 C--O 1.22 -0.736 0 CA-C-O 117.288 -1.84 . . . . 0.0 112.395 -169.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.56 -13.03 61.7 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 120.926 2.363 . . . . 0.0 114.343 173.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -108.58 -8.29 15.52 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.438 1.495 . . . . 0.0 112.746 170.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 18' ' ' LEU . . . . . 0.453 HD12 ' HA ' ' B' ' 18' ' ' LEU . 4.7 tp -93.39 -37.13 12.15 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.848 1.259 . . . . 0.0 110.456 176.139 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.16 37.42 0.44 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 128.335 2.654 . . . . 0.0 115.324 -176.164 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 20' ' ' ASP . . . . . 0.409 ' CG ' ' HE ' ' B' ' 23' ' ' ARG . 0.2 OUTLIER -104.72 165.48 13.2 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 129.141 2.976 . . . . 0.0 112.045 -169.865 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.58 -105.8 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.355 1 C-N-CA 125.975 4.45 . . . . 0.0 111.011 169.377 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -45.89 -36.64 5.52 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 127.194 2.197 . . . . 0.0 113.516 175.529 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.419 ' CD ' HD13 ' B' ' 58' ' ' LEU . 0.0 OUTLIER -66.94 -33.56 75.85 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 -178.377 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 43.8 t -62.2 -49.34 76.17 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.1 0.864 . . . . 0.0 110.109 169.597 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 80.2 mtt-85 -53.26 -46.91 69.41 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.495 1.118 . . . . 0.0 113.119 174.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 3.5 mt -44.57 -63.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 123.975 0.91 . . . . 0.0 110.504 169.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.44 -39.46 93.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 117.917 -1.039 . . . . 0.0 113.128 -169.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -64.56 -25.23 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.294 0.952 . . . . 0.0 112.418 176.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' ALA . . . . . 0.431 ' HB1' ' CD2' ' B' ' 43' ' ' HIS . . . -89.59 -27.17 20.4 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 174.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.3 -39.6 91.08 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.892 1.277 . . . . 0.0 112.872 -175.231 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -43.79 -45.51 7.32 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 128.709 2.804 . . . . 0.0 112.116 176.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -108.76 9.56 26.9 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 127.614 2.365 . . . . 0.0 111.569 175.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.19 -33.53 3.67 Favored Glycine 0 C--O 1.222 -0.626 0 CA-C-O 117.015 -1.992 . . . . 0.0 114.395 -169.18 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 34' ' ' VAL . . . . . 0.515 HG12 ' HA ' ' B' ' 76' ' ' ALA . 34.3 m -10.88 51.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 N-CA-C 121.787 3.995 . . . . 0.0 121.787 170.559 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 35.8 m -119.94 -60.51 1.7 Allowed 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.189 -1.569 . . . . 0.0 112.532 -176.528 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -162.58 165.4 15.37 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 -174.684 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -58.06 128.82 30.26 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 122.564 2.176 . . . . 0.0 107.879 167.303 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.13 2.65 73.21 Favored Glycine 0 CA--C 1.528 0.875 0 CA-C-O 116.912 -2.049 . . . . 0.0 114.895 -176.062 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -39.08 80.58 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 121.44 2.62 . . . . 0.0 110.255 169.662 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 9.7 mt -58.85 -20.86 54.66 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 126.193 1.797 . . . . 0.0 112.561 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.9 -35.56 80.46 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.703 0.401 . . . . 0.0 111.593 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.95 -46.72 64.67 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.243 0.617 . . . . 0.0 111.15 170.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 43' ' ' HIS . . . . . 0.431 ' CD2' ' HB1' ' B' ' 29' ' ' ALA . 4.7 m-70 -58.27 -38.59 77.26 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 114.128 1.158 . . . . 0.0 114.128 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 27.8 mt -97.13 -16.55 20.41 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.4 1.08 . . . . 0.0 113.545 -173.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.07 5.14 64.81 Favored Glycine 0 CA--C 1.537 1.445 0 CA-C-N 119.249 0.931 . . . . 0.0 113.931 -169.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 96.5 mt -108.33 146.11 33.45 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.926 1.29 . . . . 0.0 111.251 -173.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 10.3 t -57.83 139.16 54.75 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.485 0.66 . . . . 0.0 112.448 -173.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -58.6 -32.19 68.76 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.208 1.003 . . . . 0.0 112.911 -176.258 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 4.1 m -62.26 -44.8 95.72 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.636 0.653 . . . . 0.0 111.862 173.054 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -77.79 -39.99 42.11 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -178.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 61.2 t -60.46 -38.44 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 118.992 0.815 . . . . 0.0 110.695 173.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 18.4 m -69.21 -24.2 63.99 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 177.367 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -56.09 -43.95 78.53 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 122.916 1.341 . . . . 0.0 111.232 173.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 -74.11 -17.26 60.96 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 125.11 1.364 . . . . 0.0 114.525 170.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 96.0 mt -76.65 -28.99 56.23 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 120.394 1.452 . . . . 0.0 112.297 169.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 7.6 t -46.67 -56.19 6.53 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.95 0.796 . . . . 0.0 111.901 -179.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 52.7 t -78.4 -28.98 47.02 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 118.321 -0.847 . . . . 0.0 113.262 177.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.419 HD13 ' CD ' ' B' ' 23' ' ' ARG . 6.4 tp -52.2 -41.03 62.34 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 120.84 1.654 . . . . 0.0 111.461 175.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 30.4 mtm180 -81.94 -21.64 37.16 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.283 1.433 . . . . 0.0 112.521 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.71 -39.96 11.4 Favored Glycine 0 N--CA 1.477 1.402 0 C-N-CA 124.969 1.271 . . . . 0.0 113.024 174.174 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 20.9 m -72.12 -11.79 60.91 Favored 'General case' 0 CA--C 1.561 1.371 0 C-N-CA 126.185 1.794 . . . . 0.0 111.883 169.086 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.96 11.8 85.04 Favored Glycine 0 N--CA 1.472 1.085 0 C-N-CA 124.818 1.199 . . . . 0.0 114.593 169.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 20.7 mt -67.71 -33.87 75.75 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.991 1.316 . . . . 0.0 111.492 -178.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -112.02 145.43 18.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 C-N-CA 127.865 2.466 . . . . 0.0 110.314 170.19 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.07 143.94 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.902 1.281 . . . . 0.0 110.796 177.514 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.09 136.67 52.62 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.015 0.926 . . . . 0.0 112.293 171.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 2.8 m -134.28 144.63 48.45 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 106.02 -1.845 . . . . 0.0 106.02 168.123 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -82.14 103.82 12.03 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.948 0.795 . . . . 0.0 110.13 169.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.27 1.1 pp20? -71.65 -160.49 0.06 Allowed 'General case' 0 CA--C 1.559 1.298 0 CA-C-N 118.249 0.477 . . . . 0.0 111.83 168.642 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -60.48 -27.54 66.03 Favored Glycine 0 CA--C 1.536 1.373 0 O-C-N 119.53 -1.982 . . . . 0.0 115.607 -169.584 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 3.4 tpt85 -157.93 11.44 0.19 Allowed 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 174.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.24 176.83 8.68 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.734 1.613 . . . . 0.0 110.724 -177.021 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 7.1 p -90.15 134.45 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 168.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.18 161.99 17.67 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.098 1.759 . . . . 0.0 110.184 174.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -117.29 118.71 33.02 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 121.853 -0.529 . . . . 0.0 110.306 175.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.515 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -106.3 149.04 27.31 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.674 1.59 . . . . 0.0 110.724 177.17 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 tp -58.23 151.86 18.43 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 166.189 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.14 -66.76 0.47 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.926 0.87 . . . . 0.0 112.923 -174.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -142.07 163.4 32.97 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.953 1.359 . . . . 0.0 111.049 -178.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -32.51 -35.2 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 130.681 3.592 . . . . 0.0 113.159 166.587 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -48.54 -69.77 0.11 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.312 2.245 . . . . 0.0 113.56 170.036 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.92 -32.35 74.02 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 120.097 1.317 . . . . 0.0 110.266 179.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.08 -41.97 98.73 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.782 0.719 . . . . 0.0 110.896 -177.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 19.0 tpp85 -68.27 -54.17 19.45 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.628 1.171 . . . . 0.0 111.863 171.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.02 -33.78 75.0 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 120.325 1.421 . . . . 0.0 113.347 -173.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 4.7 tt -70.12 -54.49 12.76 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.613 0.765 . . . . 0.0 109.522 168.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.68 -25.12 75.88 Favored Glycine 0 CA--C 1.54 1.609 0 C-N-CA 124.982 1.277 . . . . 0.0 115.282 -167.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -70.78 -29.25 65.4 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 126.461 1.904 . . . . 0.0 111.07 167.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 20.6 tp 81.46 121.21 0.05 OUTLIER 'General case' 0 C--N 1.341 0.222 0 C-N-CA 130.147 3.379 . . . . 0.0 109.581 -172.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 90' ' ' VAL . . . . . 0.747 HG23 HG12 ' B' ' 92' ' ' VAL . 12.0 m -62.01 3.72 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.242 0 C-N-CA 125.208 1.403 . . . . 0.0 114.739 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 71.75 -9.79 0.92 Allowed 'General case' 0 C--O 1.217 -0.612 0 C-N-CA 125.404 1.482 . . . . 0.0 114.605 165.37 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.747 HG12 HG23 ' B' ' 90' ' ' VAL . 7.9 p -59.39 45.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 C-N-CA 129.35 3.06 . . . . 0.0 115.242 171.184 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.3 t 63.29 5.97 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 128.865 2.866 . . . . 0.0 113.742 173.076 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 18.6 tp 80.66 109.38 0.07 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 127.608 2.363 . . . . 0.0 106.308 -164.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.4 ' CB ' HD12 ' A' ' 11' ' ' LEU . . . -50.92 142.96 10.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.506 0.722 . . . . 0.0 112.863 171.062 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 3.7 m -152.22 163.25 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 127.317 2.247 . . . . 0.0 108.766 -175.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -73.98 24.43 0.08 Allowed 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 127.744 2.417 . . . . 0.0 114.697 -173.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 19.5 p -113.68 40.76 2.34 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 126.621 1.968 . . . . 0.0 109.874 168.253 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 19.2 p-10 -71.23 46.69 0.11 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 129.436 3.094 . . . . 0.0 112.49 177.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.15 138.73 84.09 Favored Pre-proline 0 CA--C 1.556 1.203 0 C-N-CA 126.884 2.074 . . . . 0.0 110.565 175.303 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -72.1 -162.08 0.11 Allowed 'Trans proline' 0 C--N 1.356 0.95 1 C-N-CA 126.802 5.001 . . . . 0.0 117.401 -163.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 13.0 t -64.49 -158.07 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 125.826 1.65 . . . . 0.0 113.786 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -169.1 -29.29 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 117.042 2.238 . . . . 0.0 117.042 -165.547 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -139.13 42.06 2.08 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.817 1.19 . . . . 0.0 111.137 -175.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 178.65 -167.77 0.07 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 130.52 3.528 . . . . 0.0 108.138 -169.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.478 0.929 0 C-N-CA 127.225 2.21 . . . . 0.0 112.91 169.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.86 -36.01 77.62 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 117.672 -1.156 . . . . 0.0 113.158 -169.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.6 -58.19 7.03 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 120.72 1.6 . . . . 0.0 111.711 176.222 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -54.73 -40.09 68.9 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.076 1.35 . . . . 0.0 112.856 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -75.34 -53.89 7.99 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.823 1.249 . . . . 0.0 111.55 177.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.18 -17.98 70.64 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-O 118.103 -1.387 . . . . 0.0 112.895 -175.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.42 HH21 ' CG ' ' B' ' 99' ' ' ASP . 66.2 mtt-85 -56.92 -19.59 18.68 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 119.844 1.822 . . . . 0.0 113.45 168.003 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.18 -6.53 15.54 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.576 1.151 . . . . 0.0 114.051 169.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.6 tp -101.34 -32.11 10.63 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.728 1.149 . . . . 0.0 111.638 -175.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -87.0 65.8 9.13 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 127.503 2.321 . . . . 0.0 111.133 -178.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -138.07 167.73 18.93 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 125.769 1.628 . . . . 0.0 110.541 -174.481 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -66.31 -103.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.553 1.432 1 C-N-CA 125.622 4.215 . . . . 0.0 111.059 169.037 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.0 p -37.56 -45.89 0.79 Allowed 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 128.347 2.659 . . . . 0.0 113.175 169.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.55 ' HG2' HD13 ' A' ' 58' ' ' LEU . 5.1 ttm180 -62.83 -42.45 99.74 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.108 0.867 . . . . 0.0 111.621 -171.579 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 19.5 t -58.27 -53.5 57.6 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 118.324 0.511 . . . . 0.0 110.385 168.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 -53.84 -36.38 62.5 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 178.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.457 HG13 ' HA ' ' A' ' 23' ' ' ARG . 1.5 mt -48.75 -58.43 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 CA-C-N 119.593 1.088 . . . . 0.0 109.039 170.616 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 79.0 mt -66.21 -37.45 85.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.435 -171.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.442 HG12 HD21 ' A' ' 86' ' ' LEU . 0.9 OUTLIER -69.33 -31.9 51.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 122.719 0.407 . . . . 0.0 111.934 177.513 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.02 -30.47 31.47 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.356 1.062 . . . . 0.0 112.709 177.355 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.42 ' O ' HG13 ' A' ' 34' ' ' VAL . 1.0 OUTLIER -65.47 -35.51 81.13 Favored 'General case' 0 C--O 1.224 -0.243 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 177.911 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.3 mt -46.18 -21.59 0.17 Allowed 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 117.3 -1.333 . . . . 0.0 114.55 169.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -122.38 -35.04 3.18 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 126.392 1.877 . . . . 0.0 113.815 178.18 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.9 -76.54 0.94 Allowed Glycine 0 N--CA 1.475 1.253 0 C-N-CA 127.043 2.259 . . . . 0.0 113.172 -170.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.42 HG13 ' O ' ' A' ' 30' ' ' LEU . 1.4 m 45.44 31.29 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 C-N-CA 125.283 1.433 . . . . 0.0 114.82 178.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 32.8 m -88.16 -79.3 0.3 Allowed 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.141 0.976 . . . . 0.0 112.888 -178.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.476 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 2.5 m-85 -140.54 154.86 69.74 Favored Pre-proline 0 N--CA 1.478 0.961 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -168.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -66.41 16.05 0.11 Allowed 'Trans proline' 0 CA--C 1.55 1.322 0 C-N-CA 124.668 3.579 . . . . 0.0 115.068 171.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -124.21 -10.37 5.16 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 125.885 1.707 . . . . 0.0 113.688 168.003 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.476 ' HG2' ' H ' ' A' ' 36' ' ' TYR . 0.0 OUTLIER -71.59 -39.75 70.33 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.695 1.747 . . . . 0.0 111.115 -174.301 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.7 mt -57.18 -19.2 19.21 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 123.925 0.89 . . . . 0.0 112.915 173.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.19 -30.99 71.94 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 120.019 1.281 . . . . 0.0 112.036 -179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.81 -49.96 11.22 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.565 0.746 . . . . 0.0 111.304 173.114 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -53.89 -31.11 48.79 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.409 HD11 HG12 ' A' ' 26' ' ' ILE . 60.0 mt -102.52 -7.6 21.74 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.848 1.659 . . . . 0.0 112.995 -177.432 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.27 0.72 8.17 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.272 1.415 . . . . 0.0 114.069 -173.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.5 mp -110.76 144.21 40.08 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 124.334 1.054 . . . . 0.0 111.864 -169.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.9 t -59.42 149.22 29.99 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 121.932 0.873 . . . . 0.0 111.205 177.501 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -63.42 -16.24 59.96 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.966 1.098 . . . . 0.0 113.966 -170.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.8 p -71.34 -48.3 51.18 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.065 1.302 . . . . 0.0 112.043 168.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -60.67 -43.1 98.06 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.219 0.918 . . . . 0.0 111.48 172.11 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 69.6 t -62.84 -40.95 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 O-C-N 121.827 -0.546 . . . . 0.0 111.34 176.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 73.8 m -62.14 -36.93 83.3 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 178.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -56.39 -41.54 76.45 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.138 0.575 . . . . 0.0 111.778 172.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -73.66 -35.23 65.22 Favored 'General case' 0 CA--C 1.558 1.288 0 O-C-N 121.264 -0.897 . . . . 0.0 112.805 174.202 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.1 mt -69.88 -37.02 75.91 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 120.607 1.549 . . . . 0.0 114.127 176.301 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 38.9 m -54.61 -39.72 68.17 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.926 1.239 . . . . 0.0 113.094 -177.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 9.0 t -67.63 -43.53 80.16 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 118.578 0.626 . . . . 0.0 112.021 175.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.55 HD13 ' HG2' ' A' ' 23' ' ' ARG . 3.3 tp -61.96 -37.33 84.35 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 127.94 2.496 . . . . 0.0 112.823 -175.706 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.0 mtm105 -82.35 2.45 32.25 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.34 1.856 . . . . 0.0 112.721 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -112.63 -45.16 0.79 Allowed Glycine 0 N--CA 1.475 1.241 0 C-N-CA 126.582 2.039 . . . . 0.0 112.352 173.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 98.6 m -66.01 3.31 0.86 Allowed 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 127.2 2.2 . . . . 0.0 113.751 171.462 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 58.21 35.89 79.99 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 125.625 1.583 . . . . 0.0 113.687 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.6 mt -86.56 -29.07 22.92 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.563 1.145 . . . . 0.0 112.698 173.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.1 m -140.17 143.84 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 125.39 1.476 . . . . 0.0 112.115 -175.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.4 t -131.12 142.81 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 125.98 1.712 . . . . 0.0 110.236 -174.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.08 158.35 35.88 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.475 1.91 . . . . 0.0 113.961 176.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.3 m -156.67 174.71 15.05 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 168.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -111.07 119.34 38.7 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.481 0.712 . . . . 0.0 110.519 169.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -77.42 -157.32 0.09 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.248 0.619 . . . . 0.0 110.767 167.326 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.86 -24.9 68.74 Favored Glycine 0 CA--C 1.537 1.465 0 O-C-N 119.479 -2.013 . . . . 0.0 115.819 -171.578 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -157.18 2.0 0.12 Allowed 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.298 1.549 . . . . 0.0 114.861 172.247 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -125.39 164.23 20.87 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 126.017 1.727 . . . . 0.0 109.584 -179.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 30.7 m -79.21 150.75 5.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 166.238 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -125.57 179.86 4.95 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.411 1.485 . . . . 0.0 110.205 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.412 ' O ' HG12 ' A' ' 34' ' ' VAL . 35.4 m-85 -142.87 132.06 23.24 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 124.443 1.097 . . . . 0.0 110.849 174.392 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.78 162.01 29.42 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.793 2.037 . . . . 0.0 110.079 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.0 mp -57.47 149.52 20.77 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 119.026 0.83 . . . . 0.0 110.293 169.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.5 -21.03 66.18 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 114.684 1.364 . . . . 0.0 114.684 -172.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -170.92 173.44 5.16 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 122.416 1.103 . . . . 0.0 113.223 168.504 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 52.9 p -40.5 -31.3 0.14 Allowed 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 128.958 2.903 . . . . 0.0 112.284 165.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -44.16 -76.27 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 127.379 2.272 . . . . 0.0 112.762 168.047 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.665 ' H ' HD22 ' A' ' 82' ' ' LEU . 0.0 OUTLIER -71.17 -28.69 64.43 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -171.635 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.5 -45.51 93.9 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.125 0.97 . . . . 0.0 111.586 177.025 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . 0.281 3.1 ppt_? -72.66 -46.12 55.51 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.618 177.112 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.09 -42.51 90.64 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 179.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.442 HD21 HG12 ' A' ' 28' ' ' VAL . 3.1 tt -73.54 -43.46 59.87 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.534 -0.729 . . . . 0.0 110.408 175.173 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.88 -35.92 57.94 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.261 0.934 . . . . 0.0 113.753 -172.227 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -78.21 -3.56 43.29 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.858 1.263 . . . . 0.0 112.353 169.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 54.8 tp 67.48 107.73 0.04 OUTLIER 'General case' 0 C--N 1.342 0.275 0 C-N-CA 129.028 2.931 . . . . 0.0 111.579 169.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.7 m -66.59 23.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 125.999 1.72 . . . . 0.0 114.424 178.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.406 ' C ' ' H ' ' A' ' 93' ' ' VAL . 28.1 mm-40 83.07 -13.93 0.77 Allowed 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.399 -1.438 . . . . 0.0 112.116 152.338 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 14.4 p -54.77 32.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.525 1 C-N-CA 133.166 4.587 . . . . 0.0 116.475 169.007 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.406 ' H ' ' C ' ' A' ' 91' ' ' GLN . 2.1 t 58.48 31.32 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 128.193 2.597 . . . . 0.0 111.533 168.647 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 79.37 113.87 0.07 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 127.589 2.356 . . . . 0.0 105.715 -165.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.51 64.68 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 127.201 2.2 . . . . 0.0 114.803 -179.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -51.57 161.16 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 127.631 2.372 . . . . 0.0 113.008 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.03 16.67 7.93 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 128.542 2.737 . . . . 0.0 114.422 -172.485 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 10.2 p -86.98 150.19 24.24 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.229 1.411 . . . . 0.0 112.402 176.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -140.7 139.99 34.83 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.904 1.682 . . . . 0.0 110.623 176.236 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -163.05 158.61 18.4 Favored Pre-proline 0 CA--C 1.541 0.609 0 O-C-N 120.32 -1.488 . . . . 0.0 111.727 -166.515 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -73.6 174.66 11.86 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 122.478 2.118 . . . . 0.0 108.275 165.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 48.9 t -50.97 143.46 10.24 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 123.182 1.468 . . . . 0.0 114.033 -171.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 85.9 t -54.62 -31.98 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 C-N-CA 126.016 1.726 . . . . 0.0 111.669 178.07 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.5 -23.47 63.62 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 177.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -112.93 11.67 19.19 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.186 1.794 . . . . 0.0 113.557 177.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.536 0.422 0 C-N-CA 124.804 1.242 . . . . 0.0 113.3 -172.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.137 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.64 -34.4 72.01 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 117.479 -1.248 . . . . 0.0 113.437 -168.541 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.24 -57.73 9.5 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.858 1.663 . . . . 0.0 111.425 174.326 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 13.9 mtp85 -54.46 -38.96 66.97 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.173 1.389 . . . . 0.0 112.398 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -76.22 -54.01 7.42 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.319 1.448 . . . . 0.0 112.497 177.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -73.42 -14.75 79.24 Favored Glycine 0 CA--C 1.53 1.009 0 CA-C-O 117.907 -1.496 . . . . 0.0 112.704 -174.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 62.1 mtt-85 -57.9 -12.79 3.5 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 119.947 1.873 . . . . 0.0 113.658 168.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -122.41 -1.44 9.12 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.026 1.73 . . . . 0.0 113.978 170.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 3.9 tp -106.91 -30.3 8.95 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.615 1.098 . . . . 0.0 111.566 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.22 66.61 9.81 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.405 2.282 . . . . 0.0 110.331 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 20' ' ' ASP . . . . . 0.484 ' CB ' ' HB3' ' B' ' 23' ' ' ARG . 0.3 OUTLIER -138.61 162.93 50.34 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 125.724 1.61 . . . . 0.0 111.343 -171.851 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -69.65 -100.54 0.01 OUTLIER 'Trans proline' 0 CA--C 1.551 1.337 0 C-N-CA 125.184 3.922 . . . . 0.0 109.584 169.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 22.7 p -36.74 -46.4 0.6 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 129.028 2.931 . . . . 0.0 113.458 168.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.484 ' HB3' ' CB ' ' B' ' 20' ' ' ASP . 7.4 ttm180 -70.9 -37.06 72.95 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.582 1.083 . . . . 0.0 112.947 -171.109 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 12.1 t -60.03 -52.47 65.24 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.853 0.835 . . . . 0.0 109.254 167.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 3.9 mmt85 -55.65 -36.75 67.39 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 177.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 26' ' ' ILE . . . . . 0.608 HG12 HD11 ' B' ' 44' ' ' LEU . 1.7 mt -49.9 -60.1 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 CA-C-N 119.756 1.162 . . . . 0.0 108.945 171.325 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 87.9 mt -63.78 -38.8 92.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 118.144 -0.932 . . . . 0.0 111.748 -173.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 28' ' ' VAL . . . . . 0.475 HG12 HD21 ' B' ' 86' ' ' LEU . 1.0 OUTLIER -68.93 -33.72 60.54 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-N 119.149 0.886 . . . . 0.0 111.881 177.659 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.44 -23.99 27.64 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.664 0.786 . . . . 0.0 113.028 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.406 ' O ' HG13 ' B' ' 34' ' ' VAL . 0.9 OUTLIER -63.06 -45.05 94.02 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 117.749 -1.12 . . . . 0.0 112.27 171.819 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -42.61 -43.16 3.68 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.719 2.408 . . . . 0.0 113.573 -174.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -100.47 -31.85 11.09 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.104 1.762 . . . . 0.0 112.67 177.389 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.04 -61.03 2.17 Favored Glycine 0 C--N 1.343 0.937 0 C-N-CA 124.542 1.068 . . . . 0.0 113.933 -171.012 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 34' ' ' VAL . . . . . 0.46 HG12 ' O ' ' B' ' 75' ' ' TYR . 0.2 OUTLIER 30.91 46.59 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 C-N-CA 127.598 2.359 . . . . 0.0 115.192 178.974 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 3.3 m -107.73 -67.91 0.93 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.665 1.586 . . . . 0.0 112.777 -176.185 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -143.17 152.77 58.77 Favored Pre-proline 0 N--CA 1.476 0.839 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -167.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -68.27 8.93 0.44 Allowed 'Trans proline' 0 CA--C 1.55 1.289 0 C-N-CA 124.689 3.593 . . . . 0.0 113.764 168.247 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -122.43 -10.18 6.17 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 125.811 1.672 . . . . 0.0 113.754 168.286 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.51 -40.11 80.98 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 119.717 1.758 . . . . 0.0 110.331 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 47.7 mt -63.14 -11.34 19.64 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 124.05 0.94 . . . . 0.0 112.355 -179.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -73.2 -33.69 65.53 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 119.743 -0.783 . . . . 0.0 111.003 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.56 -53.46 10.48 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.173 0.989 . . . . 0.0 110.34 169.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -52.62 -30.86 33.69 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 -178.615 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.678 HD12 HG22 ' B' ' 51' ' ' VAL . 65.5 mt -102.4 -18.78 15.22 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.319 1.447 . . . . 0.0 113.349 -178.024 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.51 -1.54 56.92 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.555 1.074 . . . . 0.0 113.854 -170.314 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 8.5 mp -110.95 146.94 35.71 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 119.222 1.511 . . . . 0.0 112.313 -174.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 8.9 t -56.37 150.52 14.68 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 122.291 1.043 . . . . 0.0 112.383 176.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -63.98 -14.18 52.05 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -171.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 13.5 p -72.66 -44.01 62.39 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 120.144 1.338 . . . . 0.0 112.235 169.316 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -61.27 -44.7 96.8 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.673 0.669 . . . . 0.0 111.506 170.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 51' ' ' VAL . . . . . 0.678 HG22 HD12 ' B' ' 44' ' ' LEU . 52.6 t -57.73 -47.54 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.831 174.138 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 75.5 m -59.53 -40.3 86.72 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.86 0.864 . . . . 0.0 113.155 -177.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -54.32 -46.26 72.81 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.921 0.888 . . . . 0.0 112.086 171.377 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -73.67 -28.22 61.64 Favored 'General case' 0 CA--C 1.558 1.27 0 O-C-N 121.141 -0.974 . . . . 0.0 112.682 176.567 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 45.3 mt -73.66 -33.98 64.72 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 120.864 1.665 . . . . 0.0 113.613 174.518 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 33.6 m -52.78 -40.67 63.39 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.447 1.022 . . . . 0.0 113.461 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.2 t -70.16 -39.64 75.22 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.208 0.913 . . . . 0.0 112.329 177.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 2.3 tp -60.95 -47.47 86.27 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 128.071 2.548 . . . . 0.0 111.688 -174.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 33.1 mtm105 -80.17 4.75 16.42 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.827 1.651 . . . . 0.0 112.214 177.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -106.22 -47.62 1.06 Allowed Glycine 0 CA--C 1.532 1.112 0 C-N-CA 125.958 1.742 . . . . 0.0 112.02 169.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 92.8 m -76.56 13.74 0.92 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 126.514 1.925 . . . . 0.0 114.431 177.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.03 29.06 69.92 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 125.731 1.634 . . . . 0.0 114.418 174.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 24.9 mt -80.78 -26.49 37.17 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.377 -1.072 . . . . 0.0 112.943 176.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.5 m -147.17 152.3 13.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 126.152 1.781 . . . . 0.0 112.572 -171.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -130.13 158.12 42.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.783 1.633 . . . . 0.0 111.187 173.778 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.53 161.08 30.1 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.04 1.336 . . . . 0.0 112.267 167.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.401 HG22 ' H ' ' B' ' 68' ' ' TYR . 1.1 m -156.56 176.71 12.35 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.583 1.553 . . . . 0.0 107.046 168.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.401 ' H ' HG22 ' B' ' 67' ' ' THR . 38.6 t80 -117.52 118.88 33.36 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.928 0.891 . . . . 0.0 111.344 172.544 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.25 1.2 pp20? -77.32 -151.96 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.457 0.703 . . . . 0.0 111.233 167.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -66.98 -24.79 73.2 Favored Glycine 0 CA--C 1.54 1.594 0 O-C-N 119.572 -1.955 . . . . 0.0 116.035 -173.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 5.4 ttp85 -158.71 0.32 0.09 Allowed 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 119.263 1.532 . . . . 0.0 114.528 174.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -124.98 162.93 23.43 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 126.11 1.764 . . . . 0.0 109.327 -178.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 20.8 m -80.29 152.44 4.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 O-C-N 121.709 -0.619 . . . . 0.0 109.415 165.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 8.0 ptt180 -124.62 172.47 9.22 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.263 1.425 . . . . 0.0 110.331 174.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.46 ' O ' HG12 ' B' ' 34' ' ' VAL . 28.3 m-85 -120.7 143.79 48.56 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.321 1.048 . . . . 0.0 110.027 167.685 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -142.02 149.45 40.0 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.566 1.546 . . . . 0.0 110.566 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 6.1 mp -52.93 146.78 10.25 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 119.216 0.916 . . . . 0.0 109.138 169.185 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.17 -16.22 63.27 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -172.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -169.91 172.4 6.63 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 123.055 1.407 . . . . 0.0 112.51 171.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 86.4 p -49.73 -26.13 3.55 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.408 2.283 . . . . 0.0 111.282 163.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 8.5 t60 -60.26 -58.06 10.11 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 128.298 2.639 . . . . 0.0 112.032 179.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.11 -33.15 71.49 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 120.579 1.536 . . . . 0.0 110.25 174.636 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.13 -37.41 82.74 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.949 0.9 . . . . 0.0 112.318 -176.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.26 -44.02 63.45 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-O 117.506 -1.235 . . . . 0.0 111.683 174.589 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.09 -43.72 95.32 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 120.017 1.281 . . . . 0.0 113.518 177.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.475 HD21 HG12 ' B' ' 28' ' ' VAL . 5.0 tt -67.02 -49.78 64.18 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.084 0.954 . . . . 0.0 110.312 174.059 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.81 -33.04 47.78 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.84 1.21 . . . . 0.0 114.623 -167.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -74.11 -10.96 60.14 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 118.958 1.379 . . . . 0.0 112.201 169.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 57.9 tp 69.66 110.3 0.05 Allowed 'General case' 0 C--O 1.235 0.303 0 C-N-CA 129.59 3.156 . . . . 0.0 110.939 171.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 21.0 m -66.32 23.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 C-N-CA 126.295 1.838 . . . . 0.0 114.286 177.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 91' ' ' GLN . . . . . 0.426 ' C ' ' H ' ' B' ' 93' ' ' VAL . 24.6 mm-40 78.22 -9.63 1.48 Allowed 'General case' 0 C--N 1.327 -0.402 0 O-C-N 120.43 -1.419 . . . . 0.0 113.166 156.323 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 11.2 p -54.22 26.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.25 1 C-N-CA 132.226 4.21 . . . . 0.0 115.993 167.741 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 93' ' ' VAL . . . . . 0.426 ' H ' ' C ' ' B' ' 91' ' ' GLN . 1.8 t 60.29 31.71 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 127.044 2.138 . . . . 0.0 111.589 167.52 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 80.86 112.33 0.07 Allowed 'General case' 0 C--N 1.347 0.485 0 C-N-CA 127.697 2.399 . . . . 0.0 106.338 -167.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.0 64.05 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 128.38 2.672 . . . . 0.0 114.861 176.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -54.54 150.48 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 126.723 2.009 . . . . 0.0 112.481 -177.3 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.61 13.5 0.35 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 130.042 3.337 . . . . 0.0 116.092 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 12.5 p -86.01 147.34 26.25 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.998 0.919 . . . . 0.0 112.122 173.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 99' ' ' ASP . . . . . 0.42 ' CG ' HH21 ' A' ' 16' ' ' ARG . 48.9 t0 -139.67 136.59 34.43 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.219 1.807 . . . . 0.0 111.587 175.799 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -164.47 155.05 12.94 Favored Pre-proline 0 CA--C 1.536 0.42 0 O-C-N 120.449 -1.407 . . . . 0.0 111.675 -167.626 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -73.29 172.38 15.73 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 122.244 1.963 . . . . 0.0 108.885 166.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 43.5 t -51.83 143.0 14.03 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 126.358 2.98 . . . . 0.0 114.187 -169.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.456 ' HA ' ' HB2' ' B' ' 106' ' ' ARG . 19.1 m -70.64 -18.78 21.31 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-N 109.752 -3.385 . . . . 0.0 112.47 -172.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.81 -24.11 61.67 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.127 0.971 . . . . 0.0 113.003 169.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -118.88 12.8 12.99 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 126.506 1.922 . . . . 0.0 114.205 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 106' ' ' ARG . . . . . 0.456 ' HB2' ' HA ' ' B' ' 103' ' ' VAL . 0.6 OUTLIER . . . . . 0 CA--C 1.536 0.429 0 C-N-CA 124.824 1.25 . . . . 0.0 113.399 -174.568 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.826 0 CA-C-O 122.635 1.207 . . . . 0.0 110.169 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -102.09 -37.81 8.0 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-O 117.287 -1.34 . . . . 0.0 113.568 -169.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.72 -37.99 63.87 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 121.611 2.005 . . . . 0.0 113.663 -172.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.551 HH21 ' HB3' ' A' ' 61' ' ' CYS . 0.0 OUTLIER -53.68 -23.26 10.87 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.645 0.979 . . . . 0.0 113.645 177.599 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.416 ' HG ' HG23 ' B' ' 92' ' ' VAL . 3.1 tm? -56.14 -41.82 75.96 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.29 1.836 . . . . 0.0 111.92 174.409 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.38 -35.8 92.54 Favored Glycine 0 CA--C 1.53 0.993 0 CA-C-N 120.388 1.449 . . . . 0.0 112.114 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.66 -45.71 61.17 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.803 0.841 . . . . 0.0 110.986 170.196 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.92 -24.17 67.63 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.728 1.149 . . . . 0.0 112.862 -178.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.7 mp -82.26 -28.39 31.85 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.014 0.825 . . . . 0.0 112.712 169.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -87.91 67.23 8.98 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.559 1.944 . . . . 0.0 112.831 173.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.536 ' HB3' HH11 ' A' ' 23' ' ' ARG . 31.3 t70 -143.55 135.86 13.33 Favored Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 128.241 2.616 . . . . 0.0 107.353 -176.615 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -52.68 -102.74 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.902 1 C-N-CA 127.26 5.307 . . . . 0.0 116.722 -163.677 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.4 m -56.0 -30.72 62.25 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.573 1.149 . . . . 0.0 110.511 -177.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.607 HH21 HD12 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -50.33 -42.08 52.26 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 172.717 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 36.8 t -58.7 -43.48 90.07 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.314 -0.866 . . . . 0.0 111.346 175.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.5 tpt180 -63.67 -29.47 70.7 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 118.051 -0.976 . . . . 0.0 112.118 174.009 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.491 HG13 ' HA ' ' A' ' 23' ' ' ARG . 1.6 mt -62.56 -53.57 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 120.756 1.616 . . . . 0.0 110.999 167.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.607 HD12 HH21 ' A' ' 23' ' ' ARG . 8.5 mt -60.17 -39.47 86.54 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 117.704 -1.141 . . . . 0.0 112.608 -177.263 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -68.73 -27.35 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 CA-C-N 120.292 1.406 . . . . 0.0 112.825 175.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.432 ' HB1' ' CD2' ' A' ' 43' ' ' HIS . . . -82.25 1.5 36.36 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 126.167 1.787 . . . . 0.0 114.222 169.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.64 -20.0 14.59 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 120.651 -1.281 . . . . 0.0 111.853 168.833 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.2 mt -66.79 -44.64 80.75 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.375 1.47 . . . . 0.0 109.218 165.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -132.49 95.94 3.73 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.666 1.986 . . . . 0.0 110.99 168.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -179.22 -83.48 0.06 OUTLIER Glycine 0 N--CA 1.468 0.769 0 C-N-CA 125.999 1.761 . . . . 0.0 110.592 171.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 19.5 m 43.06 25.37 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 116.881 2.178 . . . . 0.0 116.881 171.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 99.1 m -83.61 -76.48 0.29 Allowed 'General case' 0 C--O 1.223 -0.307 0 O-C-N 121.047 -1.033 . . . . 0.0 109.919 178.099 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.417 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 0.2 OUTLIER -139.38 159.71 64.84 Favored Pre-proline 0 CA--C 1.54 0.578 0 CA-C-O 118.549 -0.739 . . . . 0.0 112.902 -170.532 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -57.27 -18.8 31.81 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.183 2.588 . . . . 0.0 114.819 175.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -97.18 -6.48 57.74 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 118.175 -1.347 . . . . 0.0 115.766 172.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.417 ' HG2' ' H ' ' A' ' 36' ' ' TYR . 0.0 OUTLIER -70.37 -28.7 65.31 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.43 2.115 . . . . 0.0 113.143 -170.429 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 23.4 mt -63.75 -18.67 64.29 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 123.839 0.856 . . . . 0.0 111.717 178.576 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.24 -45.03 68.58 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.273 0.629 . . . . 0.0 111.496 177.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.46 -41.02 69.92 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.786 0.834 . . . . 0.0 112.151 176.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.432 ' CD2' ' HB1' ' A' ' 29' ' ' ALA . 14.0 m-70 -64.04 -21.37 66.48 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.903 1.446 . . . . 0.0 114.903 176.31 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 86.8 mt -115.32 -15.59 11.56 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.803 1.641 . . . . 0.0 114.029 -172.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.7 4.14 57.0 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.021 0.82 . . . . 0.0 113.405 -170.292 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 71.9 mt -102.31 172.86 6.64 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.814 1.246 . . . . 0.0 111.286 -176.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.1 p -86.27 158.34 19.72 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.503 -0.748 . . . . 0.0 110.065 175.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -61.92 -21.33 64.66 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 174.576 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.0 p -73.52 -52.58 13.05 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.078 -1.013 . . . . 0.0 109.712 168.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -69.77 -30.05 67.53 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.009 0.924 . . . . 0.0 112.505 -173.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 80.0 t -67.25 -30.26 48.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 O-C-N 120.681 -1.262 . . . . 0.0 111.769 167.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 74.3 m -70.52 -16.11 62.85 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.607 -1.308 . . . . 0.0 114.091 -175.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -54.2 -58.95 5.44 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.761 0.824 . . . . 0.0 110.635 169.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -77.02 -14.81 59.79 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-O 117.837 -1.078 . . . . 0.0 113.78 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 92.9 mt -70.81 -26.99 63.56 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 121.241 1.837 . . . . 0.0 111.668 169.066 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 65.1 p -59.26 -47.32 85.79 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 -175.295 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.9 t -72.97 -38.12 66.83 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.766 0.712 . . . . 0.0 111.829 172.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.5 tp -51.1 -48.86 61.58 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.202 1.001 . . . . 0.0 112.397 176.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.478 ' HG2' HG23 ' A' ' 64' ' ' VAL . 43.8 mtm180 -88.96 -5.54 57.89 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.627 1.571 . . . . 0.0 113.56 -176.779 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -100.9 -41.48 2.65 Favored Glycine 0 N--CA 1.474 1.2 0 C-N-CA 125.538 1.542 . . . . 0.0 112.811 175.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.551 ' HB3' HH21 ' A' ' 13' ' ' ARG . 3.8 m -77.44 8.73 3.87 Favored 'General case' 0 CA--C 1.552 1.051 0 O-C-N 120.832 -1.393 . . . . 0.0 113.297 169.729 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 58.41 34.65 75.92 Favored Glycine 0 CA--C 1.533 1.191 0 O-C-N 120.904 -1.123 . . . . 0.0 114.045 176.394 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 26.2 mt -82.38 -25.88 33.38 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.275 1.538 . . . . 0.0 111.989 171.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.478 HG23 ' HG2' ' A' ' 59' ' ' ARG . 2.5 m -133.98 149.3 30.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 127.34 2.256 . . . . 0.0 109.366 176.257 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.6 t -129.08 135.82 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 C-N-CA 124.995 1.318 . . . . 0.0 109.883 -176.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.72 148.23 44.87 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.671 1.189 . . . . 0.0 112.863 171.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 34.2 m -160.0 162.77 34.37 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.498 1.919 . . . . 0.0 106.584 -178.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -87.65 138.74 31.2 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.136 1.334 . . . . 0.0 110.917 169.072 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.98 -20.2 39.01 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 118.318 0.508 . . . . 0.0 112.239 169.515 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 139.76 -47.31 0.9 Allowed Glycine 0 CA--C 1.528 0.906 0 C-N-CA 126.009 1.766 . . . . 0.0 112.237 175.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 19.8 ttp180 -101.0 -29.67 12.05 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.562 1.945 . . . . 0.0 112.027 171.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.13 171.21 13.93 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.662 1.985 . . . . 0.0 110.913 -170.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 13.0 p -87.35 144.46 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 124.011 0.924 . . . . 0.0 109.438 169.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -128.8 174.22 9.66 Favored 'General case' 0 CA--C 1.522 -0.126 0 C-N-CA 126.244 1.818 . . . . 0.0 109.718 178.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -117.23 170.85 8.36 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.373 1.069 . . . . 0.0 109.08 166.511 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -164.97 154.97 13.5 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.46 1.904 . . . . 0.0 109.246 177.39 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 tp -56.71 142.44 40.22 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.315 0.961 . . . . 0.0 111.683 171.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -83.39 11.34 6.97 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 116.224 1.935 . . . . 0.0 116.224 -169.178 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.2 t0 165.65 144.87 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 128.69 2.796 . . . . 0.0 110.874 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 83.8 p -45.67 -29.87 1.39 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.924 2.089 . . . . 0.0 114.074 167.111 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -61.93 -49.74 74.93 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 124.062 0.945 . . . . 0.0 112.744 174.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 54.0 mt -60.85 -42.71 98.36 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 176.142 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.97 -34.08 65.38 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.617 1.167 . . . . 0.0 112.014 -174.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.7 mtt-85 -71.79 -60.68 2.11 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.417 1.087 . . . . 0.0 113.212 177.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.45 -34.6 75.69 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 120.309 1.413 . . . . 0.0 112.543 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 70.0 tp -62.46 -49.73 74.28 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.659 1.584 . . . . 0.0 110.795 169.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -67.93 -39.82 89.23 Favored Glycine 0 N--CA 1.475 1.239 0 C-N-CA 126.616 2.055 . . . . 0.0 113.926 -176.233 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 51.9 tp10 -64.79 -8.23 14.21 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 127.763 2.425 . . . . 0.0 112.713 168.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.3 tp 67.69 36.38 3.64 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 128.721 2.808 . . . . 0.0 110.6 169.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 3.8 m 48.63 -18.05 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 131.483 3.913 . . . . 0.0 117.366 -168.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 56.2 mm-40 69.94 -7.39 0.94 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 128.271 2.628 . . . . 0.0 114.076 -174.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.439 HG13 ' H ' ' A' ' 92' ' ' VAL . 0.7 OUTLIER -66.61 -10.38 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 C-N-CA 126.39 1.876 . . . . 0.0 114.467 170.813 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 79.5 42.57 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.043 0 C-N-CA 129.937 3.295 . . . . 0.0 113.158 168.071 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 tt 78.09 95.85 0.06 Allowed 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 123.614 1.673 . . . . 0.0 109.09 -168.202 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -49.55 70.72 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 128.355 2.662 . . . . 0.0 116.336 169.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 94.1 t -58.73 130.97 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 N-CA-C 106.09 -1.818 . . . . 0.0 106.09 165.212 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.598 ' HA ' ' HB3' ' B' ' 12' ' ' ALA . 29.0 t70 -60.93 -80.3 0.03 OUTLIER 'General case' 0 C--O 1.235 0.33 0 O-C-N 123.905 0.753 . . . . 0.0 112.294 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 5.7 p 66.24 132.59 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 128.785 2.834 . . . . 0.0 108.777 -169.199 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -84.92 83.67 7.97 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 120.974 1.715 . . . . 0.0 110.011 178.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.52 151.23 76.94 Favored Pre-proline 0 CA--C 1.551 1.007 0 CA-C-N 114.042 -1.435 . . . . 0.0 109.717 177.188 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -86.17 -102.39 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 124.083 3.189 . . . . 0.0 108.196 174.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 34.9 t -65.51 141.05 58.6 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 123.438 1.589 . . . . 0.0 109.784 165.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 19.2 m -104.85 6.04 10.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 112.657 -2.065 . . . . 0.0 111.541 -171.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.59 -37.15 85.81 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.897 1.279 . . . . 0.0 111.445 168.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -104.18 11.64 34.78 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.344 1.858 . . . . 0.0 111.437 -175.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.349 0.55 0 O-C-N 120.738 -1.226 . . . . 0.0 111.448 -177.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.294 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -73.31 4.0 5.16 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 -169.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.598 ' HB3' ' HA ' ' A' ' 97' ' ' ASP . . . -82.22 -39.82 22.54 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 121.016 1.734 . . . . 0.0 111.154 166.481 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -59.07 -21.37 59.06 Favored 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 124.583 1.153 . . . . 0.0 111.518 176.259 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -47.78 -47.07 30.87 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.976 2.511 . . . . 0.0 111.668 165.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.07 -15.0 69.1 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-O 119.139 -0.812 . . . . 0.0 112.557 -175.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.39 -56.25 4.59 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 166.303 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.24 -27.81 68.72 Favored 'General case' 0 CA--C 1.549 0.914 0 N-CA-C 115.583 1.698 . . . . 0.0 115.583 -173.13 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 5.8 mp -84.19 -20.05 33.01 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 119.284 0.947 . . . . 0.0 113.458 171.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.6 51.88 1.95 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.092 1.357 . . . . 0.0 110.995 169.056 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -117.21 146.85 39.14 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 127.511 2.325 . . . . 0.0 107.808 176.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -59.78 -94.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.929 1 C-N-CA 126.248 4.632 . . . . 0.0 113.663 -168.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.3 m -58.54 -24.23 60.17 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 120.773 -1.204 . . . . 0.0 111.213 175.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.465 ' HD3' ' CD1' ' B' ' 58' ' ' LEU . 13.1 ttm-85 -70.72 -41.22 72.18 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 113.977 1.102 . . . . 0.0 113.977 -178.538 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 38.1 t -56.02 -42.62 76.76 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.84 1.2 . . . . 0.0 109.449 169.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -64.66 -33.87 76.95 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 116.936 -1.507 . . . . 0.0 113.179 174.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.5 mt -56.8 -62.75 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 CA-C-N 121.317 1.871 . . . . 0.0 108.419 168.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 41.2 mt -54.88 -43.13 72.9 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.155 -0.926 . . . . 0.0 112.204 -170.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.9 p -74.59 -19.49 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-N 119.535 1.061 . . . . 0.0 113.197 -178.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.57 -27.46 21.36 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.486 1.515 . . . . 0.0 112.629 172.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.82 -47.02 83.83 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 125.5 1.52 . . . . 0.0 109.523 170.43 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.36 -61.11 1.8 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 129.946 3.298 . . . . 0.0 112.252 179.342 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 32' ' ' ASP . . . . . 0.441 ' O ' ' HE1' ' B' ' 43' ' ' HIS . 26.1 t0 -95.53 34.73 1.43 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.929 2.492 . . . . 0.0 110.395 174.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -128.92 -80.75 0.27 Allowed Glycine 0 C--N 1.337 0.613 0 C-N-CA 125.281 1.42 . . . . 0.0 113.532 -173.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 27.5 m 27.79 24.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 N-CA-C 119.651 3.204 . . . . 0.0 119.651 -174.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 76.1 m -83.7 -67.28 0.8 Allowed 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 121.331 1.878 . . . . 0.0 112.138 -178.197 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -147.15 162.57 32.24 Favored Pre-proline 0 CA--C 1.54 0.566 0 CA-C-O 117.919 -1.039 . . . . 0.0 111.231 -173.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -55.65 -27.5 61.12 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 122.7 2.267 . . . . 0.0 112.983 169.28 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -83.83 -3.9 89.08 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 117.432 -1.76 . . . . 0.0 115.521 175.011 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.62 -36.92 57.14 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.953 2.376 . . . . 0.0 112.856 -172.419 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 14.7 mt -62.45 -22.31 66.11 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 123.431 0.693 . . . . 0.0 111.458 -179.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.87 -38.34 64.63 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.553 0.741 . . . . 0.0 111.904 176.373 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -52.61 13.38 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.618 0.767 . . . . 0.0 111.198 176.105 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 43' ' ' HIS . . . . . 0.441 ' HE1' ' O ' ' B' ' 32' ' ' ASP . 24.9 m170 -57.41 -24.16 53.77 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 65.9 mt -108.44 -11.23 15.19 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.603 1.561 . . . . 0.0 113.245 -176.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.36 8.04 42.66 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.292 0.948 . . . . 0.0 113.803 -170.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 53.4 mt -103.81 164.56 11.6 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.773 1.229 . . . . 0.0 112.066 -171.169 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 68.0 p -70.58 146.42 50.1 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.286 -0.884 . . . . 0.0 109.992 174.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 39.8 ptt180 -60.75 -17.07 46.45 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 172.651 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 47.6 p -73.6 -61.03 1.98 Allowed 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 166.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -66.57 -25.26 66.55 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.425 1.011 . . . . 0.0 113.124 -170.09 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 74.7 t -68.95 -31.11 49.2 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 CA-C-N 118.687 0.676 . . . . 0.0 111.896 169.094 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 75.8 m -61.28 -30.3 70.39 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.989 -1.069 . . . . 0.0 112.351 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -57.0 -13.68 2.94 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 128.053 2.541 . . . . 0.0 114.717 173.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -119.23 -8.01 10.19 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 120.325 -1.484 . . . . 0.0 114.411 170.593 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 71.4 mt -81.13 -25.06 37.21 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.067 0.947 . . . . 0.0 111.542 168.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 4.4 p -55.63 -49.63 72.33 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 57' ' ' CYS . . . . . 0.425 ' HB3' ' NH1' ' B' ' 23' ' ' ARG . 7.3 t -72.76 -35.32 67.45 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.765 1.166 . . . . 0.0 111.889 176.301 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.465 ' CD1' ' HD3' ' B' ' 23' ' ' ARG . 1.4 tp -56.91 -52.61 64.47 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.261 2.224 . . . . 0.0 111.726 -176.258 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 28.7 mtm105 -84.4 14.48 4.42 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.747 1.619 . . . . 0.0 111.863 178.178 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -110.17 -50.48 0.67 Allowed Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.712 1.149 . . . . 0.0 111.231 169.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 81.1 m -73.47 3.93 5.46 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 125.99 1.716 . . . . 0.0 113.748 -178.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.56 24.17 70.86 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 118.759 -1.023 . . . . 0.0 113.57 -176.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 63.3 mt -73.46 -21.57 60.4 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.545 1.672 . . . . 0.0 112.522 170.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -145.31 154.5 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 126.982 2.113 . . . . 0.0 110.109 175.234 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 89.8 t -135.23 141.89 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 127.118 2.167 . . . . 0.0 109.331 -177.186 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.12 155.21 22.73 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 123.102 1.429 . . . . 0.0 114.004 174.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 29.5 m -160.27 172.28 17.66 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.711 2.004 . . . . 0.0 107.082 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -92.51 152.39 19.68 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 119.958 1.254 . . . . 0.0 111.72 168.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -96.34 -4.69 41.55 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.151 0.981 . . . . 0.0 112.034 167.528 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 121.0 -34.81 3.89 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 127.14 2.305 . . . . 0.0 112.802 176.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 23.8 ttp180 -120.42 -29.92 4.68 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 130.419 3.487 . . . . 0.0 111.822 -176.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -135.38 171.96 13.7 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 128.425 2.69 . . . . 0.0 110.896 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 8.3 p -87.52 150.23 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.797 1.239 . . . . 0.0 110.283 169.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 31.3 ptt85 -137.25 172.27 13.24 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 126.552 1.941 . . . . 0.0 109.814 -174.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -114.69 171.98 7.31 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.534 0.734 . . . . 0.0 110.201 167.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -160.95 151.05 17.57 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 127.0 2.12 . . . . 0.0 107.919 179.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.3 tp -60.45 157.8 13.3 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.618 1.167 . . . . 0.0 113.193 172.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.84 -30.92 58.68 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 116.366 1.988 . . . . 0.0 116.366 -177.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 42.0 t0 173.49 153.12 0.09 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.345 2.258 . . . . 0.0 109.091 -166.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 90.8 p -44.23 -30.91 0.86 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.191 1.796 . . . . 0.0 112.917 166.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -53.55 -59.01 5.15 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 126.236 1.814 . . . . 0.0 113.763 171.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 21.6 mt -60.77 -44.96 96.11 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.482 1.037 . . . . 0.0 108.202 176.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.6 -33.7 64.2 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.766 1.226 . . . . 0.0 112.262 -172.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 7.6 mtt-85 -70.78 -56.81 5.52 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.352 1.061 . . . . 0.0 113.342 175.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.84 -37.08 83.79 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 120.005 1.275 . . . . 0.0 112.697 -178.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 36.1 tp -63.57 -34.76 78.52 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.424 1.89 . . . . 0.0 111.781 169.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.68 -29.4 29.57 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 126.845 2.164 . . . . 0.0 114.646 -174.463 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -11.24 60.26 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.126 1.463 . . . . 0.0 111.568 167.709 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.5 tp 73.77 133.79 0.05 OUTLIER 'General case' 0 C--N 1.347 0.482 0 C-N-CA 130.903 3.681 . . . . 0.0 106.54 -169.023 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 79.0 t -67.75 5.5 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 -167.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 86.91 -25.18 0.1 Allowed 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.032 -1.042 . . . . 0.0 111.615 138.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.416 HG23 ' HG ' ' A' ' 14' ' ' LEU . 7.2 p -52.85 25.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.83 1 C-N-CA 134.702 5.201 . . . . 0.0 115.264 166.804 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 62.37 14.22 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 126.305 1.842 . . . . 0.0 113.689 171.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 4.7 tt 91.65 104.27 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 128.349 2.659 . . . . 0.0 108.735 -168.375 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.03 65.44 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 115.862 1.801 . . . . 0.0 115.862 176.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 15.5 t -55.24 130.56 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 CA-C-N 119.43 1.014 . . . . 0.0 108.588 166.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -59.04 -89.45 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 125.545 1.538 . . . . 0.0 111.825 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 12.1 p 82.1 157.56 0.13 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 129.645 3.178 . . . . 0.0 112.498 169.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -82.88 36.75 0.51 Allowed 'General case' 0 CA--C 1.544 0.721 0 O-C-N 120.973 -1.079 . . . . 0.0 111.686 172.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -133.04 87.08 40.8 Favored Pre-proline 0 CA--C 1.547 0.835 0 O-C-N 120.373 -1.455 . . . . 0.0 111.395 174.149 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -75.31 4.6 4.76 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 124.508 3.472 . . . . 0.0 114.162 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -158.19 153.51 25.82 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 129.396 3.079 . . . . 0.0 108.276 170.133 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 10.1 m -131.04 11.12 1.93 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 117.534 2.42 . . . . 0.0 117.534 -164.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.98 -21.46 58.77 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 118.88 0.763 . . . . 0.0 112.547 168.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -133.82 16.34 3.91 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 127.698 2.399 . . . . 0.0 112.421 -170.32 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.132 0 O-C-N 119.888 -1.757 . . . . 0.0 113.154 -172.39 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.349 0 CA-C-O 121.609 0.719 . . . . 0.0 112.601 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -12.47 2.81 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 167.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.64 -31.27 24.77 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.951 1.3 . . . . 0.0 112.332 166.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.7 mtm105 -84.18 -32.37 24.63 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.991 1.316 . . . . 0.0 113.458 173.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -54.72 -49.75 69.99 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.834 1.254 . . . . 0.0 109.992 172.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.82 -24.92 70.25 Favored Glycine 0 N--CA 1.473 1.158 0 O-C-N 121.202 -0.937 . . . . 0.0 113.476 176.025 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.86 1.27 15.49 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.896 1.278 . . . . 0.0 112.336 173.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -118.41 -38.59 3.14 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.234 1.414 . . . . 0.0 111.848 167.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mp -86.18 -8.76 57.58 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -175.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -128.09 35.53 4.43 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.337 1.455 . . . . 0.0 110.698 167.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -114.59 144.42 31.81 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 127.379 2.271 . . . . 0.0 106.38 176.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -54.29 -94.41 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.791 1 C-N-CA 126.15 4.567 . . . . 0.0 114.314 -166.58 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.3 t -60.25 -23.86 64.42 Favored 'General case' 0 C--O 1.223 -0.342 0 O-C-N 121.375 -0.828 . . . . 0.0 111.51 175.014 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -69.73 -34.87 74.44 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.253 1.388 . . . . 0.0 113.783 -178.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.6 t -70.05 -36.82 75.28 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 121.44 1.927 . . . . 0.0 110.53 169.201 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.1 mtm180 -59.35 -46.98 87.14 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-O 117.65 -1.166 . . . . 0.0 112.532 172.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.466 HG12 HD11 ' A' ' 44' ' ' LEU . 1.1 mt -44.89 -56.88 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 CA-C-N 121.137 1.789 . . . . 0.0 110.307 172.19 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 94.8 mt -61.8 -41.39 97.69 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 117.702 -1.142 . . . . 0.0 111.545 -175.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.8 p -75.21 -27.76 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-N 120.793 1.633 . . . . 0.0 112.833 176.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.37 -30.26 63.18 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.423 1.489 . . . . 0.0 112.441 173.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.447 ' O ' HG13 ' A' ' 34' ' ' VAL . 1.4 mp -63.44 -47.04 83.52 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.425 167.305 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.51 -45.89 56.81 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.112 1.765 . . . . 0.0 112.469 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.402 ' O ' ' HE1' ' A' ' 43' ' ' HIS . 29.6 t0 -107.29 40.53 1.66 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.103 1.761 . . . . 0.0 111.102 174.616 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -150.56 -78.3 0.02 OUTLIER Glycine 0 C--N 1.339 0.731 0 O-C-N 120.555 -1.34 . . . . 0.0 115.267 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.447 HG13 ' O ' ' A' ' 30' ' ' LEU . 27.6 m 31.37 31.01 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 C-N-CA 128.055 2.542 . . . . 0.0 117.6 -168.075 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 36.1 m -84.65 -67.66 0.78 Allowed 'General case' 0 N--CA 1.469 0.481 0 O-C-N 120.551 -1.343 . . . . 0.0 113.933 -173.125 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -143.64 164.03 32.83 Favored Pre-proline 0 CA--C 1.54 0.565 0 CA-C-O 118.054 -0.974 . . . . 0.0 112.541 -171.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -66.19 -25.49 50.31 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 121.99 1.794 . . . . 0.0 113.061 -169.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.16 11.34 48.14 Favored Glycine 0 CA--C 1.53 0.979 0 CA-C-O 117.913 -1.493 . . . . 0.0 114.439 173.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.23 -34.27 77.72 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.501 2.151 . . . . 0.0 111.126 179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 46.0 mt -56.36 -21.54 25.36 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 124.901 1.28 . . . . 0.0 112.647 175.07 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.43 -28.4 69.78 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.189 -0.944 . . . . 0.0 112.194 -178.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.2 -57.05 3.99 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.769 0.828 . . . . 0.0 111.099 169.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.402 ' HE1' ' O ' ' A' ' 32' ' ' ASP . 28.2 m170 -53.41 -31.48 45.25 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -179.064 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.466 HD11 HG12 ' A' ' 26' ' ' ILE . 70.4 mt -98.09 -22.93 15.97 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.147 0.979 . . . . 0.0 113.44 -175.043 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.56 -0.73 48.07 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 124.787 1.184 . . . . 0.0 113.484 -169.282 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.9 mt -97.32 149.21 22.34 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.276 1.43 . . . . 0.0 110.326 -176.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.7 p -66.2 152.05 45.68 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 121.233 -0.917 . . . . 0.0 110.975 -174.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -56.14 -44.05 78.86 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.495 0.718 . . . . 0.0 111.988 -178.118 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.6 m -64.24 -35.56 81.22 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.588 1.155 . . . . 0.0 112.782 173.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -73.89 -44.54 54.94 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 178.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 67.9 t -60.6 -30.65 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 119.409 1.004 . . . . 0.0 112.447 176.12 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.8 m -53.16 -38.54 62.85 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 119.825 1.193 . . . . 0.0 113.683 174.47 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 64.3 m-80 -58.63 -48.02 82.43 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.236 1.014 . . . . 0.0 111.718 175.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 34.6 m80 -65.79 -31.73 72.86 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.569 1.148 . . . . 0.0 112.343 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 60.1 mt -74.46 -32.48 62.61 Favored 'General case' 0 C--O 1.222 -0.395 0 C-N-CA 124.088 0.955 . . . . 0.0 112.767 169.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.3 m -61.97 -33.97 75.28 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 120.798 1.636 . . . . 0.0 115.375 -170.141 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 38.5 t -77.04 -34.12 57.27 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.717 1.144 . . . . 0.0 111.512 170.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.3 tp -64.14 -38.28 90.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.37 2.268 . . . . 0.0 112.271 -177.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 66.4 mtm-85 -75.23 -13.51 60.45 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.905 1.682 . . . . 0.0 113.059 174.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.89 -34.99 4.71 Favored Glycine 0 N--CA 1.473 1.153 0 C-N-CA 126.317 1.913 . . . . 0.0 113.548 175.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 56.1 m -76.51 7.69 4.24 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.422 1.489 . . . . 0.0 111.425 168.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.48 -20.03 1.78 Allowed Glycine 0 CA--C 1.533 1.171 0 C-N-CA 126.71 2.1 . . . . 0.0 116.095 175.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.3 mt -55.63 -24.99 36.54 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 127.367 2.267 . . . . 0.0 115.675 -170.358 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.44 HG12 ' CD2' ' A' ' 30' ' ' LEU . 2.7 m -121.64 127.53 75.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 C-N-CA 124.27 1.028 . . . . 0.0 112.937 171.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 90.4 t -115.7 132.91 63.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 125.792 1.637 . . . . 0.0 109.513 -176.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -91.13 155.17 18.83 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 122.242 1.02 . . . . 0.0 112.684 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 26.3 m -147.79 152.09 37.11 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.301 1.44 . . . . 0.0 109.001 177.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -98.98 110.48 23.08 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.051 1.34 . . . . 0.0 111.14 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -87.52 68.37 9.6 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.036 2.135 . . . . 0.0 111.177 -179.165 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 63.01 -1.43 1.84 Allowed Glycine 0 CA--C 1.538 1.504 0 N-CA-C 117.72 1.848 . . . . 0.0 117.72 168.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.6 mtm-85 154.7 -25.83 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 131.533 3.933 . . . . 0.0 111.363 -172.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -94.43 179.16 5.38 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 166.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 24.5 m -128.43 168.89 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 O-C-N 121.042 -1.036 . . . . 0.0 108.838 168.238 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -137.63 -176.11 4.3 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.777 1.631 . . . . 0.0 111.14 172.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -135.43 151.33 50.31 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.769 2.027 . . . . 0.0 109.01 169.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.438 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -152.39 151.62 31.05 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.017 1.327 . . . . 0.0 110.58 -173.196 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -57.3 143.77 38.36 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.568 1.147 . . . . 0.0 109.711 173.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.49 -10.75 60.0 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 116.806 2.15 . . . . 0.0 116.806 -169.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -176.17 161.59 2.36 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.235 2.214 . . . . 0.0 109.563 173.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 90.2 p -41.59 -32.76 0.38 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 128.247 2.619 . . . . 0.0 112.711 166.148 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -42.07 -60.71 1.34 Allowed 'General case' 0 C--N 1.343 0.291 0 C-N-CA 126.666 1.986 . . . . 0.0 112.801 168.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.434 ' H ' HD22 ' A' ' 82' ' ' LEU . 0.3 OUTLIER -80.37 -34.96 36.05 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -170.344 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.69 -38.4 69.61 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 118.62 0.645 . . . . 0.0 112.664 169.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -71.78 -63.74 1.07 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.946 0.898 . . . . 0.0 113.245 173.113 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.47 -25.99 67.6 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.88 -1.137 . . . . 0.0 113.548 -171.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.77 -40.47 22.58 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 123.268 0.627 . . . . 0.0 111.779 169.584 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.12 -60.12 5.41 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 127.059 2.266 . . . . 0.0 115.045 -176.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.6 pm0 -66.44 -21.67 66.21 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.676 1.738 . . . . 0.0 111.406 168.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.8 tt 80.38 132.68 0.06 Allowed 'General case' 0 C--N 1.343 0.294 0 C-N-CA 128.565 2.746 . . . . 0.0 112.225 166.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 29.4 m -63.29 16.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 126.797 2.039 . . . . 0.0 114.732 178.241 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 73.22 -11.0 0.94 Allowed 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 126.365 1.866 . . . . 0.0 113.212 169.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 2.9 p -55.73 22.78 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 C-N-CA 129.864 3.266 . . . . 0.0 117.698 175.149 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.9 t 68.7 9.75 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 126.771 2.028 . . . . 0.0 112.779 166.179 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 95.31 110.51 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 131.09 3.756 . . . . 0.0 107.665 -168.185 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.3 74.75 0.05 Allowed 'General case' 0 CA--C 1.553 1.089 0 O-C-N 121.446 -0.783 . . . . 0.0 113.05 169.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.8 t -70.77 146.59 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 126.082 1.753 . . . . 0.0 111.8 174.311 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.69 78.8 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 128.69 2.796 . . . . 0.0 112.401 170.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 19.7 p -141.02 121.67 14.26 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.036 1.335 . . . . 0.0 112.61 -172.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -111.84 134.41 53.42 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.858 1.263 . . . . 0.0 110.041 173.182 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -165.11 158.62 14.23 Favored Pre-proline 0 CA--C 1.548 0.866 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 -170.443 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -83.16 170.32 12.22 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.972 2.448 . . . . 0.0 113.203 -172.514 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.6 t -85.65 -179.87 6.96 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 125.395 1.478 . . . . 0.0 110.205 167.144 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 2.2 t -113.76 4.28 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.956 2.102 . . . . 0.0 111.412 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -128.31 -37.43 1.84 Allowed 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 125.795 1.638 . . . . 0.0 112.508 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -151.19 125.09 9.16 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.128 0.876 . . . . 0.0 112.268 173.157 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 106' ' ' ARG 0.255 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.257 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 166.487 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.59 0 CA-C-O 122.345 1.069 . . . . 0.0 113.548 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.455 HD13 ' H ' ' B' ' 11' ' ' LEU . 0.0 OUTLIER -59.05 -8.99 1.66 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.567 1.947 . . . . 0.0 114.882 172.463 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.81 -21.4 11.07 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 120.671 -1.268 . . . . 0.0 112.691 168.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 38.0 mtm105 -83.6 -46.72 12.05 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.151 1.781 . . . . 0.0 111.798 169.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -51.17 -57.89 7.58 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.913 1.685 . . . . 0.0 110.262 173.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.5 -23.71 75.2 Favored Glycine 0 C--N 1.339 0.725 0 CA-C-O 117.908 -1.495 . . . . 0.0 112.757 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 25.8 ttm105 -63.99 -49.19 73.44 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 119.792 1.796 . . . . 0.0 110.386 169.014 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.19 -33.85 75.33 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 120.065 1.302 . . . . 0.0 114.093 175.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 7.6 mp -84.57 -2.04 56.8 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 178.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -119.87 -12.82 9.13 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 172.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.55 157.32 27.08 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 126.347 1.859 . . . . 0.0 111.384 169.545 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -65.23 -99.49 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 0.992 1 C-N-CA 126.009 4.473 . . . . 0.0 111.725 -176.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 12.1 t -58.48 -25.27 62.13 Favored 'General case' 0 N--CA 1.464 0.262 0 O-C-N 120.637 -1.29 . . . . 0.0 112.469 175.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.54 -39.91 85.0 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 119.707 1.14 . . . . 0.0 112.844 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 44.0 t -66.54 -37.19 84.47 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.72 1.6 . . . . 0.0 111.008 169.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 7.2 mtm180 -61.53 -35.88 78.99 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 172.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 26' ' ' ILE . . . . . 0.452 HG12 HD11 ' B' ' 44' ' ' LEU . 1.8 mt -52.59 -59.9 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 CA-C-N 120.334 1.425 . . . . 0.0 108.851 169.122 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 96.9 mt -57.24 -45.95 83.45 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.75 -171.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 5.7 p -75.06 -31.3 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.58 -30.81 57.17 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.131 0.878 . . . . 0.0 112.387 174.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 12.1 tp -64.42 -37.09 86.3 Favored 'General case' 0 C--N 1.339 0.152 0 O-C-N 120.926 -1.109 . . . . 0.0 112.768 175.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.05 -31.75 8.28 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 128.907 2.883 . . . . 0.0 114.237 175.124 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.84 -33.17 18.67 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.663 1.985 . . . . 0.0 113.152 174.507 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -99.22 -65.02 0.84 Allowed Glycine 0 C--N 1.338 0.687 0 N-CA-C 115.465 0.946 . . . . 0.0 115.465 -165.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 16.1 m 34.5 38.8 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 125.969 1.708 . . . . 0.0 114.075 -167.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 30.0 m -86.47 -86.65 0.14 Allowed 'General case' 0 C--O 1.225 -0.23 0 C-N-CA 124.028 0.931 . . . . 0.0 110.944 -176.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -133.69 162.89 54.92 Favored Pre-proline 0 CA--C 1.544 0.72 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -169.127 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -63.91 -25.53 67.21 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 122.64 2.226 . . . . 0.0 113.843 -167.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.66 7.81 50.42 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-O 117.114 -1.937 . . . . 0.0 114.918 172.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.99 -31.97 71.55 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 121.083 2.442 . . . . 0.0 111.409 -175.084 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 31.4 mt -63.13 -18.75 63.77 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 125.32 1.448 . . . . 0.0 112.215 -179.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.0 -32.18 70.61 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 119.731 1.15 . . . . 0.0 112.245 177.165 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.62 -54.88 6.08 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.491 0.716 . . . . 0.0 111.306 170.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -53.55 -31.37 46.21 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.452 HD11 HG12 ' B' ' 26' ' ' ILE . 70.3 mt -100.55 -27.13 13.58 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.558 1.143 . . . . 0.0 112.984 -174.644 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.56 4.97 88.0 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 124.998 1.285 . . . . 0.0 113.27 -169.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 96.6 mt -105.78 150.3 25.67 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.019 1.328 . . . . 0.0 111.207 -172.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 9.5 p -64.34 149.63 47.82 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.262 -0.899 . . . . 0.0 110.402 -175.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -58.57 -35.56 72.57 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.654 0.612 . . . . 0.0 112.654 -177.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.7 m -66.82 -44.01 82.3 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.356 -0.84 . . . . 0.0 112.018 170.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -65.81 -45.31 82.81 Favored 'General case' 0 CA--C 1.548 0.884 0 O-C-N 121.162 -0.961 . . . . 0.0 112.215 177.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 94.8 t -59.59 -31.72 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 120.335 -1.478 . . . . 0.0 111.692 169.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 69.7 m -65.13 -26.99 68.43 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.02 1.282 . . . . 0.0 113.728 175.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -62.97 -55.58 24.6 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.104 0.866 . . . . 0.0 109.557 169.486 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 33.9 m80 -59.04 -39.86 83.29 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.594 1.158 . . . . 0.0 113.18 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 56.0 mt -66.59 -33.75 76.36 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 124.59 1.156 . . . . 0.0 112.709 172.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 59.9 m -63.7 -35.55 80.94 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 120.484 1.493 . . . . 0.0 114.293 -169.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 34.1 t -72.05 -34.69 68.95 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.597 0.635 . . . . 0.0 112.07 169.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.4 tp -68.41 -32.05 71.83 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.556 2.342 . . . . 0.0 112.581 -175.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 51.3 mtm-85 -82.09 -19.64 39.76 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.39 1.476 . . . . 0.0 112.239 171.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -88.88 -37.85 7.14 Favored Glycine 0 N--CA 1.476 1.325 0 C-N-CA 124.811 1.196 . . . . 0.0 113.398 177.103 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 97.0 m -81.39 15.34 2.05 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 126.332 1.853 . . . . 0.0 111.364 169.185 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.93 -26.3 1.16 Allowed Glycine 0 CA--C 1.534 1.259 0 C-N-CA 126.265 1.888 . . . . 0.0 116.525 172.55 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 21.3 mt -50.86 -29.41 11.78 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 127.664 2.386 . . . . 0.0 116.592 -168.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -118.03 122.44 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 124.915 1.286 . . . . 0.0 111.301 169.265 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 80.4 t -107.45 130.65 59.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 125.507 1.523 . . . . 0.0 108.656 -176.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -96.86 146.46 24.91 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 124.624 1.17 . . . . 0.0 111.395 -177.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 96.4 m -154.09 147.35 24.81 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 124.432 1.093 . . . . 0.0 109.001 -172.556 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -97.62 93.23 6.3 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.36 1.064 . . . . 0.0 111.719 -176.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -69.3 74.88 0.36 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.815 1.646 . . . . 0.0 114.078 173.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 63.15 -5.69 0.56 Allowed Glycine 0 N--CA 1.475 1.257 0 C-N-CA 126.808 2.147 . . . . 0.0 118.313 167.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 4.1 mtm-85 161.04 -24.98 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 130.36 3.464 . . . . 0.0 111.759 -175.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -100.6 170.4 8.39 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 166.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 11.1 m -115.1 163.32 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 119.036 0.834 . . . . 0.0 109.134 168.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 10.3 ptt-85 -129.63 172.93 11.09 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 122.2 1.0 . . . . 0.0 110.784 170.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -127.93 140.34 52.06 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 167.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -146.52 154.75 41.9 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 123.753 0.821 . . . . 0.0 110.675 -178.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 1.2 mp -57.25 142.96 41.24 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.593 0.757 . . . . 0.0 110.614 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.13 0.44 1.97 Allowed 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 118.751 2.871 . . . . 0.0 118.751 -167.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 11.8 t70 169.02 158.33 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 129.835 3.254 . . . . 0.0 109.832 173.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 88.7 p -40.58 -35.39 0.46 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.806 2.442 . . . . 0.0 112.756 167.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -38.66 -63.16 0.53 Allowed 'General case' 0 C--N 1.342 0.278 0 C-N-CA 127.242 2.217 . . . . 0.0 113.013 167.72 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 82' ' ' LEU . . . . . 0.511 ' H ' HD22 ' B' ' 82' ' ' LEU . 0.4 OUTLIER -75.2 -34.16 61.49 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -170.981 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.17 -30.22 71.41 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.857 0.863 . . . . 0.0 112.3 177.316 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.8 mmt85 -71.17 -65.74 0.71 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.645 1.178 . . . . 0.0 110.905 168.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.97 -25.83 63.93 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.599 1.333 . . . . 0.0 114.599 -173.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -87.26 -34.3 18.97 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.374 -0.829 . . . . 0.0 112.647 169.732 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.35 -58.33 5.11 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 127.27 2.367 . . . . 0.0 113.645 -175.332 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 14.0 pm0 -70.21 -17.72 63.15 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 119.22 1.51 . . . . 0.0 111.165 166.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 89' ' ' LEU . . . . . 0.406 ' C ' ' H ' ' B' ' 91' ' ' GLN . 26.5 tp 82.07 146.44 0.08 Allowed 'General case' 0 C--N 1.343 0.321 0 C-N-CA 129.989 3.315 . . . . 0.0 112.904 167.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 90' ' ' VAL . . . . . 0.497 HG23 HG12 ' B' ' 92' ' ' VAL . 5.8 m -57.34 5.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 127.513 2.325 . . . . 0.0 114.122 168.451 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 91' ' ' GLN . . . . . 0.406 ' H ' ' C ' ' B' ' 89' ' ' LEU . 7.3 mm-40 69.0 -9.27 0.6 Allowed 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 127.111 2.164 . . . . 0.0 114.228 176.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.497 HG12 HG23 ' B' ' 90' ' ' VAL . 1.2 p -56.26 26.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 130.174 3.39 . . . . 0.0 117.765 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 73.05 10.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 126.672 1.989 . . . . 0.0 112.496 168.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 78.99 101.27 0.06 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 127.716 2.407 . . . . 0.0 108.986 -171.224 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.12 139.77 22.49 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.14 1.376 . . . . 0.0 114.681 177.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 5.3 t -123.71 156.4 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 126.867 2.067 . . . . 0.0 108.426 175.019 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.68 25.42 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.364 0 C-N-CA 128.118 2.567 . . . . 0.0 115.567 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 18.2 p -96.86 127.05 42.46 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.647 1.579 . . . . 0.0 114.621 -170.054 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -93.5 141.13 28.81 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.13 1.772 . . . . 0.0 108.873 167.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -162.25 144.83 8.65 Favored Pre-proline 0 CA--C 1.544 0.738 0 O-C-N 120.086 -1.634 . . . . 0.0 108.445 -176.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -70.72 165.73 31.08 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 122.559 2.173 . . . . 0.0 112.549 -175.127 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 53.7 t -85.01 177.16 8.03 Favored 'General case' 0 CA--C 1.557 1.231 0 C-N-CA 125.449 1.5 . . . . 0.0 111.311 169.304 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 11.4 t -101.59 -10.29 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 127.129 2.172 . . . . 0.0 111.142 173.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -114.3 -57.16 2.31 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.38 1.872 . . . . 0.0 110.941 -178.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -147.06 124.78 11.83 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 119.374 0.988 . . . . 0.0 113.552 177.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 106' ' ' ARG . . . . . 0.488 ' CZ ' ' HA ' ' B' ' 106' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.397 0 C-N-CA 124.058 0.943 . . . . 0.0 113.15 166.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.821 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 pp -56.88 -40.83 76.95 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.198 0.599 . . . . 0.0 112.483 -173.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.44 1.26 8.29 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.372 1.469 . . . . 0.0 113.878 176.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.436 ' HE ' ' HB2' ' B' ' 102' ' ' CYS . 1.6 mpt_? -112.21 -21.18 11.58 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.967 1.307 . . . . 0.0 112.478 169.042 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.08 -59.71 4.98 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.705 1.138 . . . . 0.0 109.534 168.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.08 -27.56 72.45 Favored Glycine 0 CA--C 1.538 1.473 0 O-C-N 121.292 -0.88 . . . . 0.0 113.234 -178.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -51.93 28.7 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.287 1.035 . . . . 0.0 111.478 172.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.44 -25.11 59.22 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.125 -0.984 . . . . 0.0 112.524 -175.211 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.1 mp -82.83 -6.96 59.67 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 118.138 -0.934 . . . . 0.0 111.362 168.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -92.34 -35.62 13.63 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 119.995 1.271 . . . . 0.0 112.28 166.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -47.56 127.81 10.51 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 125.309 1.443 . . . . 0.0 108.697 173.261 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -50.06 -85.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 1 C-N-CA 127.621 5.547 . . . . 0.0 113.516 -165.254 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.36 -22.24 29.78 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 126.614 1.965 . . . . 0.0 113.747 174.351 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 37.8 mtt180 -74.19 -40.69 62.34 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 120.249 1.386 . . . . 0.0 112.215 178.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 6.9 t -60.18 -48.32 82.21 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.353 0.979 . . . . 0.0 110.09 169.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -62.18 -35.84 80.06 Favored 'General case' 0 CA--C 1.556 1.178 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 176.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -55.27 -53.47 34.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 CA-C-N 120.674 1.579 . . . . 0.0 108.719 167.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.693 HD22 HD21 ' A' ' 77' ' ' LEU . 25.0 mt -63.88 -45.61 88.63 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 117.483 -1.246 . . . . 0.0 112.664 -174.11 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.2 m -58.27 -27.22 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 CA-C-N 120.667 1.576 . . . . 0.0 112.378 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.482 ' HB1' ' CD2' ' A' ' 43' ' ' HIS . . . -95.63 -18.43 20.55 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.972 0.909 . . . . 0.0 113.312 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.503 HD23 ' HA ' ' A' ' 30' ' ' LEU . 8.9 mt -68.72 -41.28 79.25 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 118.247 -0.883 . . . . 0.0 112.482 168.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.8 tt -29.81 -62.32 0.14 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 130.4 3.48 . . . . 0.0 113.251 -178.345 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -98.55 -17.5 18.65 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.746 2.018 . . . . 0.0 112.684 174.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.39 -43.16 25.76 Favored Glycine 0 C--N 1.341 0.853 0 CA-C-O 116.153 -2.471 . . . . 0.0 115.833 -168.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.6 m 4.03 48.65 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 C-N-CA 131.125 3.77 . . . . 0.0 119.798 177.116 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 68.7 m -104.61 -63.17 1.24 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.975 1.71 . . . . 0.0 110.424 176.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -151.26 149.14 23.91 Favored Pre-proline 0 N--CA 1.474 0.762 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -173.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -55.99 -44.44 47.06 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 121.756 1.638 . . . . 0.0 111.082 175.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -69.04 -5.06 45.56 Favored Glycine 0 CA--C 1.535 1.288 0 CA-C-O 118.276 -1.291 . . . . 0.0 114.678 177.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -69.91 -34.97 74.19 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 118.965 1.382 . . . . 0.0 111.383 173.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.8 mt -64.56 -3.2 2.88 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 118.43 0.559 . . . . 0.0 111.9 -177.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.96 -44.3 85.41 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.724 -0.61 . . . . 0.0 110.264 172.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.58 -38.55 70.92 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.821 0.849 . . . . 0.0 111.813 173.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.482 ' CD2' ' HB1' ' A' ' 29' ' ' ALA . 6.5 m-70 -62.9 -20.03 64.77 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.606 HD12 HG22 ' A' ' 51' ' ' VAL . 75.5 mt -121.24 -19.37 7.1 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.996 1.718 . . . . 0.0 114.285 -172.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.49 17.29 78.95 Favored Glycine 0 CA--C 1.535 1.289 0 CA-C-N 118.673 0.669 . . . . 0.0 112.438 -168.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 87.1 mt -111.09 157.3 20.15 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.693 1.246 . . . . 0.0 112.749 -173.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.3 t -62.97 147.47 50.45 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.466 -0.771 . . . . 0.0 109.904 168.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 19.3 ptt-85 -61.58 -13.63 23.38 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 174.089 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.6 m -66.7 -51.18 58.99 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.033 -1.042 . . . . 0.0 111.71 169.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -65.14 -44.92 87.05 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.036 0.935 . . . . 0.0 110.142 177.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.606 HG22 HD12 ' A' ' 44' ' ' LEU . 13.0 t -52.72 -48.38 49.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.266 171.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 66.5 m -60.84 -39.58 89.62 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 118.954 0.797 . . . . 0.0 112.487 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -57.89 -44.54 86.8 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.074 0.949 . . . . 0.0 111.858 173.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 23.0 m170 -61.73 -41.59 97.84 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 120.895 -1.128 . . . . 0.0 112.149 172.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 54.8 mt -75.09 -20.5 59.46 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.2 t -49.81 -51.64 38.23 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.889 1.276 . . . . 0.0 113.508 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 40.0 t -77.87 -39.8 42.13 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.574 0.75 . . . . 0.0 111.904 175.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.7 tp -55.58 -36.61 67.07 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.456 1.503 . . . . 0.0 112.302 -176.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.431 ' HD3' ' CE2' ' A' ' 75' ' ' TYR . 69.0 mtm180 -74.13 -40.23 62.78 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 173.024 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.43 -39.03 31.7 Favored Glycine 0 N--CA 1.467 0.733 0 C-N-CA 123.798 0.713 . . . . 0.0 112.122 -170.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 67.6 m -81.18 12.33 3.55 Favored 'General case' 0 CA--C 1.562 1.417 0 C-N-CA 126.206 1.802 . . . . 0.0 112.315 171.565 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.88 -12.08 54.55 Favored Glycine 0 N--CA 1.473 1.133 0 C-N-CA 128.574 2.988 . . . . 0.0 118.946 167.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.7 mt -58.59 -29.82 66.73 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.45 1.5 . . . . 0.0 114.815 -175.015 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.6 m -132.0 132.33 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.7 t -118.85 135.23 59.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 127.871 2.468 . . . . 0.0 110.883 -168.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.68 126.55 31.42 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.29 0.636 . . . . 0.0 111.845 175.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -141.67 156.45 45.64 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.413 1.085 . . . . 0.0 109.395 174.724 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.35 124.43 28.41 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.55 1.068 . . . . 0.0 110.112 168.16 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.0 -32.57 57.3 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 121.28 -0.888 . . . . 0.0 112.758 173.488 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 166.33 -17.92 0.09 OUTLIER Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.569 1.557 . . . . 0.0 115.246 174.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.96 -16.65 0.26 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.16 2.184 . . . . 0.0 113.584 177.294 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.04 173.98 10.98 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.659 1.984 . . . . 0.0 109.729 175.338 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 8.4 p -81.26 136.95 22.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 C-N-CA 124.315 1.046 . . . . 0.0 111.072 169.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -110.24 160.4 16.55 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 126.553 1.941 . . . . 0.0 109.648 169.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.431 ' CE2' ' HD3' ' A' ' 59' ' ' ARG . 3.4 m-30 -107.99 100.76 10.08 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 107.027 -1.471 . . . . 0.0 107.027 170.268 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -93.61 142.15 27.67 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.32 1.048 . . . . 0.0 110.055 179.08 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.693 HD21 HD22 ' A' ' 27' ' ' LEU . 8.6 mt -55.33 153.19 7.46 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.667 0.787 . . . . 0.0 112.049 171.701 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.85 -32.89 66.25 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 115.054 1.502 . . . . 0.0 115.054 -169.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -167.35 161.69 14.31 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 125.071 1.348 . . . . 0.0 109.718 -175.59 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 68.6 m -48.35 -32.59 7.7 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.363 1.065 . . . . 0.0 112.332 168.1 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -47.84 -52.78 17.79 Favored 'General case' 0 C--N 1.345 0.397 0 C-N-CA 125.614 1.565 . . . . 0.0 112.829 171.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.3 mt -76.03 -46.08 31.13 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 117.926 -1.035 . . . . 0.0 108.808 -173.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.52 -33.69 46.38 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 172.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 -68.01 -67.36 0.47 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.982 1.713 . . . . 0.0 112.327 173.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.94 -30.14 71.25 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.74 1.155 . . . . 0.0 113.276 -174.406 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 47.1 tp -65.56 -38.82 90.65 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.249 1.42 . . . . 0.0 110.905 169.209 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.02 -51.52 6.89 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 128.548 2.975 . . . . 0.0 115.091 -175.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -71.53 -2.49 17.07 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.43 1.615 . . . . 0.0 113.23 172.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 32.9 tp 69.84 110.62 0.05 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 128.605 2.762 . . . . 0.0 113.288 167.123 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.489 HG23 HG12 ' A' ' 92' ' ' VAL . 29.5 m -64.9 17.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 127.097 2.159 . . . . 0.0 116.376 -169.683 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.512 ' C ' ' H ' ' A' ' 93' ' ' VAL . 43.1 mm-40 75.55 -11.01 1.16 Allowed 'General case' 0 C--O 1.216 -0.676 0 O-C-N 120.525 -1.359 . . . . 0.0 113.277 158.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.489 HG12 HG23 ' A' ' 90' ' ' VAL . 4.3 p -70.74 40.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 126.769 2.028 . . . . 0.0 111.271 166.707 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.512 ' H ' ' C ' ' A' ' 91' ' ' GLN . 2.2 t 72.0 -33.49 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 130.82 3.648 . . . . 0.0 114.657 176.203 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 51.4 tp 128.91 94.08 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.66 1 C-N-CA 132.044 4.138 . . . . 0.0 105.792 -166.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.14 138.61 37.65 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -174.092 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 25.5 t -114.0 154.26 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 126.556 1.943 . . . . 0.0 108.917 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.8 -4.76 0.49 Allowed 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 127.205 2.202 . . . . 0.0 114.885 173.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.1 p -84.73 109.85 18.35 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.857 1.663 . . . . 0.0 113.254 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -89.61 157.95 17.82 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.194 0.998 . . . . 0.0 108.89 166.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -160.21 147.34 12.42 Favored Pre-proline 0 CA--C 1.556 1.19 0 CA-C-O 117.365 -1.303 . . . . 0.0 109.362 -169.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -38.77 146.84 0.14 Allowed 'Trans proline' 0 C--N 1.357 1.017 1 C-N-CA 127.111 5.208 . . . . 0.0 121.349 -166.573 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -75.16 72.22 2.24 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-O 123.021 1.391 . . . . 0.0 108.645 168.209 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 1.2 p -54.74 -25.98 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 127.055 2.142 . . . . 0.0 112.875 -170.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.453 ' CB ' ' HA ' ' B' ' 57' ' ' CYS . . . -61.52 97.11 0.07 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.329 0.651 . . . . 0.0 112.202 168.855 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 119.33 -58.35 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 131.509 3.924 . . . . 0.0 112.019 169.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 13.6 ptt-85 . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 115.759 1.763 . . . . 0.0 115.759 -166.977 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.688 0 N-CA-C 105.651 -1.981 . . . . 0.0 105.651 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . 0.272 1.8 pp -42.69 -55.03 3.77 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 117.248 2.314 . . . . 0.0 117.248 -164.625 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.38 -23.63 63.76 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 120.398 1.454 . . . . 0.0 112.731 178.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -20.44 61.4 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 116.626 -1.654 . . . . 0.0 112.055 172.204 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.58 -67.77 0.3 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 120.778 1.626 . . . . 0.0 108.589 170.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -57.63 -38.7 88.96 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-O 119.512 -0.604 . . . . 0.0 112.721 -175.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -62.47 -50.99 69.25 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 118.105 0.952 . . . . 0.0 112.669 173.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.27 -11.71 60.83 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.364 0.983 . . . . 0.0 113.37 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.3 mp -96.42 -14.2 22.61 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.34 1.056 . . . . 0.0 112.145 168.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.95 -13.86 56.9 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.397 1.079 . . . . 0.0 112.282 166.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -79.98 133.05 58.65 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 128.414 2.686 . . . . 0.0 108.927 -177.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -52.88 -84.7 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.614 1 C-N-CA 126.819 5.013 . . . . 0.0 113.297 -167.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.03 -23.29 67.38 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 126.251 1.821 . . . . 0.0 112.508 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 47.0 mtt85 -73.84 -43.44 58.7 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 120.248 1.385 . . . . 0.0 112.663 176.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 4.5 t -58.32 -44.87 88.83 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.918 1.235 . . . . 0.0 110.023 170.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 19.5 tpt180 -61.31 -33.86 74.28 Favored 'General case' 0 CA--C 1.559 1.301 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 172.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -63.83 -52.15 60.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 O-C-N 119.601 -1.937 . . . . 0.0 108.957 168.622 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 88.5 mt -59.47 -44.7 92.96 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 117.674 -1.155 . . . . 0.0 112.437 -177.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 3.8 m -59.32 -23.89 26.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 CA-C-N 120.427 1.467 . . . . 0.0 112.734 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' ALA . . . . . 0.55 ' HB1' ' CD2' ' B' ' 43' ' ' HIS . . . -98.92 -8.18 25.97 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.4 1.08 . . . . 0.0 112.784 -179.682 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.8 mt -87.14 -25.17 24.23 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.005 1.322 . . . . 0.0 112.932 168.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.2 -30.17 10.93 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 127.991 2.516 . . . . 0.0 111.676 166.144 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -131.0 -37.72 1.27 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.436 1.894 . . . . 0.0 115.447 -170.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.26 -63.23 3.01 Favored Glycine 0 C--N 1.343 0.963 0 C-N-CA 125.022 1.296 . . . . 0.0 114.688 -165.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 4.3 m 41.01 36.2 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 173.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 60.0 m -98.76 -76.37 0.54 Allowed 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 125.587 1.555 . . . . 0.0 112.198 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -143.08 153.29 60.02 Favored Pre-proline 0 N--CA 1.478 0.933 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 -169.171 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -54.41 -35.52 84.89 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.253 2.635 . . . . 0.0 112.64 178.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -80.41 -8.84 87.17 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-O 117.849 -1.528 . . . . 0.0 115.102 175.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.17 -32.35 73.74 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 120.627 2.213 . . . . 0.0 112.879 -171.592 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 5.2 mt -67.71 -7.87 30.63 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 118.543 0.611 . . . . 0.0 111.634 -178.092 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.51 -39.15 89.97 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.299 -0.875 . . . . 0.0 111.162 169.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.81 -44.22 33.44 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.295 1.038 . . . . 0.0 112.187 175.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 43' ' ' HIS . . . . . 0.55 ' CD2' ' HB1' ' B' ' 29' ' ' ALA . 25.6 m-70 -57.45 -25.04 59.08 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 178.772 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.655 HD12 HG22 ' B' ' 51' ' ' VAL . 66.5 mt -115.21 -19.71 10.69 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.374 1.87 . . . . 0.0 114.251 -173.278 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.89 17.9 77.22 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-N 119.137 0.881 . . . . 0.0 113.065 -169.058 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 85.9 mt -110.27 162.05 15.0 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.563 1.182 . . . . 0.0 112.889 -174.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.9 t -68.67 148.91 49.74 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.123 -0.986 . . . . 0.0 110.092 168.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 22.8 ptt-85 -60.29 -15.34 24.26 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 174.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 1.8 m -67.35 -50.79 58.44 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.986 -1.071 . . . . 0.0 111.68 169.199 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -65.92 -43.22 88.79 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.68 0.792 . . . . 0.0 110.398 176.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 51' ' ' VAL . . . . . 0.655 HG22 HD12 ' B' ' 44' ' ' LEU . 16.6 t -54.6 -44.39 69.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 O-C-N 121.588 -0.695 . . . . 0.0 112.074 171.354 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.1 m -62.3 -39.91 94.57 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.51 1.05 . . . . 0.0 112.802 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -55.78 -44.8 78.09 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.45 1.1 . . . . 0.0 111.487 172.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 22.2 m80 -63.27 -40.6 97.86 Favored 'General case' 0 CA--C 1.549 0.906 0 O-C-N 121.179 -0.95 . . . . 0.0 112.305 172.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 82.7 mt -73.83 -28.36 61.57 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -176.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 68.1 m -50.68 -53.39 31.54 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 120.798 1.636 . . . . 0.0 113.785 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 57' ' ' CYS . . . . . 0.453 ' HA ' ' CB ' ' A' ' 104' ' ' ALA . 36.2 t -68.87 -42.85 76.47 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 118.551 0.614 . . . . 0.0 112.525 179.363 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 mp -49.0 -41.88 35.96 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.552 1.941 . . . . 0.0 114.287 174.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 85.7 mtm180 -91.4 -20.85 21.36 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -177.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -86.52 -45.72 5.44 Favored Glycine 0 N--CA 1.472 1.054 0 CA-C-N 119.921 1.237 . . . . 0.0 112.122 176.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 84.8 m -74.29 9.08 1.81 Allowed 'General case' 0 CA--C 1.561 1.399 0 C-N-CA 126.083 1.753 . . . . 0.0 113.612 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 84.81 -5.67 81.3 Favored Glycine 0 C--N 1.341 0.853 0 C-N-CA 128.797 3.094 . . . . 0.0 116.713 168.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 12.0 mt -64.26 -22.56 66.99 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 119.007 1.404 . . . . 0.0 114.6 -173.248 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 31.9 t -137.91 134.8 45.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 125.533 1.533 . . . . 0.0 112.284 -171.065 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 15.7 t -118.6 132.62 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 126.843 2.057 . . . . 0.0 111.281 -169.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -82.36 129.93 34.99 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.878 0.871 . . . . 0.0 110.8 169.59 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.01 159.76 42.03 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.111 0.964 . . . . 0.0 110.42 174.556 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.38 128.74 34.17 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.457 0.571 . . . . 0.0 109.912 166.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.65 -28.65 30.54 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.443 -0.786 . . . . 0.0 112.731 170.005 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 159.77 -39.79 0.47 Allowed Glycine 0 CA--C 1.531 1.038 0 C-N-CA 124.556 1.074 . . . . 0.0 115.005 172.219 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.31 -19.23 11.34 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.689 1.596 . . . . 0.0 113.103 172.534 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.85 171.74 13.8 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.485 1.914 . . . . 0.0 110.588 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 7.1 p -80.68 152.4 4.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 C-N-CA 124.328 1.051 . . . . 0.0 109.682 168.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 22.0 ptt180 -132.04 173.96 10.68 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.52 2.328 . . . . 0.0 110.749 177.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -120.09 120.93 37.67 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.643 166.422 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -109.87 164.04 12.96 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.159 1.384 . . . . 0.0 109.165 172.109 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 64.8 mt -70.02 166.35 19.91 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.725 -0.609 . . . . 0.0 111.018 172.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.8 -48.88 66.59 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 -177.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -161.99 164.66 28.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.988 2.115 . . . . 0.0 109.377 -171.177 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 73.2 m -51.53 -26.83 9.21 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.918 0.887 . . . . 0.0 112.58 168.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -52.26 -58.38 6.82 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 125.024 1.329 . . . . 0.0 112.292 170.582 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 8.9 mt -70.22 -42.62 72.03 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.563 1.074 . . . . 0.0 109.774 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.25 -35.77 50.69 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.242 1.017 . . . . 0.0 113.237 173.223 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 -67.01 -64.66 0.81 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.704 1.201 . . . . 0.0 112.337 175.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.63 -17.97 64.98 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 -176.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 43.0 tp -82.58 -30.94 29.26 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 127.104 2.162 . . . . 0.0 112.352 169.264 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -87.23 -59.71 1.73 Allowed Glycine 0 N--CA 1.473 1.102 0 C-N-CA 128.776 3.084 . . . . 0.0 114.252 -172.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -71.81 -16.57 62.18 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 119.045 1.422 . . . . 0.0 110.708 167.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 23.5 tp 78.24 147.79 0.09 Allowed 'General case' 0 C--N 1.343 0.312 0 C-N-CA 129.16 2.984 . . . . 0.0 114.488 165.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 90' ' ' VAL . . . . . 0.545 HG23 HG12 ' B' ' 92' ' ' VAL . 15.6 m -59.05 10.39 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 127.366 2.266 . . . . 0.0 114.46 168.024 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 70.57 -17.2 0.29 Allowed 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 127.083 2.153 . . . . 0.0 115.571 172.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.545 HG12 HG23 ' B' ' 90' ' ' VAL . 2.5 p -59.06 31.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 C-N-CA 130.622 3.569 . . . . 0.0 116.803 -178.033 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.4 t 69.77 12.96 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 127.702 2.401 . . . . 0.0 113.086 168.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 46.6 tp 84.06 104.41 0.05 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 129.285 3.034 . . . . 0.0 108.743 -169.523 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.07 119.42 5.44 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.165 168.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 2.9 t -95.05 165.2 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 126.207 1.803 . . . . 0.0 109.798 171.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -62.02 18.39 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 128.576 2.75 . . . . 0.0 115.935 175.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 44.2 p -102.06 117.96 35.89 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.399 1.48 . . . . 0.0 113.392 -173.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -80.28 152.97 28.76 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 165.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -159.97 139.23 8.09 Favored Pre-proline 0 CA--C 1.545 0.757 0 CA-C-O 116.977 -1.487 . . . . 0.0 107.007 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -47.78 146.98 7.66 Favored 'Trans proline' 0 C--N 1.353 0.795 1 C-N-CA 125.753 4.302 . . . . 0.0 118.212 -167.031 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 102' ' ' CYS . . . . . 0.436 ' HB2' ' HE ' ' A' ' 13' ' ' ARG . 7.5 t -77.9 57.05 1.65 Allowed 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 125.316 1.446 . . . . 0.0 110.669 169.861 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 1.5 p -28.13 -42.32 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.575 1 C-N-CA 132.278 4.231 . . . . 0.0 116.628 -168.733 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -50.88 154.93 1.3 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 122.25 1.024 . . . . 0.0 112.926 177.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 72.83 -40.09 0.47 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.263 1.825 . . . . 0.0 113.742 -177.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 6.8 ptt-85 . . . . . 0 N--CA 1.486 1.349 0 C-N-CA 128.782 2.833 . . . . 0.0 113.606 171.689 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.606 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 pp -60.56 -43.11 97.63 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.747 1.018 . . . . 0.0 113.747 -174.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.34 -20.76 66.54 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.973 0.909 . . . . 0.0 113.111 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.8 mmt180 -87.77 -43.03 12.18 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.141 0.977 . . . . 0.0 110.564 173.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -59.17 -43.34 92.11 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.55 1.14 . . . . 0.0 112.095 -178.175 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -56.13 -30.98 58.6 Favored Glycine 0 CA--C 1.533 1.205 0 CA-C-N 118.963 0.801 . . . . 0.0 112.586 176.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.6 ttp85 -90.69 -13.77 33.53 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 174.134 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.1 -30.05 62.15 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 121.033 1.742 . . . . 0.0 111.108 169.203 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.8 mp -81.96 -45.89 14.76 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.137 0.975 . . . . 0.0 110.298 169.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.19 64.98 5.19 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-O 122.459 1.123 . . . . 0.0 112.874 170.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -136.55 138.52 26.84 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 128.876 2.87 . . . . 0.0 109.523 -177.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -52.18 -89.26 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.807 1 C-N-CA 126.22 4.614 . . . . 0.0 114.159 -168.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 m -67.72 -24.22 65.35 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.833 0.853 . . . . 0.0 110.734 -177.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.502 ' HG2' HD13 ' A' ' 58' ' ' LEU . 16.9 ttm105 -74.74 -37.82 62.42 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.849 1.204 . . . . 0.0 112.601 -177.46 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 14.0 t -55.75 -46.48 77.82 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 120.126 1.33 . . . . 0.0 109.982 166.325 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 58.0 mmt-85 -58.95 -44.7 91.51 Favored 'General case' 0 C--O 1.217 -0.652 0 CA-C-O 117.801 -1.095 . . . . 0.0 112.809 174.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mm -53.26 -48.93 54.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 CA-C-N 120.867 1.667 . . . . 0.0 110.763 173.098 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 89.3 mt -61.88 -42.39 99.01 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 118.538 -0.744 . . . . 0.0 111.44 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -77.19 -26.26 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -179.2 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.82 -31.67 59.49 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.289 1.436 . . . . 0.0 111.056 173.376 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 tp -65.1 -45.11 86.54 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 116.567 -1.682 . . . . 0.0 111.882 169.269 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 mt -47.59 -45.3 27.2 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.58 1.952 . . . . 0.0 113.677 -178.007 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -98.3 -1.81 40.95 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 125.97 1.708 . . . . 0.0 113.193 177.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -107.7 -76.52 0.98 Allowed Glycine 0 C--N 1.341 0.85 0 C-N-CA 126.561 2.029 . . . . 0.0 113.636 -174.438 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.2 m 36.45 34.7 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 C-N-CA 127.576 2.351 . . . . 0.0 115.362 -169.165 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.56 -62.33 1.61 Allowed 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.247 -0.908 . . . . 0.0 112.814 -172.095 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -164.63 155.89 13.34 Favored Pre-proline 0 N--CA 1.476 0.835 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -169.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -57.79 129.88 35.72 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.075 1.85 . . . . 0.0 108.682 169.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.17 -2.67 83.77 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 117.486 -1.73 . . . . 0.0 114.312 -173.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.86 -36.08 78.26 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 120.828 2.314 . . . . 0.0 110.323 169.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.96 -19.67 63.02 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.601 1.161 . . . . 0.0 112.221 179.231 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.59 -25.58 68.3 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 118.393 0.542 . . . . 0.0 111.839 178.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.08 -54.76 5.48 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.98 0.912 . . . . 0.0 111.377 169.583 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -55.01 -26.38 36.65 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.436 HD12 HG22 ' A' ' 51' ' ' VAL . 57.0 mt -108.39 -12.79 14.98 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.26 1.424 . . . . 0.0 113.432 -176.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.45 6.11 32.82 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 124.202 0.906 . . . . 0.0 113.935 -171.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 57.5 mt -108.1 138.8 43.75 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.399 1.08 . . . . 0.0 111.39 -169.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.7 t -60.37 151.63 27.4 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.654 0.74 . . . . 0.0 112.324 -173.28 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -50.53 -35.91 31.76 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.374 1.469 . . . . 0.0 113.484 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.03 -45.74 80.37 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.373 1.069 . . . . 0.0 111.944 175.077 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -66.55 -45.5 79.19 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.36 -0.837 . . . . 0.0 111.569 175.497 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.436 HG22 HD12 ' A' ' 44' ' ' LEU . 2.6 t -63.39 -28.6 45.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 O-C-N 120.748 -1.22 . . . . 0.0 112.153 175.661 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.8 m -63.51 -41.53 98.51 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.007 0.821 . . . . 0.0 112.726 171.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -59.48 -34.03 72.06 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.912 0.885 . . . . 0.0 112.463 172.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -70.69 -45.75 64.42 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 121.105 -0.997 . . . . 0.0 112.849 172.009 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 83.2 mt -69.76 -18.58 63.51 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.312 1.445 . . . . 0.0 113.81 176.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 t -57.2 -55.56 33.13 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.97 1.259 . . . . 0.0 111.303 -178.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 16.0 t -69.6 -34.63 74.37 Favored 'General case' 0 C--O 1.219 -0.537 0 O-C-N 121.749 -0.594 . . . . 0.0 111.858 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.502 HD13 ' HG2' ' A' ' 23' ' ' ARG . 4.3 tp -64.76 -37.36 87.35 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.994 0.918 . . . . 0.0 112.514 -176.237 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.42 ' HG2' HG23 ' A' ' 64' ' ' VAL . 88.5 mtm180 -85.16 -30.4 23.97 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.884 1.273 . . . . 0.0 110.979 175.091 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.61 -44.55 81.78 Favored Glycine 0 N--CA 1.474 1.195 0 C-N-CA 123.915 0.769 . . . . 0.0 112.532 176.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 20.6 m -72.95 -10.2 59.55 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.376 1.47 . . . . 0.0 112.816 169.112 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.71 2.59 61.12 Favored Glycine 0 CA--C 1.533 1.187 0 O-C-N 120.531 -1.356 . . . . 0.0 115.127 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.5 mt -53.94 -25.94 23.0 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 120.092 1.946 . . . . 0.0 113.391 173.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.42 HG23 ' HG2' ' A' ' 59' ' ' ARG . 2.9 m -124.47 141.92 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.833 1.653 . . . . 0.0 113.881 169.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 65.6 t -133.92 137.8 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 126.186 1.795 . . . . 0.0 110.508 -175.059 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.468 ' HB2' ' CE1' ' A' ' 75' ' ' TYR . . . -91.28 154.43 19.26 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 174.77 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.8 m -143.06 135.34 27.26 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.332 1.853 . . . . 0.0 110.065 -173.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -79.63 105.36 10.87 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.827 0.851 . . . . 0.0 112.333 169.343 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.402 ' CG ' ' HD3' ' A' ' 74' ' ' ARG . 76.2 mm-40 -83.59 174.34 10.64 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.555 1.142 . . . . 0.0 110.76 167.169 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -69.57 24.16 0.38 Allowed Glycine 0 N--CA 1.481 1.649 0 N-CA-C 117.891 1.916 . . . . 0.0 117.891 -168.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.82 -14.04 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 128.174 2.59 . . . . 0.0 113.913 179.024 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -140.77 171.37 14.19 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 126.777 2.031 . . . . 0.0 108.191 -175.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 34.2 m -118.06 148.14 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 123.581 0.752 . . . . 0.0 109.004 170.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.402 ' HD3' ' CG ' ' A' ' 69' ' ' GLU . 9.2 ptt85 -117.21 -178.73 3.52 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.319 0.648 . . . . 0.0 112.499 174.728 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.468 ' CE1' ' HB2' ' A' ' 66' ' ' ALA . 12.0 m-85 -131.34 131.23 43.59 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.068 1.747 . . . . 0.0 106.886 166.004 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.88 163.73 25.7 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.673 1.589 . . . . 0.0 110.284 176.227 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.8 mp -59.3 146.25 40.23 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.763 0.825 . . . . 0.0 109.564 169.211 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -47.64 -40.86 20.76 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.808 1.243 . . . . 0.0 114.048 -178.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -167.92 167.24 12.97 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.737 1.615 . . . . 0.0 111.401 176.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -35.61 -35.79 0.06 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 130.399 3.479 . . . . 0.0 112.228 165.334 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -44.05 -61.23 1.54 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 126.587 1.955 . . . . 0.0 113.059 169.233 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.6 mt -74.75 -29.85 61.28 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.345 0.975 . . . . 0.0 110.24 -176.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.54 -26.83 68.88 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.633 -1.175 . . . . 0.0 111.69 178.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -67.67 -71.78 0.19 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 120.117 1.326 . . . . 0.0 111.688 172.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.48 -41.79 90.58 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.451 1.023 . . . . 0.0 112.262 -169.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.94 -35.42 74.52 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.846 1.259 . . . . 0.0 111.745 175.03 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.42 -45.6 94.57 Favored Glycine 0 CA--C 1.527 0.837 0 C-N-CA 126.064 1.792 . . . . 0.0 113.571 173.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . 0.328 16.4 pt-20 -85.25 21.12 1.78 Allowed 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.629 1.172 . . . . 0.0 112.953 169.655 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 33.9 tp 77.75 -43.71 0.4 Allowed 'General case' 0 N--CA 1.474 0.769 1 C-N-CA 131.856 4.062 . . . . 0.0 113.986 166.512 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.365 5.2 t 145.3 5.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.286 1 C-N-CA 134.787 5.235 . . . . 0.0 110.412 168.966 . . . . . . . . 3 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 87.47 -25.34 0.09 Allowed 'General case' 0 C--O 1.217 -0.658 0 O-C-N 120.119 -1.613 . . . . 0.0 111.115 137.478 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.32 48.1 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 130.391 3.476 . . . . 0.0 111.217 166.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER 68.54 -32.68 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 131.635 3.974 . . . . 0.0 115.145 175.668 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 50.1 tp 132.86 86.36 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.108 1 C-N-CA 132.417 4.287 . . . . 0.0 106.851 -167.57 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.22 16.22 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 118.708 2.855 . . . . 0.0 118.708 -168.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER 68.7 128.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 129.785 3.234 . . . . 0.0 114.508 176.2 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -72.8 2.52 6.54 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 127.333 2.253 . . . . 0.0 114.09 173.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 34.6 p -80.67 170.89 15.72 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.856 1.662 . . . . 0.0 111.446 172.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -134.61 126.69 29.7 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 165.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 48.1 mm-40 -151.05 170.06 8.35 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 126.968 2.107 . . . . 0.0 108.696 -167.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -73.6 -171.77 0.92 Allowed 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.657 2.238 . . . . 0.0 109.534 166.237 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 51.7 t -59.29 155.61 14.16 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 123.352 1.548 . . . . 0.0 113.028 -177.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -75.44 -3.52 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-N 113.754 -1.566 . . . . 0.0 111.947 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -75.38 -25.79 57.95 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.138 0.975 . . . . 0.0 111.735 166.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -96.04 -153.95 0.42 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.699 1.6 . . . . 0.0 111.588 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 31.2 ttm180 . . . . . 0 N--CA 1.469 0.518 0 C-N-CA 124.692 1.197 . . . . 0.0 112.239 -172.846 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.597 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 pp -55.76 -45.21 78.12 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -175.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.62 -25.55 68.01 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.398 1.079 . . . . 0.0 113.082 -178.207 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 15.9 mmt180 -84.0 -41.75 16.93 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.736 0.814 . . . . 0.0 110.498 176.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -57.95 -48.53 79.68 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.326 0.65 . . . . 0.0 111.523 177.009 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.75 -28.2 62.68 Favored Glycine 0 CA--C 1.533 1.165 0 CA-C-N 119.005 0.821 . . . . 0.0 113.046 -178.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -87.22 -21.53 25.79 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-O 118.028 -0.987 . . . . 0.0 113.651 171.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.45 -29.28 64.68 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 121.584 1.993 . . . . 0.0 112.205 172.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.2 mp -84.11 -44.74 13.73 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 118.089 -0.958 . . . . 0.0 110.489 169.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.68 66.68 5.23 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-O 122.804 1.288 . . . . 0.0 111.467 169.209 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -136.15 139.74 30.95 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 128.318 2.647 . . . . 0.0 109.242 -175.009 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -55.23 -79.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 125.179 3.92 . . . . 0.0 111.811 -171.012 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.88 -30.84 69.43 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 117.355 -1.307 . . . . 0.0 111.486 -178.046 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 64.5 mtt85 -72.95 -37.35 67.15 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 121.299 1.863 . . . . 0.0 112.715 -177.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 36.5 t -54.3 -48.69 71.0 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 121.438 1.926 . . . . 0.0 110.301 168.336 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 73.8 mmt-85 -58.59 -54.12 50.68 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.022 0.929 . . . . 0.0 112.949 175.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mm -49.78 -50.21 18.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 C-N-CA 125.939 1.696 . . . . 0.0 111.67 172.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 96.3 mt -65.56 -41.61 92.78 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.597 -175.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 p -78.08 -28.4 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 CA-C-N 119.102 0.865 . . . . 0.0 112.562 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.72 -31.73 69.9 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.494 1.118 . . . . 0.0 111.627 170.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.412 ' O ' HG13 ' B' ' 34' ' ' VAL . 3.6 tp -63.58 -45.51 90.12 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 117.087 -1.435 . . . . 0.0 112.466 169.434 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.1 mt -47.63 -45.62 27.93 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 127.311 2.244 . . . . 0.0 113.856 -176.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -106.9 18.1 22.26 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 126.171 1.789 . . . . 0.0 112.317 179.294 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.67 -75.07 0.23 Allowed Glycine 0 N--CA 1.47 0.937 0 C-N-CA 125.94 1.734 . . . . 0.0 113.554 -175.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 34' ' ' VAL . . . . . 0.588 ' HB ' ' HE ' ' B' ' 74' ' ' ARG . 26.7 m 36.71 34.61 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 127.047 2.139 . . . . 0.0 116.477 -171.343 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.6 -59.58 2.39 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 -171.335 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 36' ' ' TYR . . . . . 0.417 ' HA ' ' HA ' ' B' ' 74' ' ' ARG . 7.7 p90 -165.89 156.59 11.68 Favored Pre-proline 0 N--CA 1.473 0.684 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -170.17 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -57.51 129.97 36.57 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.209 1.939 . . . . 0.0 108.684 169.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.98 -0.83 81.94 Favored Glycine 0 CA--C 1.532 1.103 0 CA-C-O 117.252 -1.86 . . . . 0.0 114.559 -173.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.1 -37.56 83.17 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 121.045 2.422 . . . . 0.0 109.818 169.546 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mt -60.59 -21.07 62.22 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 124.673 1.189 . . . . 0.0 111.948 179.156 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.75 -27.59 69.3 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.787 -0.57 . . . . 0.0 112.149 178.118 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.23 -52.53 7.62 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.177 0.991 . . . . 0.0 111.474 170.159 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 9.4 m170 -54.88 -27.55 43.64 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 53.1 mt -108.29 -14.92 14.59 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.967 1.307 . . . . 0.0 113.961 -174.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.57 5.26 49.67 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.309 0.957 . . . . 0.0 114.107 -170.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 75.7 mt -105.03 137.51 42.67 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.653 1.181 . . . . 0.0 111.309 -171.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 12.6 t -60.84 152.03 28.3 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.513 -0.742 . . . . 0.0 112.16 -173.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -50.45 -42.68 54.5 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.983 1.313 . . . . 0.0 112.81 -178.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 1.5 m -64.3 -38.95 92.85 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.138 -0.977 . . . . 0.0 112.547 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -70.48 -45.83 64.92 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.256 0.623 . . . . 0.0 111.308 174.274 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.2 t -63.13 -31.23 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 O-C-N 120.981 -1.075 . . . . 0.0 111.694 176.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 39.2 m -56.67 -44.39 81.36 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.956 1.253 . . . . 0.0 113.056 169.765 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -60.74 -28.13 68.46 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.228 0.922 . . . . 0.0 112.869 176.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -78.52 -41.76 31.38 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.878 -1.139 . . . . 0.0 112.616 173.056 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 89.5 mt -72.28 -17.64 61.86 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.747 1.219 . . . . 0.0 114.064 174.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.3 t -58.97 -58.54 8.18 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.449 1.022 . . . . 0.0 111.601 -177.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 9.1 t -64.59 -39.27 93.43 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.714 -0.616 . . . . 0.0 111.415 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 tp -55.8 -48.43 75.4 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.917 2.487 . . . . 0.0 113.1 -177.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -80.5 -12.53 59.53 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.118 0.967 . . . . 0.0 111.859 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -82.36 -47.05 6.23 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.205 0.907 . . . . 0.0 111.307 169.478 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 59.8 m -67.95 -3.26 9.37 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 127.358 2.263 . . . . 0.0 114.414 174.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 62.47 22.82 64.04 Favored Glycine 0 N--CA 1.471 0.999 0 CA-C-N 119.852 1.205 . . . . 0.0 114.006 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 85.1 mt -69.5 -24.32 63.74 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.188 1.494 . . . . 0.0 112.761 171.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 1.5 m -146.82 140.57 20.12 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 C-N-CA 126.223 1.809 . . . . 0.0 111.328 -169.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 9.3 t -138.25 140.64 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 O-C-N 124.115 0.884 . . . . 0.0 110.22 -169.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.94 147.74 26.1 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.852 1.261 . . . . 0.0 113.261 174.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 45.4 m -138.15 135.55 35.81 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.892 1.677 . . . . 0.0 109.544 -177.227 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -79.26 120.83 24.29 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 123.977 0.798 . . . . 0.0 110.525 168.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -106.05 173.73 6.19 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.003 1.721 . . . . 0.0 109.5 175.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -68.36 23.79 0.27 Allowed Glycine 0 N--CA 1.481 1.649 0 N-CA-C 118.366 2.107 . . . . 0.0 118.366 -168.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 170.15 -9.61 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 128.929 2.891 . . . . 0.0 114.076 177.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -142.77 172.89 12.08 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.169 1.788 . . . . 0.0 108.524 -177.362 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 35.6 m -116.39 148.02 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 169.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 74' ' ' ARG . . . . . 0.588 ' HE ' ' HB ' ' B' ' 34' ' ' VAL . 0.0 OUTLIER -122.38 -179.32 4.15 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.541 0.686 . . . . 0.0 111.871 178.558 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -128.88 136.27 50.2 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 166.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.437 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -134.6 161.59 34.67 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 124.6 1.16 . . . . 0.0 109.445 177.299 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.27 148.89 49.19 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 167.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.96 -27.97 69.2 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 115.873 1.805 . . . . 0.0 115.873 -169.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -172.94 162.42 4.69 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.234 1.813 . . . . 0.0 112.286 177.114 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.3 m -33.84 -38.57 0.06 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 129.524 3.13 . . . . 0.0 112.885 164.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -50.06 -58.15 6.12 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.588 1.955 . . . . 0.0 113.161 173.176 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 14.3 mt -72.66 -38.15 67.72 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.878 -1.139 . . . . 0.0 110.668 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -56.18 -31.37 63.35 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.975 1.31 . . . . 0.0 112.999 176.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -66.89 -66.24 0.58 Allowed 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 120.25 1.386 . . . . 0.0 111.5 171.103 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.48 -41.33 76.41 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.146 0.979 . . . . 0.0 112.527 -173.066 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -78.12 -32.47 50.46 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.27 1.828 . . . . 0.0 111.717 176.726 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.91 -45.59 91.99 Favored Glycine 0 N--CA 1.469 0.849 0 C-N-CA 125.637 1.589 . . . . 0.0 112.205 177.092 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . 0.313 19.6 pt-20 -92.05 20.0 6.26 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 167.748 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 89' ' ' LEU . . . . . 0.551 ' O ' HG13 ' B' ' 90' ' ' VAL . 24.8 tp 70.79 -42.87 0.54 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 131.057 3.743 . . . . 0.0 115.692 167.522 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 90' ' ' VAL . . . . . 0.551 HG13 ' O ' ' B' ' 89' ' ' LEU . 2.6 m 168.38 -21.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.956 1 C-N-CA 131.928 4.091 . . . . 0.0 110.581 -171.372 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 71.04 -15.73 0.39 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.454 2.302 . . . . 0.0 114.276 174.442 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.505 HG13 ' O ' ' B' ' 92' ' ' VAL . 3.6 p -59.21 37.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 129.408 3.083 . . . . 0.0 115.51 170.589 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 80.38 -24.6 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 C-N-CA 127.909 2.484 . . . . 0.0 112.682 175.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 56.0 tp 117.05 95.04 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 131.347 3.859 . . . . 0.0 105.919 -167.263 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.8 122.57 18.87 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.422 -0.799 . . . . 0.0 108.891 171.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 96' ' ' VAL . . . . . 0.413 HG23 ' H ' ' B' ' 96' ' ' VAL . 2.7 t -51.9 139.08 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 124.736 1.215 . . . . 0.0 113.95 -178.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -67.04 12.7 0.07 Allowed 'General case' 0 CA--C 1.561 1.366 0 C-N-CA 127.72 2.408 . . . . 0.0 115.037 171.364 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 6.8 p -89.35 171.16 9.96 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.574 1.549 . . . . 0.0 110.801 173.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -126.56 122.5 35.27 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 168.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 50.7 mm-40 -147.96 165.24 19.01 Favored Pre-proline 0 CA--C 1.544 0.717 0 C-N-CA 127.014 2.126 . . . . 0.0 108.59 -168.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.34 -173.95 1.64 Allowed 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.466 2.777 . . . . 0.0 110.025 167.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 36.4 t -58.85 149.33 27.06 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-O 122.527 1.156 . . . . 0.0 112.975 179.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -74.77 1.52 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 CA-C-N 114.869 -1.06 . . . . 0.0 112.378 -177.049 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.15 -27.36 42.73 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.392 1.077 . . . . 0.0 111.938 166.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -89.72 -153.41 0.28 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 126.168 1.787 . . . . 0.0 111.864 175.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 . . . . . 0 N--CA 1.469 0.517 0 C-N-CA 124.94 1.296 . . . . 0.0 111.786 -174.428 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.069 0 CA-C-O 117.97 -1.014 . . . . 0.0 108.478 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 25.9 tp -52.36 -44.13 65.05 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.714 1.143 . . . . 0.0 110.964 173.261 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.81 -3.51 12.68 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.458 ' HD2' ' HB2' ' B' ' 102' ' ' CYS . 66.5 mtt-85 -124.46 -38.44 2.41 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.06 1.344 . . . . 0.0 111.265 178.761 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.431 ' C ' HD13 ' A' ' 14' ' ' LEU . 1.8 tm? -50.9 -58.2 6.59 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.784 1.633 . . . . 0.0 107.941 166.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.12 -22.7 77.39 Favored Glycine 0 C--O 1.218 -0.856 0 CA-C-O 118.392 -1.227 . . . . 0.0 111.627 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.438 HH11 ' HG3' ' A' ' 16' ' ' ARG . 2.6 ttm-85 -68.75 -39.31 80.38 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 119.514 1.657 . . . . 0.0 111.688 171.57 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.88 -35.3 79.71 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.072 -1.018 . . . . 0.0 111.658 175.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.27 6.9 mp -87.53 10.42 17.85 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 123.536 0.734 . . . . 0.0 111.639 171.533 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -111.55 2.23 17.27 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 126.105 1.762 . . . . 0.0 113.52 166.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.418 ' CG ' ' HE ' ' A' ' 23' ' ' ARG . 7.4 t70 -105.07 136.3 19.19 Favored Pre-proline 0 CA--C 1.538 0.511 0 C-N-CA 126.08 1.752 . . . . 0.0 109.904 -172.012 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.433 ' HG2' ' H ' ' A' ' 22' ' ' THR . 55.2 Cg_endo -55.86 -62.94 0.21 Allowed 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 125.226 3.951 . . . . 0.0 111.201 -172.367 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.433 ' H ' ' HG2' ' A' ' 21' ' ' PRO . 85.3 m -62.6 -44.12 97.11 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 117.558 -1.211 . . . . 0.0 109.832 -174.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.418 ' HE ' ' CG ' ' A' ' 20' ' ' ASP . 30.1 mtm180 -68.51 -38.39 80.9 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 117.128 -1.415 . . . . 0.0 112.491 -175.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 88.1 m -57.97 -50.0 74.88 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 120.244 1.384 . . . . 0.0 111.02 170.255 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.3 ttm180 -62.54 -37.45 86.14 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 118.758 -0.639 . . . . 0.0 112.266 177.049 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.4 mt -54.04 -61.63 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 C-N-CA 125.059 1.344 . . . . 0.0 110.055 169.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 92.3 mt -56.15 -41.15 74.94 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.811 0.844 . . . . 0.0 111.501 -169.224 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.2 p -77.52 -32.43 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 175.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.79 -30.27 68.82 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 119.29 0.95 . . . . 0.0 112.507 174.3 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.512 ' O ' HG13 ' A' ' 34' ' ' VAL . 7.0 tp -64.47 -43.46 94.16 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 121.094 -1.004 . . . . 0.0 112.244 177.628 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -44.28 -36.11 2.61 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.958 2.903 . . . . 0.0 113.916 174.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -90.9 -41.08 11.36 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.3 1.84 . . . . 0.0 112.723 176.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.38 -69.93 1.3 Allowed Glycine 0 C--N 1.337 0.587 0 C-N-CA 124.026 0.822 . . . . 0.0 112.449 -168.181 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.577 HG12 ' HA ' ' A' ' 76' ' ' ALA . 16.3 m 37.88 33.23 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 125.371 1.469 . . . . 0.0 114.692 -167.425 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -83.91 -64.46 1.16 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.016 -1.053 . . . . 0.0 112.177 -171.375 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -156.97 157.11 30.53 Favored Pre-proline 0 N--CA 1.473 0.688 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -169.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -58.98 118.97 5.95 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.24 1.96 . . . . 0.0 108.52 171.477 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 90.68 1.46 73.97 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 117.335 -1.814 . . . . 0.0 114.936 -175.263 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.47 -35.83 78.74 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 121.184 2.492 . . . . 0.0 110.468 169.429 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 33.7 mt -54.45 -22.53 12.95 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 126.135 1.774 . . . . 0.0 112.077 174.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.86 -27.26 69.05 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.348 -1.47 . . . . 0.0 112.2 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.54 -57.09 4.01 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 118.203 0.456 . . . . 0.0 110.267 169.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 29.7 m170 -54.57 -31.0 55.9 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 -177.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 37.5 mt -103.05 -2.67 27.12 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.968 1.307 . . . . 0.0 113.417 -175.691 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.24 7.83 20.76 Favored Glycine 0 CA--C 1.535 1.324 0 CA-C-N 118.968 0.804 . . . . 0.0 114.441 -175.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 36.2 mt -107.25 160.19 15.78 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.61 1.164 . . . . 0.0 112.91 -171.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.564 HG23 ' H ' ' A' ' 50' ' ' ASN . 1.2 t -62.49 144.54 55.88 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.124 -0.985 . . . . 0.0 111.768 170.686 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -55.46 -29.21 58.28 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 127.007 2.123 . . . . 0.0 111.602 175.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 29.8 p -72.03 -57.33 4.37 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.431 -0.793 . . . . 0.0 111.739 169.104 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.564 ' H ' HG23 ' A' ' 47' ' ' THR . 14.8 t30 -66.09 -26.43 67.47 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 120.075 -1.641 . . . . 0.0 113.94 -175.341 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 75.9 t -66.54 -35.47 74.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 CA-C-N 120.402 1.456 . . . . 0.0 111.439 167.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.9 p -77.11 -22.29 52.94 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.697 -1.252 . . . . 0.0 114.137 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 -39.64 -44.94 1.58 Allowed 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 126.239 1.815 . . . . 0.0 111.198 167.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . 0.264 11.6 m-70 -104.33 -11.02 17.39 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -173.641 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 80.7 mt -71.64 -21.63 61.8 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.735 -1.228 . . . . 0.0 112.695 168.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.6 t -50.96 -42.59 60.01 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.576 1.08 . . . . 0.0 113.809 178.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 48.4 t -89.85 -32.15 17.03 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 118.79 0.723 . . . . 0.0 111.771 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 tp -56.58 -40.36 75.11 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.79 0.836 . . . . 0.0 111.311 176.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -78.32 -16.43 57.73 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 175.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -88.69 -56.19 2.03 Favored Glycine 0 N--CA 1.47 0.954 0 C-N-CA 125.931 1.729 . . . . 0.0 111.883 -177.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 52.0 m -64.27 -6.66 7.29 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 125.309 1.444 . . . . 0.0 111.942 168.052 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.49 6.62 84.52 Favored Glycine 0 C--N 1.341 0.849 0 C-N-CA 124.979 1.276 . . . . 0.0 114.176 171.254 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.7 mt -48.41 -28.73 3.42 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.262 1.425 . . . . 0.0 113.15 170.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.7 m -132.12 143.73 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 126.173 1.789 . . . . 0.0 112.23 173.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 45.4 t -126.5 143.3 40.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 127.154 2.182 . . . . 0.0 110.047 -175.662 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -89.54 154.03 20.32 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.111 1.364 . . . . 0.0 113.795 173.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.4 m -163.01 161.59 25.55 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.702 1.601 . . . . 0.0 108.471 -174.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.422 ' HA ' ' HA ' ' A' ' 73' ' ' VAL . 17.4 m-85 -80.47 156.63 26.49 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 119.672 1.124 . . . . 0.0 113.05 169.265 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -115.41 -152.5 0.5 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.04 1.336 . . . . 0.0 108.825 166.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.02 -22.19 60.07 Favored Glycine 0 CA--C 1.537 1.414 0 CA-C-N 121.01 1.732 . . . . 0.0 115.156 -175.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.74 -23.34 0.08 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.708 1.203 . . . . 0.0 113.871 169.397 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -95.14 -170.24 2.15 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.484 1.914 . . . . 0.0 109.982 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' A' ' 68' ' ' TYR . 35.1 m -109.9 166.09 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 124.61 1.164 . . . . 0.0 109.959 169.282 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.0 ptt180 -140.8 171.04 14.64 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 128.178 2.591 . . . . 0.0 110.319 -170.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -124.03 139.05 54.32 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.88 1.272 . . . . 0.0 108.008 167.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.577 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -131.98 161.4 33.22 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 126.314 1.846 . . . . 0.0 109.547 175.743 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.0 mt -60.77 159.53 10.87 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 118.732 0.696 . . . . 0.0 110.248 169.086 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -42.49 -44.37 4.05 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.436 1.494 . . . . 0.0 114.334 -176.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.411 ' CG ' ' H ' ' A' ' 80' ' ' SER . 17.4 t70 -177.55 -172.35 0.36 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 129.491 3.116 . . . . 0.0 109.576 169.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.411 ' H ' ' CG ' ' A' ' 79' ' ' ASP . 14.3 t -53.37 -20.92 5.0 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 127.32 2.248 . . . . 0.0 113.396 174.185 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -46.92 87.76 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.224 1.009 . . . . 0.0 111.692 176.406 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 8.8 mt -86.52 -31.99 20.98 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.193 0.906 . . . . 0.0 111.202 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.58 -28.6 65.69 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.036 0.835 . . . . 0.0 112.893 170.303 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.9 mmt180 -69.33 -65.68 0.68 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.256 1.422 . . . . 0.0 112.002 169.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.83 -19.54 64.18 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -175.09 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.34 -38.82 14.82 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.6 -1.312 . . . . 0.0 111.949 167.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.47 -52.71 20.16 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 126.361 1.934 . . . . 0.0 114.372 -177.086 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.26 -6.89 56.32 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.562 1.181 . . . . 0.0 112.56 169.462 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 18.8 tp 77.79 128.47 0.05 OUTLIER 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 129.393 3.077 . . . . 0.0 113.201 167.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.415 ' HB ' HG22 ' A' ' 92' ' ' VAL . 2.4 m -34.13 -21.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 131.129 3.771 . . . . 0.0 116.532 170.029 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 76.57 -9.9 1.41 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.287 1.835 . . . . 0.0 114.063 165.533 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.415 HG22 ' HB ' ' A' ' 90' ' ' VAL . 17.3 m -64.57 57.44 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.717 1 C-N-CA 132.497 4.319 . . . . 0.0 112.159 169.704 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . 0.396 0.5 OUTLIER 19.04 44.86 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.424 -1.762 0 CA-C-N 108.581 -3.918 . . . . 0.0 116.272 -162.805 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 50.8 tp 61.29 83.91 0.14 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.851 2.061 . . . . 0.0 111.674 -169.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.69 85.76 0.05 OUTLIER 'General case' 0 CA--C 1.55 0.948 0 O-C-N 121.057 -1.027 . . . . 0.0 111.712 170.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 89.9 t -59.04 153.94 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 127.829 2.452 . . . . 0.0 111.199 169.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -42.96 1.79 0.0 OUTLIER 'General case' 0 CA--C 1.565 1.524 1 C-N-CA 131.727 4.011 . . . . 0.0 117.162 169.885 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -97.17 146.82 24.7 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 128.23 2.612 . . . . 0.0 116.501 -169.42 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -89.21 73.29 8.11 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.967 1.707 . . . . 0.0 109.759 167.012 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -65.64 146.91 98.95 Favored Pre-proline 0 CA--C 1.549 0.907 0 O-C-N 120.845 -1.16 . . . . 0.0 109.93 169.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.67 97.17 0.78 Allowed 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.477 2.785 . . . . 0.0 112.746 -178.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -55.15 -6.16 0.14 Allowed 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 129.452 3.101 . . . . 0.0 116.155 -178.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 14.4 t 71.3 -51.05 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 128.853 2.861 . . . . 0.0 111.263 -173.202 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -77.96 -65.94 0.91 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.335 1.454 . . . . 0.0 111.881 -173.423 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -78.29 -31.52 48.95 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 117.835 0.289 . . . . 0.0 110.859 168.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 . . . . . 0 CA--C 1.548 0.878 0 C-N-CA 127.106 2.162 . . . . 0.0 110.583 175.991 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.058 0 CA-C-O 118.727 -0.654 . . . . 0.0 110.074 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 19.0 tp -51.31 -47.1 62.71 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.124 0.875 . . . . 0.0 110.691 170.303 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.48 -3.07 3.87 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 116.416 2.006 . . . . 0.0 116.416 178.107 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 66.2 mtt-85 -124.29 -42.21 2.13 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.004 1.321 . . . . 0.0 110.757 -179.393 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.425 HD13 ' C ' ' B' ' 14' ' ' LEU . 0.9 OUTLIER -53.73 -52.89 58.67 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.94 1.696 . . . . 0.0 108.763 168.283 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.52 -23.19 78.34 Favored Glycine 0 C--O 1.222 -0.649 0 CA-C-O 118.645 -1.086 . . . . 0.0 111.392 -178.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.402 HH11 ' HG3' ' B' ' 16' ' ' ARG . 2.1 ttm-85 -68.37 -44.51 75.04 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.214 1.507 . . . . 0.0 110.515 168.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.99 -30.13 70.63 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.987 0.812 . . . . 0.0 112.511 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 5.9 mp -93.42 9.56 35.97 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 124.335 1.054 . . . . 0.0 113.095 169.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -111.6 1.63 16.91 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.625 1.57 . . . . 0.0 112.16 165.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -75.19 146.3 81.61 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 126.034 1.734 . . . . 0.0 112.371 -169.213 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -59.31 -19.3 49.92 Favored 'Trans proline' 0 C--N 1.349 0.571 1 C-N-CA 125.479 4.119 . . . . 0.0 116.073 179.706 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -143.09 -30.57 0.51 Allowed 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.121 -176.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.584 ' HG2' HD13 ' B' ' 58' ' ' LEU . 0.0 OUTLIER -61.11 -30.6 70.46 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.359 1.436 . . . . 0.0 112.744 176.974 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 88.0 m -53.4 -52.76 58.32 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.581 1.152 . . . . 0.0 111.134 168.018 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 12.5 ttm180 -61.53 -43.19 99.31 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.274 1.03 . . . . 0.0 112.413 173.288 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 26' ' ' ILE . . . . . 0.648 HG12 HD11 ' B' ' 44' ' ' LEU . 2.5 mt -51.36 -57.65 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 C-N-CA 124.734 1.214 . . . . 0.0 110.839 174.109 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 86.4 mt -55.81 -44.34 77.75 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.501 1.12 . . . . 0.0 111.817 -175.267 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 8.8 p -76.45 -31.41 20.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 CA-C-N 119.373 0.988 . . . . 0.0 113.1 178.187 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.13 -31.51 66.07 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.716 -0.615 . . . . 0.0 111.985 174.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' B' ' 30' ' ' LEU . 10.7 tp -60.64 -41.27 94.6 Favored 'General case' 0 C--N 1.341 0.221 0 O-C-N 120.924 -1.11 . . . . 0.0 112.828 178.366 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -43.33 -36.74 1.98 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 129.377 3.071 . . . . 0.0 113.423 173.17 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -90.33 -34.17 15.81 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.447 1.899 . . . . 0.0 112.697 178.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -93.38 -68.27 1.09 Allowed Glycine 0 C--N 1.338 0.676 0 C-N-CA 123.706 0.669 . . . . 0.0 114.105 -168.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 34' ' ' VAL . . . . . 0.409 HG12 ' HA ' ' B' ' 76' ' ' ALA . 31.2 m 36.78 33.98 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 C-N-CA 126.47 1.908 . . . . 0.0 115.311 -167.242 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.04 -63.6 1.35 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.456 -0.778 . . . . 0.0 113.064 -169.022 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 36' ' ' TYR . . . . . 0.41 ' HA ' ' HA ' ' B' ' 74' ' ' ARG . 6.0 p90 -161.1 161.31 24.0 Favored Pre-proline 0 C--O 1.24 0.59 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 -169.392 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -58.65 127.16 23.52 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.288 1.992 . . . . 0.0 107.601 167.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.47 2.93 90.7 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-O 117.321 -1.822 . . . . 0.0 114.782 -175.231 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 3.7 pp0? -62.8 -41.07 99.12 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 121.279 2.539 . . . . 0.0 110.394 169.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 29.7 mt -54.66 -19.07 5.38 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 125.647 1.579 . . . . 0.0 112.958 176.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.89 -32.47 67.74 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.571 1.078 . . . . 0.0 112.553 172.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.81 -51.29 11.61 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.286 0.634 . . . . 0.0 111.96 170.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 34.2 m170 -56.03 -24.29 38.37 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.997 1.481 . . . . 0.0 114.997 179.344 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.648 HD11 HG12 ' B' ' 26' ' ' ILE . 56.4 mt -112.29 -4.16 14.39 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.845 1.658 . . . . 0.0 113.277 -177.067 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 61.05 7.81 9.62 Favored Glycine 0 CA--C 1.536 1.377 0 CA-C-O 119.013 -0.881 . . . . 0.0 114.818 -172.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 16.2 mt -102.04 162.44 12.91 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.703 1.601 . . . . 0.0 113.067 -169.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.494 HG23 ' H ' ' B' ' 50' ' ' ASN . 1.5 t -61.57 138.5 58.3 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 121.237 -0.914 . . . . 0.0 111.24 172.416 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 66.7 mtt180 -49.93 -31.62 12.84 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.561 1.945 . . . . 0.0 111.936 173.305 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 60.7 p -72.47 -52.39 15.99 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 118.664 0.665 . . . . 0.0 112.724 173.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 50' ' ' ASN . . . . . 0.494 ' H ' HG23 ' B' ' 47' ' ' THR . 44.2 t30 -69.5 -25.57 64.12 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 120.662 1.573 . . . . 0.0 113.259 -179.476 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 51' ' ' VAL . . . . . 0.543 HG22 HD12 ' B' ' 44' ' ' LEU . 37.2 t -61.1 -51.87 68.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 O-C-N 121.514 -0.741 . . . . 0.0 109.436 167.36 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 78.0 p -75.77 -27.56 58.09 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 115.741 1.756 . . . . 0.0 115.741 -176.235 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -36.86 -56.15 0.87 Allowed 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 123.984 1.85 . . . . 0.0 109.895 168.181 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 27.4 m-70 -90.43 -4.33 57.08 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -178.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 86.9 mt -72.19 -16.64 61.96 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.73 -1.231 . . . . 0.0 108.979 164.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 21.3 t -49.92 -42.11 47.5 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.911 1.232 . . . . 0.0 112.64 168.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 7.2 t -84.34 -44.84 13.4 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 119.478 1.035 . . . . 0.0 112.03 178.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.584 HD13 ' HG2' ' B' ' 23' ' ' ARG . 6.9 tp -56.71 -34.61 67.64 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.382 0.673 . . . . 0.0 111.683 -176.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 38.3 mtm105 -81.68 -31.46 32.23 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.121 0.968 . . . . 0.0 113.551 174.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.5 -50.14 39.67 Favored Glycine 0 N--CA 1.473 1.116 0 CA-C-N 119.253 0.933 . . . . 0.0 111.931 177.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 56.9 m -65.95 -0.63 2.43 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 125.737 1.615 . . . . 0.0 113.115 172.013 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.04 -8.78 10.82 Favored Glycine 0 C--N 1.342 0.863 0 C-N-CA 125.67 1.605 . . . . 0.0 114.88 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 20.7 mt -52.33 -28.12 18.05 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.819 1.647 . . . . 0.0 113.59 -176.193 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.414 HG12 ' CD2' ' B' ' 30' ' ' LEU . 3.0 m -125.98 141.64 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 126.624 1.97 . . . . 0.0 112.036 167.715 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 64.7 t -132.58 141.73 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 127.376 2.27 . . . . 0.0 109.557 -174.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.67 164.43 22.83 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.971 1.309 . . . . 0.0 113.175 178.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.44 ' HB ' ' HG2' ' B' ' 74' ' ' ARG . 0.2 OUTLIER -165.89 173.1 10.88 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.325 1.05 . . . . 0.0 108.671 178.896 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -94.9 157.15 16.04 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.21 0.604 . . . . 0.0 110.196 164.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -120.92 -151.03 0.47 Allowed 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.282 1.433 . . . . 0.0 109.321 167.523 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.6 -24.61 59.91 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-N 120.719 1.599 . . . . 0.0 115.105 -174.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.79 -21.94 0.08 Allowed 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 118.628 1.214 . . . . 0.0 113.93 168.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -97.1 -174.21 2.9 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.307 1.843 . . . . 0.0 109.78 -178.432 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 34.6 m -105.46 162.02 4.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.514 1.125 . . . . 0.0 109.482 168.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 74' ' ' ARG . . . . . 0.44 ' HG2' ' HB ' ' B' ' 67' ' ' THR . 6.7 ptt180 -137.54 175.45 9.59 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 126.928 2.091 . . . . 0.0 111.039 -171.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -129.14 141.41 51.19 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.435 1.094 . . . . 0.0 109.032 166.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.409 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -138.47 159.77 41.22 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 125.855 1.662 . . . . 0.0 110.113 178.299 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 50.0 mt -58.21 152.62 16.74 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 122.699 0.4 . . . . 0.0 111.362 172.025 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -46.89 -46.64 21.31 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.834 1.654 . . . . 0.0 114.01 -174.133 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -162.3 166.12 25.74 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 127.014 2.126 . . . . 0.0 108.58 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 8.0 t -52.12 -20.11 2.33 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.035 1.334 . . . . 0.0 113.322 168.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.54 -48.07 82.08 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.86 1.664 . . . . 0.0 113.428 170.609 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 18.2 mt -75.96 -35.37 59.69 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 119.578 1.081 . . . . 0.0 110.084 176.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.17 -28.59 66.75 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 118.848 0.749 . . . . 0.0 112.823 173.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 12.0 mmt180 -76.15 -64.31 1.13 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.679 1.591 . . . . 0.0 112.314 174.133 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.81 -22.46 64.18 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -178.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.35 -45.12 13.1 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.262 -0.899 . . . . 0.0 111.097 168.661 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.59 -49.21 45.4 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.895 1.712 . . . . 0.0 115.006 -173.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.9 -5.23 55.17 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.644 1.222 . . . . 0.0 112.292 169.345 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 17.9 tp 77.49 127.58 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 128.825 2.85 . . . . 0.0 113.294 168.347 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 90' ' ' VAL . . . . . 0.414 ' HB ' HG22 ' B' ' 92' ' ' VAL . 2.2 m -35.71 -19.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 131.234 3.814 . . . . 0.0 115.951 168.266 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 75.37 -7.48 1.77 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 127.272 2.229 . . . . 0.0 114.273 167.325 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.414 HG22 ' HB ' ' B' ' 90' ' ' VAL . 13.5 m -69.45 60.29 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.616 1 C-N-CA 131.715 4.006 . . . . 0.0 112.069 174.055 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.39 0.5 OUTLIER 21.79 38.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.425 -1.697 2 CA-C-N 107.302 -4.499 . . . . 0.0 116.461 -163.375 . . . . . . . . 4 3 . 1 . 017 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 37.8 tp 64.39 73.8 0.42 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.023 1.729 . . . . 0.0 111.511 -169.326 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.02 98.17 0.07 Allowed 'General case' 0 CA--C 1.55 0.955 0 O-C-N 120.764 -1.21 . . . . 0.0 111.91 169.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -74.56 160.08 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 C-N-CA 126.874 2.07 . . . . 0.0 112.412 174.539 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -44.06 -6.69 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.235 1 C-N-CA 131.802 4.041 . . . . 0.0 117.63 178.087 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.13 152.16 19.42 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 126.382 1.873 . . . . 0.0 115.21 -172.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -92.05 80.46 5.12 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.073 1.749 . . . . 0.0 109.544 167.228 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -64.5 162.87 30.65 Favored Pre-proline 0 CA--C 1.557 1.242 0 C-N-CA 124.812 1.245 . . . . 0.0 112.187 174.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -75.74 73.34 4.77 Favored 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 124.112 3.208 . . . . 0.0 113.945 -176.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 102' ' ' CYS . . . . . 0.458 ' HB2' ' HD2' ' A' ' 13' ' ' ARG . 2.5 t -35.17 -17.89 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.178 1 C-N-CA 133.037 4.535 . . . . 0.0 119.842 175.789 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER 63.35 -26.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 130.939 3.696 . . . . 0.0 115.654 -170.577 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -103.18 -44.55 5.16 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 116.007 1.854 . . . . 0.0 116.007 -167.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -104.94 -62.7 1.31 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.322 0.965 . . . . 0.0 111.949 -176.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 . . . . . 0 CA--C 1.55 0.952 0 C-N-CA 126.804 2.041 . . . . 0.0 114.031 177.431 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.652 0 CA-C-O 120.871 0.367 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.1 tt -59.99 -41.86 92.97 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.653 0.781 . . . . 0.0 111.22 -175.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.41 -9.28 32.25 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.2 mmp_? -96.2 -58.53 2.05 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.376 -0.828 . . . . 0.0 108.983 165.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.411 ' CD2' HD21 ' A' ' 63' ' ' LEU . 1.6 tm? -59.94 -54.49 45.5 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.246 1.418 . . . . 0.0 111.878 -173.12 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.91 -28.79 73.96 Favored Glycine 0 CA--C 1.528 0.864 0 O-C-N 121.647 -0.658 . . . . 0.0 113.015 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 54.8 ttt-85 -74.9 -26.93 60.0 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.119 0.967 . . . . 0.0 111.78 174.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -87.21 -3.92 59.08 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.293 1.037 . . . . 0.0 113.616 172.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.1 mt -99.42 -24.22 14.86 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.747 1.219 . . . . 0.0 110.857 168.367 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.38 82.78 3.17 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.205 1.402 . . . . 0.0 114.166 -174.032 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -150.82 154.26 34.49 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 125.743 1.617 . . . . 0.0 111.229 -176.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -57.74 -67.4 0.07 OUTLIER 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 124.103 3.202 . . . . 0.0 112.025 175.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 55.9 m -74.2 -43.71 56.13 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.386 1.074 . . . . 0.0 111.241 -177.012 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.535 ' CD ' HD13 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -60.17 -32.83 71.43 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 118.343 -0.837 . . . . 0.0 112.704 -175.486 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.5 t -56.54 -53.45 57.38 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.292 0.951 . . . . 0.0 111.072 168.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -57.76 -46.28 84.74 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.747 -0.596 . . . . 0.0 112.49 175.496 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.7 mt -45.33 -56.48 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-N 118.677 0.671 . . . . 0.0 110.075 173.298 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 27' ' ' LEU . 21.5 mt -65.77 -32.78 74.51 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -169.352 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.6 m -66.85 -34.63 71.24 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 CA-C-N 120.435 1.471 . . . . 0.0 111.62 170.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.52 -6.15 57.77 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.078 1.351 . . . . 0.0 113.766 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -80.5 -48.11 13.28 Favored 'General case' 0 CA--C 1.519 -0.242 0 C-N-CA 125.262 1.425 . . . . 0.0 109.219 -178.169 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.0 mt -48.38 -59.36 3.52 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.913 2.485 . . . . 0.0 110.873 172.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -85.95 26.67 0.97 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.636 1.575 . . . . 0.0 111.827 174.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.07 -87.28 0.7 Allowed Glycine 0 C--N 1.337 0.601 0 C-N-CA 125.469 1.509 . . . . 0.0 111.274 -173.406 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.467 HG12 ' HA ' ' A' ' 76' ' ' ALA . 26.9 m 36.6 22.5 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 N-CA-C 118.826 2.899 . . . . 0.0 118.826 -179.62 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 98.5 m -83.72 -67.08 0.82 Allowed 'General case' 0 N--CA 1.471 0.579 0 O-C-N 120.137 -1.602 . . . . 0.0 112.887 -177.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.4 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 45.4 p90 -156.57 162.15 28.11 Favored Pre-proline 0 CA--C 1.544 0.749 0 O-C-N 121.25 -0.906 . . . . 0.0 113.015 -172.283 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -56.79 109.98 0.52 Allowed 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.607 2.871 . . . . 0.0 111.304 175.357 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 90.99 7.75 65.62 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-O 117.464 -1.742 . . . . 0.0 115.532 -175.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.4 ' HG2' ' H ' ' A' ' 36' ' ' TYR . 5.0 pp0? -59.66 -37.22 78.15 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 120.582 2.191 . . . . 0.0 110.564 168.799 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 20.3 mt -50.76 -26.21 5.34 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 126.054 1.741 . . . . 0.0 112.562 173.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.64 -36.95 77.4 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.895 -0.574 . . . . 0.0 112.253 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -42.58 62.33 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.233 0.469 . . . . 0.0 111.527 175.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.4 m-70 -60.13 -32.58 71.15 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 176.482 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 16.8 mt -105.6 -21.28 13.23 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -172.133 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.79 2.51 64.98 Favored Glycine 0 CA--C 1.536 1.374 0 CA-C-N 119.323 0.965 . . . . 0.0 114.331 -171.212 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -98.13 142.28 30.02 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.282 1.433 . . . . 0.0 109.759 175.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.8 p -61.4 150.94 33.79 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.136 -0.977 . . . . 0.0 111.853 -173.352 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -59.43 -19.83 50.39 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 175.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -78.17 -46.25 21.04 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 118.937 0.79 . . . . 0.0 110.981 171.655 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -65.73 -45.08 83.99 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.363 1.065 . . . . 0.0 112.552 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 80.9 t -61.22 -39.17 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 CA-C-N 118.53 0.604 . . . . 0.0 111.504 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 69.6 m -66.26 -26.46 67.36 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -178.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -51.32 -37.27 46.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.902 1.281 . . . . 0.0 111.727 170.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -90.34 -12.38 37.86 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 176.202 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 95.0 mt -81.23 -27.71 35.14 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 117.922 -1.037 . . . . 0.0 111.675 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.42 -37.47 83.62 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 121.0 1.727 . . . . 0.0 113.467 -177.76 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 51.5 t -86.48 -15.33 40.47 Favored 'General case' 0 CA--C 1.558 1.265 0 O-C-N 120.827 -1.171 . . . . 0.0 111.718 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.535 HD13 ' CD ' ' A' ' 23' ' ' ARG . 7.4 tp -68.11 -41.79 81.23 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 119.579 -1.95 . . . . 0.0 108.895 167.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 45.5 mtm180 -78.44 -13.51 59.81 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.066 1.746 . . . . 0.0 112.292 176.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -96.07 -57.38 1.15 Allowed Glycine 0 N--CA 1.47 0.901 0 C-N-CA 125.97 1.748 . . . . 0.0 111.659 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.7 m -74.48 23.63 0.09 Allowed 'General case' 0 CA--C 1.566 1.58 0 C-N-CA 125.098 1.359 . . . . 0.0 112.854 173.124 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 59.2 28.73 64.61 Favored Glycine 0 N--CA 1.476 1.313 0 C-N-CA 127.152 2.31 . . . . 0.0 117.482 167.062 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.411 HD21 ' CD2' ' A' ' 14' ' ' LEU . 70.6 mt -82.21 -30.14 31.02 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.187 0.995 . . . . 0.0 113.324 177.225 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.0 m -133.33 144.93 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.951 1.7 . . . . 0.0 111.092 -178.221 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 72.0 t -129.09 139.95 50.51 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 126.295 1.838 . . . . 0.0 109.179 -175.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.94 142.92 52.83 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.577 1.151 . . . . 0.0 112.267 172.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 16.8 m -155.58 155.38 33.24 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.438 1.095 . . . . 0.0 108.233 176.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.23 125.71 31.25 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 119.379 0.99 . . . . 0.0 109.144 167.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.42 -16.32 63.87 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.525 1.057 . . . . 0.0 113.525 175.174 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 154.71 -32.89 0.68 Allowed Glycine 0 CA--C 1.531 1.087 0 C-N-CA 126.804 2.145 . . . . 0.0 112.153 -179.056 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.48 -21.45 0.2 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.346 1.458 . . . . 0.0 113.376 172.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -104.59 169.26 8.56 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.393 2.277 . . . . 0.0 110.028 174.109 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 10.0 p -92.58 145.52 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.621 0.768 . . . . 0.0 110.948 173.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -131.27 164.4 25.67 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.139 1.775 . . . . 0.0 110.855 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -115.93 120.02 37.83 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.265 1.026 . . . . 0.0 108.547 167.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.467 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -121.76 155.37 35.42 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 118.59 0.632 . . . . 0.0 112.191 175.641 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 tp -52.82 140.71 23.42 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.855 1.262 . . . . 0.0 109.626 173.453 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.57 -31.55 72.66 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -171.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -164.79 179.56 6.46 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 -178.292 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 20.1 m -55.89 -33.03 64.24 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.088 1.755 . . . . 0.0 114.208 171.382 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -68.74 -45.02 72.56 Favored 'General case' 0 C--N 1.344 0.333 0 CA-C-N 119.926 1.239 . . . . 0.0 112.467 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.9 mt -69.94 -40.65 75.37 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 120.13 1.332 . . . . 0.0 109.881 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.9 -35.15 75.92 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.455 0.702 . . . . 0.0 109.877 -178.671 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -71.95 -50.2 31.02 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 126.377 1.871 . . . . 0.0 112.649 172.08 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.94 -46.63 77.48 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 121.115 1.779 . . . . 0.0 111.593 -177.266 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.4 -51.27 70.22 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.715 0.806 . . . . 0.0 109.647 171.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -79.99 21.69 4.71 Favored Glycine 0 CA--C 1.537 1.462 0 C-N-CA 126.465 1.983 . . . . 0.0 114.699 -179.562 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 23.5 tp10 -101.8 -65.49 0.98 Allowed 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 126.427 1.891 . . . . 0.0 108.782 167.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 7.7 tp 165.85 -29.34 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.95 1.7 . . . . 0.0 112.021 -167.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.293 22.9 t 58.39 11.59 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 127.514 2.326 . . . . 0.0 111.837 -166.22 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.467 ' C ' ' H ' ' A' ' 93' ' ' VAL . 1.8 tp-100 88.01 -19.32 0.23 Allowed 'General case' 0 C--O 1.218 -0.575 0 O-C-N 120.315 -1.49 . . . . 0.0 109.452 135.813 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.9 p -75.01 37.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 127.338 2.255 . . . . 0.0 110.268 163.387 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.467 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.6 t 71.19 -8.9 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 C-N-CA 127.776 2.43 . . . . 0.0 114.106 174.597 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 99.02 102.75 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 131.112 3.765 . . . . 0.0 107.865 -169.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.13 137.6 58.23 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.251 1.821 . . . . 0.0 115.179 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 25.4 m -74.97 162.39 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 126.53 1.932 . . . . 0.0 113.906 171.245 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.03 -41.13 97.53 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 128.738 2.815 . . . . 0.0 115.235 178.669 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 23.6 p -71.26 76.77 0.72 Allowed 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.767 1.167 . . . . 0.0 111.007 170.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . 0.267 1.8 p-10 -71.43 80.3 0.77 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 123.799 1.762 . . . . 0.0 109.473 169.178 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -61.2 138.42 94.45 Favored Pre-proline 0 CA--C 1.545 0.762 0 CA-C-N 114.205 -1.362 . . . . 0.0 109.894 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.76 160.49 49.52 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 123.97 3.114 . . . . 0.0 116.077 -166.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 8.1 t -44.6 116.4 1.05 Allowed 'General case' 0 C--N 1.347 0.476 0 C-N-CA 125.721 1.608 . . . . 0.0 111.303 -169.114 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 3.4 p -76.55 -8.95 12.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 -166.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.27 128.62 33.98 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.603 -0.686 . . . . 0.0 110.075 -175.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 24.9 mp0 48.87 24.06 0.78 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 125.763 1.625 . . . . 0.0 114.112 -173.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 . . . . . 0 C--O 1.237 0.439 0 N-CA-C 117.162 2.282 . . . . 0.0 117.162 -164.807 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.707 0 CA-C-O 121.476 0.655 . . . . 0.0 111.813 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 tt -55.66 -41.84 74.21 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.552 1.541 . . . . 0.0 111.235 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.28 -11.36 30.97 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 178.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 13.0 mmp_? -98.2 -56.2 2.55 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.227 1.011 . . . . 0.0 109.663 167.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -60.49 -51.58 68.84 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.369 1.468 . . . . 0.0 111.618 -173.517 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.97 -34.1 89.0 Favored Glycine 0 CA--C 1.529 0.952 0 C-N-CA 124.094 0.854 . . . . 0.0 112.976 175.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -70.19 -36.58 74.73 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.208 1.004 . . . . 0.0 111.109 175.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.3 -24.65 60.43 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.971 0.908 . . . . 0.0 112.745 175.159 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 11.7 mt -77.89 -29.87 50.48 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.414 1.086 . . . . 0.0 111.387 168.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -99.93 50.37 0.91 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.465 1.506 . . . . 0.0 114.436 -171.361 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -114.87 149.72 42.9 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 127.21 2.204 . . . . 0.0 108.593 174.37 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -61.48 -52.84 2.78 Favored 'Trans proline' 0 CA--C 1.534 0.485 0 C-N-CA 124.317 3.345 . . . . 0.0 111.888 -171.091 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.437 ' HB ' ' CD2' ' B' ' 54' ' ' HIS . 15.9 m -76.6 -41.63 45.43 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 117.866 -1.064 . . . . 0.0 110.759 177.124 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 22.3 mtm180 -59.51 -36.9 76.98 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 120.177 1.353 . . . . 0.0 112.963 -176.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 53.8 t -48.79 -55.92 10.17 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.547 0.739 . . . . 0.0 110.37 169.11 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 25' ' ' ARG . . . . . 0.493 ' HB3' HD22 ' B' ' 44' ' ' LEU . 7.9 mpt_? -57.93 -51.86 67.9 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 118.502 -0.761 . . . . 0.0 113.027 172.827 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 3.8 mt -44.7 -55.69 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 CA-C-N 119.387 0.994 . . . . 0.0 109.6 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 29.2 mt -64.26 -38.11 89.87 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 116.701 -1.618 . . . . 0.0 114.374 -169.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -65.92 -35.44 75.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 CA-C-N 120.88 1.673 . . . . 0.0 111.296 172.155 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.58 -13.44 56.54 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.793 1.237 . . . . 0.0 113.821 179.156 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.45 -47.08 28.84 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.045 0.938 . . . . 0.0 109.748 -175.279 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 mt -48.46 -48.35 37.66 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 128.735 2.814 . . . . 0.0 112.382 172.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -94.79 18.81 11.06 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.052 1.741 . . . . 0.0 111.968 175.493 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.73 -85.46 1.08 Allowed Glycine 0 C--O 1.222 -0.609 0 C-N-CA 125.343 1.449 . . . . 0.0 111.16 -172.11 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 34' ' ' VAL . . . . . 0.461 HG12 ' HA ' ' B' ' 76' ' ' ALA . 11.5 m 32.15 27.57 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 N-CA-C 118.761 2.874 . . . . 0.0 118.761 -174.769 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 73.1 m -81.82 -75.99 0.27 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 120.941 1.7 . . . . 0.0 111.497 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -155.72 166.52 16.13 Favored Pre-proline 0 CA--C 1.55 0.968 0 O-C-N 120.55 -1.344 . . . . 0.0 113.052 -170.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.18 89.73 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 124.756 3.637 . . . . 0.0 113.017 177.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 123.83 -4.97 9.14 Favored Glycine 0 C--O 1.221 -0.67 0 CA-C-O 117.309 -1.828 . . . . 0.0 115.624 -176.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -57.75 -34.99 70.12 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 120.425 2.113 . . . . 0.0 112.426 175.563 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 23.2 mt -53.85 -22.68 10.32 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 124.669 1.188 . . . . 0.0 112.445 177.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.33 88.84 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 118.926 -0.559 . . . . 0.0 111.938 -177.401 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.3 -34.86 65.96 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 122.999 0.52 . . . . 0.0 112.02 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 5.4 m-70 -65.54 -27.61 68.57 Favored 'General case' 0 CA--C 1.553 1.067 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 174.022 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.493 HD22 ' HB3' ' B' ' 25' ' ' ARG . 15.1 mt -114.7 -20.39 10.68 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.684 1.364 . . . . 0.0 114.684 -170.029 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.94 -2.1 61.19 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 125.204 1.383 . . . . 0.0 114.417 -171.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -93.96 143.72 26.1 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.693 1.197 . . . . 0.0 110.113 176.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.4 p -61.52 149.99 37.21 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 121.14 -0.975 . . . . 0.0 111.175 -177.057 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -60.8 -19.25 59.17 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 174.086 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 6.5 t -77.24 -37.66 52.74 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 118.752 0.705 . . . . 0.0 112.185 170.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -74.68 -47.91 29.03 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.751 0.821 . . . . 0.0 111.424 175.221 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 63.2 t -58.92 -38.1 71.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-N 119.643 1.11 . . . . 0.0 111.803 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 55.5 m -66.6 -21.52 66.13 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -56.38 -51.19 69.24 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 122.947 1.356 . . . . 0.0 109.835 174.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 54' ' ' HIS . . . . . 0.437 ' CD2' ' HB ' ' B' ' 22' ' ' THR . 55.4 m-70 -73.84 -8.92 57.89 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 172.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 95.6 mt -83.25 -22.69 33.0 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 117.358 -1.306 . . . . 0.0 112.285 173.465 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.34 -37.81 81.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 121.201 1.819 . . . . 0.0 112.627 178.243 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 48.5 t -91.06 -13.74 32.61 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 118.129 0.422 . . . . 0.0 111.32 176.568 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 4.9 tp -70.34 -42.99 71.14 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 119.461 -2.024 . . . . 0.0 109.286 167.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 37.1 mtm105 -83.07 -5.98 59.31 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.966 1.706 . . . . 0.0 112.519 174.584 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.22 -65.11 1.12 Allowed Glycine 0 C--N 1.336 0.536 0 N-CA-C 109.409 -1.477 . . . . 0.0 109.409 174.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 60.6 m -72.22 26.43 0.05 Allowed 'General case' 0 CA--C 1.564 1.482 0 C-N-CA 126.517 1.927 . . . . 0.0 113.287 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.95 20.76 58.07 Favored Glycine 0 N--CA 1.474 1.18 0 C-N-CA 127.515 2.483 . . . . 0.0 117.409 167.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 60.4 mt -77.65 -35.9 52.06 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.885 0.874 . . . . 0.0 113.205 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 1.7 m -126.64 142.07 44.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 126.273 1.829 . . . . 0.0 111.225 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 54.6 t -123.76 138.31 53.94 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 127.068 2.147 . . . . 0.0 108.85 -178.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.06 139.99 38.0 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 123.976 0.91 . . . . 0.0 111.317 176.339 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 41.1 m -152.48 159.58 43.33 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.584 1.554 . . . . 0.0 107.128 -174.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -87.86 135.69 33.28 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.497 1.499 . . . . 0.0 112.246 169.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -78.13 45.2 0.53 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.269 1.428 . . . . 0.0 109.808 167.457 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 76.51 -46.5 2.27 Favored Glycine 0 CA--C 1.534 1.262 0 O-C-N 120.204 -1.56 . . . . 0.0 113.011 -169.654 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -126.37 -46.43 1.62 Allowed 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.725 1.263 . . . . 0.0 114.073 -173.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -97.9 175.49 6.12 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.896 1.225 . . . . 0.0 110.504 173.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 14.9 p -93.34 141.29 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.255 1.022 . . . . 0.0 111.26 174.376 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 29.4 ptt180 -125.38 163.11 23.31 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 127.477 2.311 . . . . 0.0 110.853 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -113.19 118.82 35.76 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.993 0.917 . . . . 0.0 108.728 168.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.461 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -119.09 152.26 36.8 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.077 0.951 . . . . 0.0 111.355 178.243 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 tp -52.77 141.69 20.69 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.95 0.9 . . . . 0.0 109.989 171.351 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.54 -32.28 72.1 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -172.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -164.94 176.1 8.95 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 22.5 m -52.23 -31.66 33.22 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.104 1.762 . . . . 0.0 114.501 171.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 7.9 m-70 -72.19 -44.37 63.1 Favored 'General case' 0 C--N 1.345 0.37 0 CA-C-O 117.286 -1.34 . . . . 0.0 112.822 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 9.5 mt -69.13 -40.28 78.38 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 120.665 1.575 . . . . 0.0 109.701 174.288 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.23 -38.7 84.19 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.612 0.765 . . . . 0.0 109.874 -179.185 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 4.8 tpm_? -71.36 -50.13 35.3 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.571 1.549 . . . . 0.0 112.776 171.069 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.61 -44.36 86.76 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 121.589 1.995 . . . . 0.0 111.657 -173.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.67 -53.26 58.48 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.616 1.167 . . . . 0.0 109.45 170.545 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.46 -7.86 83.25 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.175 1.369 . . . . 0.0 115.63 -172.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 28.1 tp10 -69.07 -63.51 1.05 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 126.387 1.875 . . . . 0.0 109.016 169.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 10.7 tp 163.22 -26.59 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.838 2.055 . . . . 0.0 113.232 -170.128 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . 0.305 42.1 t 58.17 11.97 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 126.827 2.051 . . . . 0.0 111.935 -164.065 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 91' ' ' GLN . . . . . 0.432 ' C ' ' H ' ' B' ' 93' ' ' VAL . 3.0 tp-100 86.34 -23.06 0.15 Allowed 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 125.136 1.374 . . . . 0.0 110.818 135.613 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.6 p -69.01 33.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 C-N-CA 129.068 2.947 . . . . 0.0 112.444 168.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 93' ' ' VAL . . . . . 0.432 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.3 OUTLIER 67.88 11.56 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 126.966 2.106 . . . . 0.0 113.402 176.0 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 tt 91.97 101.23 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 130.228 3.411 . . . . 0.0 109.709 -176.039 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.28 127.27 31.28 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -178.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 26.8 m -69.08 159.39 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 125.915 1.686 . . . . 0.0 114.726 171.617 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.44 -37.56 80.37 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 128.435 2.694 . . . . 0.0 115.413 -178.471 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 61.2 p -78.02 91.64 4.27 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.714 1.143 . . . . 0.0 110.759 172.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -73.35 86.04 1.48 Allowed 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 122.945 1.355 . . . . 0.0 108.868 167.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 72.0 mm-40 -64.23 140.98 98.05 Favored Pre-proline 0 CA--C 1.55 0.95 0 O-C-N 120.887 -1.133 . . . . 0.0 109.091 174.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -69.73 152.95 69.57 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 123.748 2.965 . . . . 0.0 117.345 -165.171 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 35.5 t -46.27 108.75 0.15 Allowed 'General case' 0 C--N 1.345 0.409 0 C-N-CA 126.557 1.943 . . . . 0.0 111.592 -171.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 5.6 p -73.13 -6.29 7.88 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 -167.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.87 119.04 17.54 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.587 -0.696 . . . . 0.0 110.832 -175.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 46.5 mp0 50.4 25.79 2.04 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.413 1.885 . . . . 0.0 113.763 -175.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 . . . . . 0 CA--C 1.535 0.379 0 N-CA-C 116.318 1.97 . . . . 0.0 116.318 -164.544 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.305 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.17 -32.92 74.86 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.072 0.851 . . . . 0.0 111.482 -171.527 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.82 -44.15 90.8 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.652 1.115 . . . . 0.0 112.569 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -64.58 -61.21 2.35 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.704 -0.622 . . . . 0.0 111.312 172.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -52.67 63.99 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.757 1.623 . . . . 0.0 110.272 -171.307 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.63 -32.49 71.01 Favored Glycine 0 CA--C 1.529 0.942 0 CA-C-O 118.672 -1.071 . . . . 0.0 113.411 -170.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -33.87 66.18 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.412 1.606 . . . . 0.0 111.19 175.062 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.13 -31.25 71.57 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 118.648 0.658 . . . . 0.0 111.754 176.184 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.7 mp -84.48 -30.31 25.31 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 118.567 -0.73 . . . . 0.0 111.496 174.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.12 60.65 1.05 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.374 1.47 . . . . 0.0 113.961 171.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -153.26 155.14 31.59 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 124.663 1.185 . . . . 0.0 109.042 174.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -59.76 -95.24 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.76 1 C-N-CA 126.156 4.571 . . . . 0.0 113.733 -166.528 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.6 p -44.92 -30.09 0.94 Allowed 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 127.386 2.274 . . . . 0.0 113.436 169.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.3 ttm105 -73.74 -43.16 59.89 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.076 0.853 . . . . 0.0 112.407 -175.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 8.2 t -54.21 -51.96 62.77 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.547 0.739 . . . . 0.0 109.346 166.474 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -52.17 -50.78 61.15 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.35 1.06 . . . . 0.0 113.2 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.7 mm -50.76 -48.12 28.19 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 124.049 0.94 . . . . 0.0 111.736 174.358 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 77.4 mt -65.22 -48.23 74.06 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 118.726 0.694 . . . . 0.0 112.278 -176.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.1 p -69.42 -27.42 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 123.483 0.713 . . . . 0.0 112.301 179.018 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.21 -38.46 66.08 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.75 0.82 . . . . 0.0 111.697 169.408 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.527 ' O ' HG13 ' A' ' 34' ' ' VAL . 3.3 tp -64.61 -28.75 69.84 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 120.308 1.413 . . . . 0.0 114.569 -175.746 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 mt -42.32 -30.02 0.29 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.88 1.672 . . . . 0.0 112.614 169.313 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -110.74 -32.43 6.86 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 126.987 2.115 . . . . 0.0 111.446 167.11 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.22 8.06 34.01 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 128.711 3.053 . . . . 0.0 116.034 -166.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.574 HG12 ' HA ' ' A' ' 76' ' ' ALA . 23.5 m -58.87 26.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.029 0 C-N-CA 127.215 2.206 . . . . 0.0 116.583 168.252 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 73.6 m -82.44 -81.86 0.15 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.425 1.09 . . . . 0.0 111.464 172.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.23 156.54 78.01 Favored Pre-proline 0 N--CA 1.47 0.568 0 CA-C-O 118.11 -0.948 . . . . 0.0 111.461 -172.112 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -56.92 -36.31 99.01 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.035 2.49 . . . . 0.0 113.448 -174.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -85.3 1.52 88.52 Favored Glycine 0 CA--C 1.533 1.217 0 CA-C-O 118.554 -1.137 . . . . 0.0 115.327 177.238 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.29 -30.4 66.22 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.807 1.804 . . . . 0.0 113.28 -170.223 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mt -60.3 -16.9 38.66 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.091 0.557 . . . . 0.0 111.81 -179.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.32 -36.87 76.42 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.812 0.845 . . . . 0.0 111.702 175.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -51.73 16.57 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.01 0.924 . . . . 0.0 111.313 175.043 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -55.94 -33.35 64.66 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 21.7 mt -105.37 -15.68 14.96 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -174.439 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.75 11.19 68.86 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-N 119.657 1.117 . . . . 0.0 114.035 -170.606 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.9 mp -95.11 155.63 16.65 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 117.996 0.898 . . . . 0.0 112.492 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.7 p -64.84 151.81 44.51 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.245 0.618 . . . . 0.0 110.308 170.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -40.84 81.58 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.941 -0.475 . . . . 0.0 111.148 176.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.1 m -63.38 -38.5 91.41 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.353 0.661 . . . . 0.0 112.219 176.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 44.4 t-20 -70.99 -49.26 47.23 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.807 -0.558 . . . . 0.0 111.199 176.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 1.3 t -55.98 -35.88 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 120.338 -1.476 . . . . 0.0 112.765 172.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 72.0 m -66.69 -32.78 74.31 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -57.64 -38.63 75.35 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.759 0.708 . . . . 0.0 111.616 171.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 23.3 m80 -69.72 -39.5 76.8 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.396 -0.815 . . . . 0.0 112.577 175.486 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.8 mt -75.28 -12.92 60.38 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.771 0.828 . . . . 0.0 113.137 177.264 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.6 t -60.4 -55.36 34.52 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.404 1.002 . . . . 0.0 110.675 168.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.8 t -67.69 -39.67 84.43 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.326 -0.859 . . . . 0.0 111.739 177.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.4 tp -62.02 -37.69 85.86 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -175.326 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.422 ' HG2' HG23 ' A' ' 64' ' ' VAL . 45.0 mtm105 -82.46 -7.3 59.64 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.865 0.866 . . . . 0.0 111.9 177.091 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -102.13 -45.24 1.76 Allowed Glycine 0 CA--C 1.535 1.283 0 C-N-CA 126.036 1.779 . . . . 0.0 114.685 178.217 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 7.2 m -67.36 4.41 1.0 Allowed 'General case' 0 CA--C 1.563 1.447 0 C-N-CA 126.008 1.723 . . . . 0.0 112.229 168.102 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.97 21.21 78.24 Favored Glycine 0 C--N 1.343 0.955 0 C-N-CA 126.018 1.771 . . . . 0.0 114.36 170.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.1 mt -85.13 -22.92 28.65 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.121 1.368 . . . . 0.0 113.61 -174.508 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.422 HG23 ' HG2' ' A' ' 59' ' ' ARG . 2.4 m -137.28 147.4 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 C-N-CA 125.795 1.638 . . . . 0.0 111.286 -178.52 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 88.5 t -130.37 144.63 37.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.82 1.648 . . . . 0.0 109.849 -179.024 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.59 134.36 34.81 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.91 0.884 . . . . 0.0 111.769 172.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.9 166.6 24.34 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.483 0.713 . . . . 0.0 109.596 171.801 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -80.39 127.48 32.45 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 165.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.265 0.0 OUTLIER -78.73 -16.22 57.5 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 120.038 1.29 . . . . 0.0 114.313 171.706 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 130.65 -21.74 4.71 Favored Glycine 0 N--CA 1.477 1.4 0 C-N-CA 125.602 1.572 . . . . 0.0 113.987 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.1 -19.78 1.49 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.558 2.743 . . . . 0.0 112.62 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 -148.28 173.14 13.32 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 129.564 3.146 . . . . 0.0 111.071 -177.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 14.1 p -88.97 145.13 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 167.336 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 -126.98 165.83 18.68 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.978 1.711 . . . . 0.0 111.224 -179.469 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 17.2 m-30 -112.49 120.75 42.71 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 164.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.574 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -121.44 154.36 36.66 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.932 1.293 . . . . 0.0 109.819 -178.299 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 81.6 mt -57.58 151.01 17.85 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.994 0.815 . . . . 0.0 110.226 169.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.51 -37.21 75.12 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 -168.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -162.18 167.8 23.52 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 126.288 1.835 . . . . 0.0 109.064 175.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 51.1 m -44.76 -32.16 1.44 Allowed 'General case' 0 C--O 1.214 -0.775 0 CA-C-O 117.604 -1.189 . . . . 0.0 110.998 167.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -37.58 -65.03 0.34 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.702 1.601 . . . . 0.0 114.026 169.017 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 15.3 mt -73.46 -41.0 63.72 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.749 1.613 . . . . 0.0 110.826 -176.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.67 -26.55 65.64 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 177.197 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -79.22 -59.79 2.63 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 126.793 2.037 . . . . 0.0 109.469 178.198 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.88 -37.72 85.6 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.83 -42.9 85.04 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.74 -0.6 . . . . 0.0 109.483 169.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.51 -34.17 73.3 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 126.296 1.903 . . . . 0.0 117.043 -174.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.77 -11.97 59.91 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 121.533 2.666 . . . . 0.0 112.261 167.669 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 41.2 tp 64.08 113.33 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 127.85 2.46 . . . . 0.0 109.225 -174.002 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 19.3 m -66.61 26.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 126.281 1.832 . . . . 0.0 114.907 -175.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.438 ' C ' ' H ' ' A' ' 93' ' ' VAL . 39.2 mm-40 79.98 -2.96 2.01 Favored 'General case' 0 N--CA 1.442 -0.856 0 O-C-N 119.911 -1.743 . . . . 0.0 111.271 157.371 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 13.5 p -60.63 31.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 131.153 3.781 . . . . 0.0 113.871 166.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.438 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.3 t 56.87 18.96 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 127.987 2.515 . . . . 0.0 113.99 169.572 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 tt 99.59 105.74 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 129.891 3.276 . . . . 0.0 107.099 -169.285 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.29 61.5 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.992 2.117 . . . . 0.0 116.078 -176.313 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.5 t -64.35 152.51 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 125.165 1.386 . . . . 0.0 108.427 167.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.93 -72.45 0.38 Allowed 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.796 1.638 . . . . 0.0 113.186 178.21 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.1 p 70.91 144.36 0.06 Allowed 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 129.596 3.158 . . . . 0.0 115.13 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -90.93 131.94 36.25 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 163.058 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -168.32 138.43 2.06 Favored Pre-proline 0 CA--C 1.541 0.597 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.46 -179.43 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -69.55 166.27 27.89 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 122.676 2.251 . . . . 0.0 111.626 174.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 5.7 t -104.44 -157.1 0.59 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 126.582 1.953 . . . . 0.0 111.151 -176.653 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 4.0 t 41.79 53.47 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 C-N-CA 126.136 1.774 . . . . 0.0 114.128 168.079 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . 76.13 -13.43 0.9 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 126.502 1.921 . . . . 0.0 115.511 177.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 74.8 mt-10 -69.12 162.64 26.55 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 122.829 1.3 . . . . 0.0 112.117 174.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 . . . . . 0 N--CA 1.464 0.272 0 C-N-CA 125.998 1.719 . . . . 0.0 110.214 176.577 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.468 0 N-CA-C 110.753 -0.091 . . . . 0.0 110.753 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.02 -26.92 67.02 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.629 1.172 . . . . 0.0 112.645 -172.375 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.75 -56.18 17.51 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.999 1.272 . . . . 0.0 111.752 171.051 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -59.03 -58.95 6.41 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.802 0.841 . . . . 0.0 111.828 175.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.72 -52.52 56.66 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 125.869 1.668 . . . . 0.0 109.945 -172.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.59 -39.25 96.62 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-O 118.358 -1.246 . . . . 0.0 112.247 -175.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -37.59 79.77 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.123 1.461 . . . . 0.0 110.923 174.131 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.86 -16.43 60.68 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 178.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 10.3 mp -90.62 -32.73 16.13 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 118.962 0.801 . . . . 0.0 110.031 168.266 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -74.85 56.0 0.71 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.392 1.877 . . . . 0.0 113.633 169.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -146.63 135.15 10.94 Favored Pre-proline 0 CA--C 1.544 0.714 0 C-N-CA 125.419 1.488 . . . . 0.0 107.167 178.475 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -46.89 -70.01 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.803 1 C-N-CA 125.628 4.218 . . . . 0.0 113.525 -166.219 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 12.1 p -70.18 -16.49 63.08 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 117.849 -1.072 . . . . 0.0 112.59 -178.264 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.535 ' HG3' HD13 ' B' ' 58' ' ' LEU . 0.0 OUTLIER -72.16 -46.3 56.96 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 116.551 -1.69 . . . . 0.0 112.252 -176.486 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 38.0 t -45.99 -52.34 11.93 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.454 1.025 . . . . 0.0 110.404 169.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -61.01 -50.37 73.64 Favored 'General case' 0 C--O 1.225 -0.221 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 179.379 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 26' ' ' ILE . . . . . 0.437 HG13 HH22 ' B' ' 23' ' ' ARG . 5.2 mm -51.37 -56.99 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.841 1.2 . . . . 0.0 110.526 171.782 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 59.7 mt -62.17 -42.76 99.57 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 118.699 -0.667 . . . . 0.0 111.906 -169.673 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 6.3 p -73.23 -32.64 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 123.614 0.765 . . . . 0.0 112.69 177.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 29' ' ' ALA . . . . . 0.434 ' HB1' ' CD2' ' B' ' 43' ' ' HIS . . . -75.33 -31.6 60.65 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.409 0.55 . . . . 0.0 111.891 176.149 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.403 ' O ' HG13 ' B' ' 34' ' ' VAL . 7.8 tp -62.0 -40.83 96.99 Favored 'General case' 0 C--N 1.341 0.235 0 O-C-N 121.093 -1.004 . . . . 0.0 112.536 -178.344 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.76 -31.0 1.81 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 130.023 3.329 . . . . 0.0 114.383 172.297 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -100.99 -14.06 18.01 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 127.032 2.133 . . . . 0.0 112.626 -178.54 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -114.68 -71.91 0.53 Allowed Glycine 0 C--N 1.344 1.006 0 C-N-CA 124.87 1.224 . . . . 0.0 115.642 -169.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 34' ' ' VAL . . . . . 0.51 HG12 ' HA ' ' B' ' 76' ' ' ALA . 35.0 m 32.6 34.48 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 N-CA-C 117.314 2.339 . . . . 0.0 117.314 -169.004 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 68.6 m -82.9 -84.08 0.13 Allowed 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 125.975 1.71 . . . . 0.0 112.326 176.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 36' ' ' TYR . . . . . 0.405 ' H ' ' HB3' ' B' ' 39' ' ' GLN . 0.1 OUTLIER -130.72 163.31 49.53 Favored Pre-proline 0 CA--C 1.543 0.701 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -172.459 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -57.81 -42.2 61.65 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.336 2.024 . . . . 0.0 111.943 178.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -72.11 -1.83 50.69 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 117.955 -1.47 . . . . 0.0 114.645 174.197 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 39' ' ' GLN . . . . . 0.405 ' HB3' ' H ' ' B' ' 36' ' ' TYR . 5.8 pt20 -64.17 -51.5 63.52 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.533 1.666 . . . . 0.0 111.322 -177.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 5.3 mt -66.48 -28.57 68.68 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 118.77 0.714 . . . . 0.0 109.248 -174.417 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -75.06 23.96 0.1 Allowed 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 172.598 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -143.43 -45.39 0.28 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.385 2.674 . . . . 0.0 108.111 168.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 43' ' ' HIS . . . . . 0.434 ' CD2' ' HB1' ' B' ' 29' ' ' ALA . 0.3 OUTLIER -53.13 -29.55 31.71 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 126.323 1.849 . . . . 0.0 113.819 170.756 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.7 mt -101.61 -18.59 15.82 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 126.045 1.738 . . . . 0.0 113.323 175.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.27 -2.47 52.0 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 124.285 0.945 . . . . 0.0 114.667 -170.444 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mp -92.84 144.84 24.88 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.052 1.426 . . . . 0.0 110.383 -178.229 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 21.2 p -58.86 156.35 11.52 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.065 0.946 . . . . 0.0 113.544 -169.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -37.39 79.14 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 121.465 -0.772 . . . . 0.0 111.314 178.16 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 26.6 m -63.3 -47.08 83.8 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.754 0.822 . . . . 0.0 111.933 170.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -62.78 -50.43 71.05 Favored 'General case' 0 CA--C 1.546 0.795 0 O-C-N 121.038 -1.039 . . . . 0.0 112.375 178.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 3.9 t -67.8 -19.57 25.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 O-C-N 121.007 -1.058 . . . . 0.0 111.739 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 61.2 m -72.2 -46.61 55.52 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.496 1.498 . . . . 0.0 113.674 171.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -49.74 -46.91 50.89 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 123.644 1.687 . . . . 0.0 111.208 173.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -59.46 -55.08 39.21 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 113.134 -1.848 . . . . 0.0 113.783 170.441 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 52.5 mt -67.59 -14.99 63.41 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 120.003 -1.686 . . . . 0.0 112.78 -178.14 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.2 t -50.69 -50.96 53.68 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 119.452 1.024 . . . . 0.0 111.065 168.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.95 -21.19 31.88 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.821 1.191 . . . . 0.0 112.875 -171.414 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.535 HD13 ' HG3' ' B' ' 23' ' ' ARG . 4.7 tp -73.02 -47.17 47.35 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 121.659 -0.651 . . . . 0.0 111.69 176.632 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 43.3 mtm180 -72.35 -26.4 61.9 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.786 0.834 . . . . 0.0 110.94 174.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.3 -46.32 12.83 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-O 119.292 -0.727 . . . . 0.0 113.745 176.215 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 54.1 m -75.8 -15.93 60.18 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 119.161 1.481 . . . . 0.0 113.772 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 107.65 9.36 28.91 Favored Glycine 0 C--N 1.344 0.992 0 C-N-CA 125.259 1.409 . . . . 0.0 115.622 169.125 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 3.1 mt -85.12 -17.26 37.82 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 120.006 1.903 . . . . 0.0 114.55 -169.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.73 143.09 42.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 126.455 1.902 . . . . 0.0 110.455 177.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 98.1 t -131.1 141.2 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.304 1.041 . . . . 0.0 110.024 -176.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.49 136.87 33.24 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.496 1.119 . . . . 0.0 112.144 173.58 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -142.15 166.22 25.31 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.113 0.965 . . . . 0.0 109.506 172.235 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -77.36 127.38 32.47 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 165.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.254 0.0 OUTLIER -75.15 -21.13 59.01 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 172.757 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 135.21 -19.44 3.86 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.781 1.658 . . . . 0.0 114.02 -177.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 5.1 tmt_? -142.63 -25.48 0.63 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 129.503 3.121 . . . . 0.0 111.608 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -138.66 179.39 6.51 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 127.557 2.343 . . . . 0.0 110.8 -177.252 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 14.8 p -91.1 145.16 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.943 0.897 . . . . 0.0 108.865 166.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 20.2 ptt180 -128.92 164.29 23.44 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 126.295 1.838 . . . . 0.0 110.093 176.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -108.0 149.21 28.68 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 106.005 -1.85 . . . . 0.0 106.005 162.475 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.51 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -146.56 158.3 43.88 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 125.227 1.411 . . . . 0.0 108.571 176.786 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 62.3 mt -59.28 152.91 19.83 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.385 0.993 . . . . 0.0 109.32 167.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.79 -34.99 76.88 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -168.455 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -159.62 167.56 28.18 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 123.121 1.439 . . . . 0.0 110.292 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 14.7 m -50.28 -30.62 12.25 Favored 'General case' 0 C--O 1.22 -0.473 0 C-N-CA 125.601 1.56 . . . . 0.0 110.337 167.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -46.73 -65.52 0.55 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.118 1.367 . . . . 0.0 113.789 171.606 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 11.9 mt -67.68 -41.09 84.25 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 121.075 1.761 . . . . 0.0 111.036 -177.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.02 -24.09 65.9 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 177.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -80.03 -64.52 1.17 Allowed 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 124.982 1.313 . . . . 0.0 110.707 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.54 -34.9 77.84 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.112 1.152 . . . . 0.0 114.112 -178.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tt -65.32 -41.57 93.84 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 121.4 -0.813 . . . . 0.0 109.459 169.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.86 -40.14 95.37 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 126.709 2.099 . . . . 0.0 115.835 -175.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.06 -15.23 62.53 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 120.88 2.34 . . . . 0.0 112.9 169.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 43.2 tp 67.78 111.41 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 127.603 2.361 . . . . 0.0 109.834 -169.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 20.1 m -61.41 28.21 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 128.207 2.603 . . . . 0.0 115.232 174.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 81.87 -15.17 0.73 Allowed 'General case' 0 CA--C 1.535 0.394 0 O-C-N 119.768 -1.832 . . . . 0.0 113.077 156.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.3 p -56.14 31.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.098 1 C-N-CA 132.854 4.461 . . . . 0.0 115.649 168.172 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 2.0 t 56.71 26.27 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 128.15 2.58 . . . . 0.0 113.415 167.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 tt 80.42 106.47 0.07 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 127.51 2.324 . . . . 0.0 105.109 -167.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.79 75.84 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.156 1.783 . . . . 0.0 115.695 -169.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.3 146.05 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 126.273 1.829 . . . . 0.0 112.855 -179.139 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.32 -20.19 60.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 127.46 2.304 . . . . 0.0 113.919 179.415 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 22.5 p -49.29 124.65 9.48 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.884 1.674 . . . . 0.0 113.743 -169.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -67.44 152.98 44.74 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 165.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -167.9 143.27 3.14 Favored Pre-proline 0 N--CA 1.448 -0.558 0 CA-C-O 116.806 -1.569 . . . . 0.0 107.778 172.158 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -60.79 158.87 31.11 Favored 'Trans proline' 0 CA--C 1.536 0.599 0 C-N-CA 122.809 2.34 . . . . 0.0 112.521 177.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 15.4 t -85.28 -145.41 0.1 Allowed 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 122.537 1.16 . . . . 0.0 112.87 -176.235 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 25.2 t 12.22 68.92 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 C-N-CA 130.825 3.65 . . . . 0.0 114.199 174.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . 77.02 -9.09 1.58 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.834 2.054 . . . . 0.0 115.613 171.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -73.29 164.14 27.09 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.633 1.173 . . . . 0.0 112.263 174.62 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.6 mtp180 . . . . . 0 N--CA 1.469 0.477 0 C-N-CA 127.964 2.506 . . . . 0.0 109.764 172.906 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.555 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -52.68 -53.42 47.63 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.801 1.182 . . . . 0.0 113.019 -170.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.449 ' HA ' ' HB1' ' B' ' 19' ' ' ALA . . . -64.58 -14.9 59.9 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 175.558 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.593 HH22 ' CA ' ' B' ' 102' ' ' CYS . 34.3 ttt180 -93.03 -43.57 8.84 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.376 1.07 . . . . 0.0 111.991 172.601 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.684 ' CD1' HG21 ' B' ' 92' ' ' VAL . 3.4 tm? -62.89 -37.63 87.71 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.635 1.574 . . . . 0.0 112.417 -177.125 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.18 -23.23 52.14 Favored Glycine 0 CA--C 1.536 1.389 0 CA-C-N 120.034 1.288 . . . . 0.0 112.741 170.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.9 ttp85 -100.24 -0.43 38.62 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.903 1.446 . . . . 0.0 114.903 171.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -86.64 -35.66 19.24 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.918 1.235 . . . . 0.0 109.248 167.165 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.6 mp -70.65 -38.01 73.78 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 167.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -92.54 35.45 1.02 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 171.184 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.73 149.17 74.0 Favored Pre-proline 0 CA--C 1.542 0.664 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 165.513 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -41.79 -89.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.351 0.659 1 C-N-CA 126.495 4.797 . . . . 0.0 113.793 -167.257 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.52 -31.14 72.04 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 124.997 1.319 . . . . 0.0 111.066 175.416 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 54.5 mtm-85 -58.69 -33.76 70.52 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 119.547 1.067 . . . . 0.0 113.746 -177.39 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 49.3 t -58.64 -54.29 48.73 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.295 0.952 . . . . 0.0 110.694 172.446 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -72.01 -34.26 68.72 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.356 -0.84 . . . . 0.0 112.295 -179.436 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.5 mm -52.14 -46.39 43.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 124.61 1.164 . . . . 0.0 109.222 167.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 41.7 mt -64.71 -46.06 83.92 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 117.298 -1.334 . . . . 0.0 111.969 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.4 m -64.29 -35.23 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 CA-C-N 121.391 1.905 . . . . 0.0 112.235 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.37 -1.74 46.63 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.978 1.311 . . . . 0.0 113.483 177.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.54 -52.72 7.28 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 124.87 1.268 . . . . 0.0 108.533 169.201 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -44.47 -60.31 2.02 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.823 2.849 . . . . 0.0 114.015 -171.843 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -101.16 18.09 20.77 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 126.324 1.849 . . . . 0.0 111.279 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.574 ' HA3' HE22 ' A' ' 39' ' ' GLN . . . -109.44 -80.01 1.15 Allowed Glycine 0 C--N 1.337 0.635 0 C-N-CA 127.718 2.58 . . . . 0.0 111.164 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.4 m 36.93 28.72 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 116.405 2.002 . . . . 0.0 116.405 -177.228 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 31.5 m -83.57 -72.12 0.47 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 120.506 1.503 . . . . 0.0 113.588 -173.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.43 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -137.36 160.8 64.1 Favored Pre-proline 0 N--CA 1.471 0.621 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -178.234 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -60.94 113.22 1.63 Allowed 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.234 1.956 . . . . 0.0 108.76 171.42 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.35 -2.33 60.97 Favored Glycine 0 CA--C 1.538 1.508 0 CA-C-O 118.099 -1.389 . . . . 0.0 116.042 -173.498 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.574 HE22 ' HA3' ' A' ' 33' ' ' GLY . 2.5 pp0? -58.13 -20.1 37.76 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 120.579 2.189 . . . . 0.0 114.597 176.641 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.5 HD12 ' H ' ' A' ' 40' ' ' LEU . 1.8 mp -71.87 -9.16 57.93 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-O 118.758 -0.639 . . . . 0.0 112.327 176.218 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.96 -44.09 94.63 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.668 0.667 . . . . 0.0 111.688 177.571 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.7 -50.91 63.16 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 123.458 0.703 . . . . 0.0 110.684 172.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 -59.1 -27.62 65.74 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -177.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.9 mt -113.39 -22.39 10.41 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -173.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.44 -3.19 33.99 Favored Glycine 0 CA--C 1.535 1.301 0 CA-C-N 119.545 1.066 . . . . 0.0 114.337 -169.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -84.31 139.21 32.46 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.44 1.12 . . . . 0.0 109.803 175.16 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.403 HG23 ' H ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER -55.16 147.82 15.51 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.545 -0.722 . . . . 0.0 111.053 -179.373 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -48.78 -27.75 3.19 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.483 1.113 . . . . 0.0 113.057 169.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.2 m -69.03 -46.35 68.18 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.1 0.96 . . . . 0.0 111.62 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.403 ' H ' HG23 ' A' ' 47' ' ' THR . 29.1 t-20 -74.41 -39.35 62.69 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.119 0.872 . . . . 0.0 111.978 177.049 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.2 t -55.87 -48.43 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 118.621 -0.704 . . . . 0.0 110.57 169.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 39.2 m -64.88 -40.01 94.44 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 120.087 1.312 . . . . 0.0 113.073 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -56.08 -51.79 66.62 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.476 1.11 . . . . 0.0 111.675 176.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 -70.74 -28.51 64.76 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 120.595 -1.316 . . . . 0.0 113.506 177.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.9 mt -70.26 -30.07 67.01 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 117.933 -1.032 . . . . 0.0 112.751 172.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.1 p -49.52 -44.26 46.19 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.346 1.43 . . . . 0.0 113.259 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.5 t -70.51 -42.09 71.74 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.615 1.966 . . . . 0.0 112.873 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.1 tp -63.4 -29.54 70.82 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.927 1.691 . . . . 0.0 112.03 -177.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 56.1 mtm180 -83.67 -12.38 55.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.474 1.509 . . . . 0.0 113.651 172.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -97.17 -48.38 2.06 Favored Glycine 0 N--CA 1.474 1.21 0 C-N-CA 124.446 1.022 . . . . 0.0 111.13 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 69.1 m -68.49 10.62 0.23 Allowed 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 127.836 2.454 . . . . 0.0 114.142 170.146 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 63.48 14.5 54.62 Favored Glycine 0 N--CA 1.474 1.171 0 C-N-CA 126.581 2.038 . . . . 0.0 116.583 174.037 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 86.1 mt -75.7 -28.72 58.73 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 120.619 -1.518 . . . . 0.0 113.427 -179.147 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -134.05 135.12 55.14 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 125.757 1.623 . . . . 0.0 112.834 176.555 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 87.0 t -124.89 138.88 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 125.817 1.647 . . . . 0.0 109.235 -175.557 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.19 152.22 36.68 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 122.624 1.202 . . . . 0.0 112.9 178.118 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.2 m -160.4 163.21 33.3 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.769 1.627 . . . . 0.0 108.103 -170.254 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -85.87 148.32 25.85 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 119.125 0.875 . . . . 0.0 111.248 167.295 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.93 -14.39 41.98 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 121.35 -0.844 . . . . 0.0 111.745 167.62 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 138.21 -14.92 3.49 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 126.976 2.227 . . . . 0.0 113.628 -176.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 65.3 ttt-85 -157.49 -43.91 0.07 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.038 2.135 . . . . 0.0 111.861 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -101.33 179.33 4.39 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.408 1.883 . . . . 0.0 110.459 169.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 25.9 m -105.6 160.11 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 123.793 0.837 . . . . 0.0 112.484 171.148 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.8 ptt85 -142.88 170.28 15.98 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 129.397 3.079 . . . . 0.0 109.788 -172.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -110.9 120.36 42.14 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.358 1.063 . . . . 0.0 108.703 167.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -108.71 146.15 33.95 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.491 1.516 . . . . 0.0 111.159 174.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 tp -56.83 135.28 55.65 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 118.238 -0.886 . . . . 0.0 108.837 170.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.47 -42.34 70.56 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -170.565 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -154.35 159.28 41.09 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.849 1.66 . . . . 0.0 112.796 176.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.56 -36.98 0.12 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 130.797 3.639 . . . . 0.0 113.468 165.522 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -56.37 -48.3 77.12 Favored 'General case' 0 C--N 1.342 0.252 0 C-N-CA 126.178 1.791 . . . . 0.0 113.336 174.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 11.0 mt -69.59 -41.63 75.52 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 175.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.57 -37.99 76.94 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.974 1.309 . . . . 0.0 111.027 -175.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 -68.04 -55.42 12.65 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-O 117.538 -1.22 . . . . 0.0 112.177 173.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.41 -40.2 95.75 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 121.895 2.134 . . . . 0.0 112.753 -177.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.0 tp -61.54 -43.99 97.86 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.65 1.98 . . . . 0.0 112.664 170.549 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -78.55 -32.56 41.57 Favored Glycine 0 N--CA 1.478 1.442 0 C-N-CA 126.882 2.182 . . . . 0.0 114.301 -176.027 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -66.99 -6.12 15.61 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.538 1.135 . . . . 0.0 110.084 166.225 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 32.1 tp 78.56 -34.65 0.17 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 130.661 3.584 . . . . 0.0 112.794 167.177 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 153.37 -21.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.021 1 C-N-CA 134.012 4.925 . . . . 0.0 111.423 173.19 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 46.2 mm-40 71.24 -23.99 0.18 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.866 2.066 . . . . 0.0 114.428 -178.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.8 p -71.51 42.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 126.59 1.956 . . . . 0.0 115.135 -172.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER 63.28 17.73 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 C-N-CA 126.996 2.119 . . . . 0.0 112.504 177.183 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 62.4 mt 84.6 107.51 0.05 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 129.976 3.31 . . . . 0.0 109.693 -171.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.75 76.1 0.85 Allowed 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.089 -1.007 . . . . 0.0 110.002 169.413 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.0 t -44.74 149.09 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 127.487 2.315 . . . . 0.0 114.652 -169.216 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.62 25.75 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 128.532 2.733 . . . . 0.0 114.937 171.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 44.0 p -104.53 170.61 7.79 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.655 -1.278 . . . . 0.0 112.723 175.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -99.94 2.95 44.1 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 128.83 2.852 . . . . 0.0 113.842 -176.442 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -53.43 141.7 42.36 Favored Pre-proline 0 CA--C 1.556 1.192 0 N-CA-C 116.151 1.908 . . . . 0.0 116.151 -167.113 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -72.97 -168.97 0.45 Allowed 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 125.236 3.957 . . . . 0.0 111.489 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 49.6 t -56.21 148.83 17.39 Favored 'General case' 0 CA--C 1.548 0.874 0 O-C-N 120.429 -1.42 . . . . 0.0 111.881 175.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 93.5 t -73.5 -18.48 17.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.877 -169.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -81.41 24.04 0.58 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.682 1.593 . . . . 0.0 114.222 173.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -128.68 161.96 28.46 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.245 1.818 . . . . 0.0 110.719 -171.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.785 0 C-N-CA 126.004 1.722 . . . . 0.0 112.858 177.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.887 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -35.84 -73.0 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 127.61 2.364 . . . . 0.0 114.139 -176.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.68 -5.7 39.4 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.933 1.457 . . . . 0.0 114.933 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -86.08 -46.64 10.28 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 118.658 -0.687 . . . . 0.0 110.464 168.024 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.96 -41.37 99.51 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.368 0.985 . . . . 0.0 112.104 -168.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.8 -6.3 11.63 Favored Glycine 0 CA--C 1.542 1.774 0 CA-C-O 119.004 -0.887 . . . . 0.0 114.432 173.273 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 49.6 ttp85 -115.4 -3.68 12.41 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 127.187 2.195 . . . . 0.0 113.851 172.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -92.65 -27.96 16.97 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.478 1.511 . . . . 0.0 110.906 167.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 3.8 mp -79.18 -44.58 21.61 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 168.246 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.449 ' HB1' ' HA ' ' A' ' 12' ' ' ALA . . . -87.69 32.57 0.72 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 125.299 1.44 . . . . 0.0 114.619 171.807 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -64.17 151.94 89.25 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 126.924 2.09 . . . . 0.0 111.977 172.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -44.67 -36.27 10.17 Favored 'Trans proline' 0 C--N 1.357 0.987 1 C-N-CA 125.579 4.186 . . . . 0.0 114.718 177.7 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.45 ' HB ' HH21 ' B' ' 23' ' ' ARG . 5.6 m -130.18 -34.89 1.62 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.824 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.618 ' HG2' HD13 ' B' ' 58' ' ' LEU . 0.0 OUTLIER -60.28 -26.94 66.89 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 117.211 -1.376 . . . . 0.0 112.091 -179.742 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 42.3 t -55.13 -65.43 0.59 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 120.14 1.336 . . . . 0.0 112.193 168.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 17.4 ttm180 -68.65 -33.2 73.6 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.152 -0.968 . . . . 0.0 111.713 -177.286 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.1 mm -48.92 -55.03 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 O-C-N 121.049 -1.032 . . . . 0.0 109.053 168.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.416 HD22 HD11 ' B' ' 77' ' ' LEU . 56.6 mt -62.82 -36.44 83.17 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 116.798 -1.572 . . . . 0.0 112.613 -174.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 3.6 m -64.27 -38.48 82.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 CA-C-N 120.849 1.659 . . . . 0.0 111.045 175.131 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.35 -7.1 59.14 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.307 1.043 . . . . 0.0 113.547 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.15 -55.3 6.25 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 170.48 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -44.05 -61.29 1.51 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 128.433 2.693 . . . . 0.0 112.558 177.586 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -86.97 5.19 38.47 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.051 1.34 . . . . 0.0 112.086 -176.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.53 -73.16 0.53 Allowed Glycine 0 C--N 1.341 0.833 0 C-N-CA 126.465 1.983 . . . . 0.0 113.657 -173.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 25.4 m 37.65 29.52 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 116.183 1.92 . . . . 0.0 116.183 -174.48 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 25.7 m -82.91 -73.37 0.41 Allowed 'General case' 0 C--N 1.342 0.251 0 CA-C-N 120.358 1.435 . . . . 0.0 114.218 -173.243 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 36' ' ' TYR . . . . . 0.469 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 1.0 OUTLIER -148.36 164.68 20.79 Favored Pre-proline 0 N--CA 1.47 0.526 0 N-CA-C 114.012 1.115 . . . . 0.0 114.012 -175.486 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -55.1 119.65 6.87 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.136 1.891 . . . . 0.0 108.768 169.117 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.43 -4.05 83.97 Favored Glycine 0 CA--C 1.535 1.339 0 CA-C-O 117.249 -1.861 . . . . 0.0 115.897 -174.545 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 39' ' ' GLN . . . . . 0.469 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 2.4 pp0? -57.22 -27.17 61.78 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 121.203 2.501 . . . . 0.0 112.948 176.761 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 3.4 mt -67.96 -22.7 65.02 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 124.509 1.124 . . . . 0.0 111.593 178.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.16 -43.49 98.79 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 118.549 0.613 . . . . 0.0 111.156 -173.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.94 -50.86 64.76 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.664 0.786 . . . . 0.0 111.571 173.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -54.75 -35.77 64.09 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 178.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 17.3 mt -103.21 -21.64 13.84 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -172.42 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.41 -1.69 33.96 Favored Glycine 0 CA--C 1.537 1.467 0 CA-C-N 119.177 0.899 . . . . 0.0 113.418 -168.587 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -90.08 121.85 32.52 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 125.386 1.474 . . . . 0.0 108.531 176.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.8 t -47.7 139.08 7.63 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.29 1.036 . . . . 0.0 112.548 -175.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.12 -28.35 4.19 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.816 1.647 . . . . 0.0 113.577 174.749 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 50.3 m -62.32 -58.28 8.26 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.002 0.921 . . . . 0.0 111.358 170.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -76.12 -34.91 59.47 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.427 1.012 . . . . 0.0 113.483 -178.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 1.5 t -50.2 -47.83 24.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.906 1.23 . . . . 0.0 109.648 169.545 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 5.2 m -83.22 -27.9 29.64 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -177.091 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -45.88 -34.8 4.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.27 1.428 . . . . 0.0 112.429 173.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -113.26 2.12 15.44 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 127.373 2.269 . . . . 0.0 114.311 -178.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 46.7 mt -72.58 -24.64 61.12 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 119.615 -1.928 . . . . 0.0 109.116 166.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 18.3 p -43.11 -42.74 4.15 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.092 1.357 . . . . 0.0 111.75 167.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 12.5 t -75.36 -43.03 52.6 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.618 HD13 ' HG2' ' B' ' 23' ' ' ARG . 6.5 tp -62.85 -34.57 77.62 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.488 1.515 . . . . 0.0 110.967 -176.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.449 ' HG2' HG23 ' B' ' 64' ' ' VAL . 60.5 mtm180 -82.46 -7.56 59.64 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.164 1.385 . . . . 0.0 113.867 173.719 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -97.89 -49.37 1.78 Allowed Glycine 0 N--CA 1.474 1.174 0 CA-C-N 119.391 0.996 . . . . 0.0 111.778 175.464 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 99.5 m -72.02 13.46 0.3 Allowed 'General case' 0 CA--C 1.565 1.551 0 C-N-CA 126.741 2.016 . . . . 0.0 113.223 175.008 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.89 0.04 12.53 Favored Glycine 0 N--CA 1.471 1.025 0 C-N-CA 127.597 2.522 . . . . 0.0 116.59 176.248 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.556 HD12 HD12 ' B' ' 58' ' ' LEU . 41.6 mt -65.62 -30.29 70.98 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.654 1.727 . . . . 0.0 113.702 -171.037 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.449 HG23 ' HG2' ' B' ' 59' ' ' ARG . 0.7 OUTLIER -123.7 141.08 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 126.433 1.893 . . . . 0.0 111.771 170.842 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 74.3 t -123.7 138.15 54.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 125.538 1.535 . . . . 0.0 109.118 174.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.62 148.5 30.24 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.458 1.103 . . . . 0.0 113.013 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 8.7 m -160.48 162.87 33.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.144 1.378 . . . . 0.0 108.194 -168.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -81.75 147.28 29.52 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.842 1.201 . . . . 0.0 111.55 167.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.21 -14.62 43.38 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.169 0.895 . . . . 0.0 111.781 167.427 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 139.51 -18.01 3.06 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 126.851 2.167 . . . . 0.0 113.02 -177.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 58.5 ttt-85 -153.37 -46.09 0.09 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 127.326 2.251 . . . . 0.0 111.446 -176.344 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -97.61 -177.88 3.94 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.599 1.96 . . . . 0.0 109.975 170.075 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 33.8 m -109.09 158.74 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 123.869 0.868 . . . . 0.0 112.822 171.043 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 10.0 ptt85 -140.08 173.57 11.39 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 128.71 2.804 . . . . 0.0 110.12 -171.105 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -117.9 120.14 36.96 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.304 1.042 . . . . 0.0 108.476 167.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -103.96 151.43 23.19 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.901 1.28 . . . . 0.0 110.196 172.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.416 HD11 HD22 ' B' ' 27' ' ' LEU . 2.0 tp -60.43 143.81 52.48 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 168.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -42.66 -60.42 1.56 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.107 0.963 . . . . 0.0 112.612 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 79' ' ' ASP . . . . . 0.461 ' CG ' ' H ' ' B' ' 80' ' ' SER . 11.8 t70 -166.8 -174.83 2.87 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.42 1.488 . . . . 0.0 113.658 171.539 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.461 ' H ' ' CG ' ' B' ' 79' ' ' ASP . 4.2 m -35.65 -39.26 0.14 Allowed 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 130.196 3.398 . . . . 0.0 113.757 172.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -55.45 -52.41 63.71 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.344 1.057 . . . . 0.0 113.035 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 19.2 mt -75.1 -34.39 61.73 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.036 1.289 . . . . 0.0 110.08 175.321 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.31 -38.19 88.47 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.32 0.648 . . . . 0.0 110.729 -174.122 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -67.95 -55.04 14.21 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-O 117.425 -1.274 . . . . 0.0 111.816 169.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.99 -32.45 72.92 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 122.407 2.367 . . . . 0.0 113.977 -174.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.41 -43.37 50.28 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.245 1.418 . . . . 0.0 112.285 171.355 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -79.72 -26.35 56.56 Favored Glycine 0 CA--C 1.54 1.645 0 C-N-CA 124.809 1.195 . . . . 0.0 114.918 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -69.57 -10.6 58.83 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.704 1.202 . . . . 0.0 109.397 165.278 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 60.2 tp 80.87 -42.6 0.19 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 130.798 3.639 . . . . 0.0 110.574 171.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 90' ' ' VAL . . . . . 0.46 ' CG2' HG22 ' B' ' 92' ' ' VAL . 0.0 OUTLIER 160.54 -27.25 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.548 1 C-N-CA 133.057 4.543 . . . . 0.0 110.573 170.438 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 79.93 -12.2 1.08 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.323 2.249 . . . . 0.0 113.129 -178.022 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.684 HG21 ' CD1' ' A' ' 14' ' ' LEU . 27.2 m -80.34 70.02 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 CA-C-O 125.641 2.639 . . . . 0.0 114.749 -168.117 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.344 0.7 OUTLIER 34.38 27.47 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.432 -1.347 2 C-N-CA 133.825 4.85 . . . . 0.0 114.595 -167.312 . . . . . . . . 4 3 . 1 . 020 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 34.3 mt 74.61 71.32 0.1 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.497 2.319 . . . . 0.0 110.985 -168.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.4 99.3 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.063 -1.023 . . . . 0.0 111.731 169.47 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 2.8 t -65.68 159.67 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 126.037 1.735 . . . . 0.0 110.978 177.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.59 9.13 0.69 Allowed 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 128.247 2.619 . . . . 0.0 115.488 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 61.7 p -78.25 154.32 31.09 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 116.426 2.01 . . . . 0.0 116.426 -167.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -65.17 1.93 0.91 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 130.124 3.37 . . . . 0.0 116.356 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -68.68 141.79 93.19 Favored Pre-proline 0 CA--C 1.555 1.136 0 N-CA-C 115.091 1.515 . . . . 0.0 115.091 -167.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 101' ' ' PRO . . . . . 0.545 ' C ' HH12 ' A' ' 13' ' ' ARG . 66.2 Cg_endo -75.29 -171.23 0.95 Allowed 'Trans proline' 0 C--N 1.361 1.196 1 C-N-CA 125.634 4.223 . . . . 0.0 111.704 175.761 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 102' ' ' CYS . . . . . 0.593 ' CA ' HH22 ' A' ' 13' ' ' ARG . 0.1 OUTLIER -59.04 149.08 28.6 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 120.696 -1.252 . . . . 0.0 112.369 -176.613 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 61.0 t -63.04 -23.66 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -168.316 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -90.19 44.28 1.19 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.022 1.329 . . . . 0.0 113.31 177.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -143.29 158.43 43.63 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.765 2.026 . . . . 0.0 110.65 -172.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.89 0 C-N-CA 127.076 2.15 . . . . 0.0 112.969 -179.125 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.555 1.172 0 N-CA-C 119.851 3.278 . . . . 0.0 119.851 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp 2.43 -92.14 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 128.459 2.703 . . . . 0.0 116.876 -179.472 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.93 -36.88 64.71 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.302 0.955 . . . . 0.0 111.475 -169.352 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.402 ' CZ ' ' HA ' ' B' ' 101' ' ' PRO . 8.7 ttm105 -58.55 -48.05 82.18 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 117.648 -1.168 . . . . 0.0 110.622 169.748 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.66 -51.5 69.68 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.11 1.364 . . . . 0.0 111.095 -179.051 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.22 -38.86 91.35 Favored Glycine 0 CA--C 1.533 1.213 0 CA-C-N 119.044 0.838 . . . . 0.0 112.372 177.262 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -87.11 10.14 17.64 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.249 1.42 . . . . 0.0 114.174 175.972 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -117.93 -2.48 11.3 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.761 2.424 . . . . 0.0 111.469 169.364 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.0 mp -105.13 -36.26 7.33 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.232 0.923 . . . . 0.0 109.734 165.871 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.44 86.14 2.57 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 168.12 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -130.69 156.3 80.03 Favored Pre-proline 0 CA--C 1.54 0.576 0 C-N-CA 127.489 2.315 . . . . 0.0 110.71 -173.335 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -77.64 -122.81 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.361 3.374 . . . . 0.0 109.575 -174.603 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 54.1 m -57.65 -17.38 14.37 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 119.924 -1.735 . . . . 0.0 113.003 170.707 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.46 -18.27 60.66 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 120.8 -1.188 . . . . 0.0 112.606 171.475 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.5 t -85.38 -29.43 24.43 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 120.351 -1.468 . . . . 0.0 110.911 166.077 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.2 -43.28 74.27 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.678 -0.639 . . . . 0.0 109.798 167.859 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.549 HG23 HD13 ' A' ' 40' ' ' LEU . 1.3 mm -52.14 -51.3 31.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 CA-C-N 118.94 0.791 . . . . 0.0 112.177 169.211 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 52.9 mt -62.88 -38.39 90.67 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.126 0.788 . . . . 0.0 113.126 -177.167 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.9 p -79.18 -28.83 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 CA-C-N 119.395 0.998 . . . . 0.0 113.195 175.701 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.41 3.15 13.96 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.654 1.182 . . . . 0.0 112.953 169.351 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.474 HD22 ' CE2' ' A' ' 75' ' ' TYR . 0.3 OUTLIER -83.62 -52.38 6.5 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.02 1.328 . . . . 0.0 108.603 168.163 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.46 -52.73 27.17 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 128.728 2.811 . . . . 0.0 111.94 178.144 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -90.85 36.97 0.91 Allowed 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.861 2.064 . . . . 0.0 111.358 174.163 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -147.28 -93.26 0.12 Allowed Glycine 0 C--N 1.338 0.667 0 C-N-CA 125.588 1.566 . . . . 0.0 113.331 -172.77 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 28.4 m 38.84 29.44 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 C-N-CA 127.356 2.262 . . . . 0.0 116.053 -170.805 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.432 ' HB2' ' HG2' ' A' ' 39' ' ' GLN . 69.4 m -68.44 -89.43 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 127.872 2.469 . . . . 0.0 113.489 176.166 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.426 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 17.7 m-85 -142.93 144.63 30.02 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 126.622 1.969 . . . . 0.0 110.72 -172.935 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -63.24 135.31 49.8 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 123.081 2.521 . . . . 0.0 111.162 -174.107 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.64 -3.13 56.44 Favored Glycine 0 CA--C 1.534 1.224 0 CA-C-O 118.628 -1.095 . . . . 0.0 114.589 -175.211 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.432 ' HG2' ' HB2' ' A' ' 35' ' ' CYS . 2.7 pp0? -70.17 -17.85 63.18 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.773 1.787 . . . . 0.0 112.841 176.198 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.549 HD13 HG23 ' A' ' 26' ' ' ILE . 5.8 mt -50.68 -22.02 1.87 Allowed 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.5 0.591 . . . . 0.0 111.525 171.227 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.39 -32.32 73.89 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.685 0.994 . . . . 0.0 113.685 178.468 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.8 -44.43 27.48 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.105 0.562 . . . . 0.0 110.448 169.118 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -63.65 -30.78 71.84 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.743 1.217 . . . . 0.0 114.081 -176.139 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 27.6 mt -101.41 -14.09 17.7 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.008 1.723 . . . . 0.0 113.71 176.223 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.57 0.39 31.32 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.43 1.014 . . . . 0.0 114.241 -170.612 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 88.8 mt -89.62 136.68 32.89 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.062 1.345 . . . . 0.0 109.732 -179.488 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.1 p -59.07 159.14 7.64 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -168.405 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 71.6 mtp85 -54.37 -30.4 51.65 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.836 176.634 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.4 m -69.09 -57.62 5.17 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.467 1.031 . . . . 0.0 111.225 169.56 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -54.9 -41.37 70.84 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.388 -0.82 . . . . 0.0 112.995 -178.797 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.4 t -71.95 -32.65 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 O-C-N 121.486 -0.759 . . . . 0.0 111.962 176.862 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 68.8 m -69.55 -33.75 73.22 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.364 0.984 . . . . 0.0 112.19 178.477 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -54.9 -48.81 72.56 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.729 0.695 . . . . 0.0 111.788 169.649 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 32.0 m80 -62.6 -40.28 96.43 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 177.538 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 84.1 mt -75.9 -17.86 59.62 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.54 1.536 . . . . 0.0 114.218 179.769 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 t -66.31 -41.84 89.16 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.858 1.208 . . . . 0.0 111.895 179.479 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 46.4 t -67.57 -48.28 67.36 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-O 122.8 1.286 . . . . 0.0 110.884 168.839 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.472 ' HB3' ' CG2' ' A' ' 64' ' ' VAL . 1.1 tp -62.45 -37.75 87.12 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.591 1.557 . . . . 0.0 114.362 -169.241 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.431 ' HG2' HG23 ' A' ' 64' ' ' VAL . 1.2 mtt85 -89.76 8.65 30.72 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 114.679 1.362 . . . . 0.0 114.679 173.808 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -108.38 -55.77 0.58 Allowed Glycine 0 N--CA 1.474 1.224 0 C-N-CA 124.959 1.266 . . . . 0.0 111.138 171.879 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 56.0 m -74.76 15.31 0.39 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 128.262 2.625 . . . . 0.0 112.863 179.409 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.97 -5.68 24.09 Favored Glycine 0 C--N 1.34 0.799 0 C-N-CA 128.415 2.912 . . . . 0.0 116.296 169.497 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.4 mt -60.93 -30.42 70.19 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.57 1.685 . . . . 0.0 114.106 -173.059 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.472 ' CG2' ' HB3' ' A' ' 58' ' ' LEU . 1.5 m -138.87 151.21 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 125.854 1.662 . . . . 0.0 111.115 169.395 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.2 t -149.86 144.7 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 123.234 0.614 . . . . 0.0 112.559 176.059 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -78.89 140.43 38.11 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.108 1.363 . . . . 0.0 113.092 178.527 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.5 m -143.07 134.07 25.6 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 126.062 1.745 . . . . 0.0 106.956 -168.969 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -61.78 127.04 29.54 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 121.18 1.809 . . . . 0.0 111.191 172.851 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.313 2.8 pp20? -85.34 -134.15 0.06 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 118.147 -0.93 . . . . 0.0 110.314 174.344 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -72.77 -37.77 57.12 Favored Glycine 0 CA--C 1.531 1.068 0 CA-C-N 120.892 1.678 . . . . 0.0 113.408 176.27 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.0 ttp85 -154.9 -9.38 0.13 Allowed 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -179.524 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -111.8 -173.08 2.17 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.618 2.367 . . . . 0.0 107.707 171.37 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 4.3 m -104.8 146.42 12.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 124.017 0.927 . . . . 0.0 108.916 166.768 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -111.27 -162.66 0.81 Allowed 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 127.279 2.231 . . . . 0.0 109.713 172.752 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.474 ' CE2' HD22 ' A' ' 30' ' ' LEU . 1.1 p90 -159.24 96.87 1.33 Allowed 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 127.107 2.163 . . . . 0.0 106.557 -172.092 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -94.23 156.16 16.68 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.701 1.6 . . . . 0.0 111.233 -177.466 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.1 mt -62.7 160.13 14.84 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 165.471 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -42.44 -47.04 4.94 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.545 1.138 . . . . 0.0 114.056 -177.932 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -169.02 172.37 7.59 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 126.309 1.843 . . . . 0.0 108.63 176.728 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -34.33 -36.67 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 128.762 2.825 . . . . 0.0 111.226 162.836 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -38.96 -67.83 0.19 Allowed 'General case' 0 C--N 1.344 0.35 0 C-N-CA 128.552 2.741 . . . . 0.0 113.542 168.662 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 17.4 mt -79.07 -36.01 41.56 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 118.673 -0.679 . . . . 0.0 109.757 -173.16 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.77 -34.19 62.29 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.924 0.784 . . . . 0.0 112.597 170.096 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 -83.14 -59.73 2.38 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.738 178.738 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.35 -32.36 73.76 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -176.232 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.77 -35.98 59.96 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 121.417 -0.802 . . . . 0.0 110.656 169.846 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.58 -42.87 62.29 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 125.403 1.478 . . . . 0.0 114.44 -173.76 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -77.83 -23.61 48.95 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.734 1.267 . . . . 0.0 111.96 169.352 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 22.1 tp 80.74 146.38 0.09 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 129.583 3.153 . . . . 0.0 113.859 166.19 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.9 m -48.9 -7.39 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 129.142 2.977 . . . . 0.0 117.14 -178.387 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 74.89 -44.01 0.53 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 128.147 2.579 . . . . 0.0 113.008 172.893 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.8 p -50.94 44.68 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.34 1 C-N-CA 133.793 4.837 . . . . 0.0 118.435 -169.804 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 59.25 10.35 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 128.896 2.878 . . . . 0.0 112.756 -172.622 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.2 tt 75.28 113.9 0.06 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.821 2.448 . . . . 0.0 106.056 -165.503 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.51 77.94 0.11 Allowed 'General case' 0 CA--C 1.551 1.013 0 O-C-N 121.137 -0.977 . . . . 0.0 112.477 -177.274 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.0 m -57.98 140.81 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 125.743 1.617 . . . . 0.0 114.468 -174.948 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.79 104.0 0.07 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.94 2.496 . . . . 0.0 110.216 171.544 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 11.9 p -153.18 -72.3 0.14 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.458 1.103 . . . . 0.0 111.041 -169.157 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . 0.251 30.9 m-20 64.21 43.49 4.88 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 127.377 2.271 . . . . 0.0 112.996 171.591 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -66.39 158.12 79.29 Favored Pre-proline 0 CA--C 1.544 0.735 0 CA-C-N 113.769 -1.56 . . . . 0.0 110.413 168.028 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -59.8 161.8 17.47 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.463 2.776 . . . . 0.0 111.357 169.412 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -60.33 145.87 46.18 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.29 0.566 . . . . 0.0 111.004 -178.408 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 22.0 t -52.63 -29.26 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 124.809 1.244 . . . . 0.0 113.228 -173.108 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -94.15 -17.45 22.75 Favored 'General case' 0 CA--C 1.553 1.071 0 N-CA-C 115.556 1.687 . . . . 0.0 115.556 -179.942 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -105.91 -142.7 0.37 Allowed 'General case' 0 N--CA 1.478 0.954 0 CA-C-O 116.251 -1.833 . . . . 0.0 110.643 -179.503 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.3 ptp180 . . . . . 0 N--CA 1.493 1.679 0 C-N-CA 127.753 2.421 . . . . 0.0 115.364 -173.093 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 0.992 0 N-CA-C 118.21 2.67 . . . . 0.0 118.21 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 27.2 tp -2.19 -96.94 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 128.319 2.647 . . . . 0.0 116.708 -174.356 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.09 -33.67 63.71 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 119.217 0.917 . . . . 0.0 111.041 -169.339 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 7.0 ttm105 -55.23 -46.81 76.0 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 118.521 -0.752 . . . . 0.0 110.719 169.267 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.34 -50.0 74.34 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.906 1.282 . . . . 0.0 111.063 -179.666 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -59.07 -31.3 68.52 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-N 119.323 0.965 . . . . 0.0 112.831 177.624 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.6 3.08 55.09 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 174.436 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.09 -17.49 14.31 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 127.587 2.355 . . . . 0.0 111.706 172.701 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 4.3 mp -93.8 -44.91 7.89 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.416 0.687 . . . . 0.0 110.853 168.151 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.71 70.55 7.49 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.734 0.778 . . . . 0.0 110.807 172.675 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -127.12 132.97 24.57 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 128.066 2.546 . . . . 0.0 106.105 176.404 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -52.89 -94.01 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.862 1 C-N-CA 126.603 4.868 . . . . 0.0 115.806 -165.936 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 5.3 m -58.19 -25.37 61.49 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.623 1.569 . . . . 0.0 111.214 178.517 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 13.4 ttp180 -73.91 -34.69 64.47 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 179.635 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 52.8 t -63.03 -36.97 85.35 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.573 1.533 . . . . 0.0 109.572 167.605 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.1 mtm180 -61.78 -41.41 97.68 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.949 0.9 . . . . 0.0 112.354 169.823 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mm -61.41 -47.47 93.3 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 CA-C-N 120.235 1.38 . . . . 0.0 111.48 170.284 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 52.8 mt -62.47 -40.9 98.13 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.814 0.845 . . . . 0.0 112.101 -179.301 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 3.7 p -77.59 -28.2 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 177.462 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.17 -12.23 59.67 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 121.138 -0.976 . . . . 0.0 113.183 170.208 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.08 -54.07 16.97 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.292 1.037 . . . . 0.0 108.806 169.263 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 2.6 mt -41.3 -66.7 0.31 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 128.164 2.586 . . . . 0.0 111.201 173.273 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -79.75 32.05 0.25 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.667 1.987 . . . . 0.0 112.403 177.836 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -143.74 -80.91 0.05 OUTLIER Glycine 0 C--N 1.338 0.693 0 C-N-CA 125.002 1.287 . . . . 0.0 113.832 -173.867 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 23.6 m 37.43 22.83 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 N-CA-C 118.447 2.758 . . . . 0.0 118.447 -175.289 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 91.3 m -76.11 -69.66 0.49 Allowed 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.979 1.718 . . . . 0.0 113.274 179.87 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -144.14 159.12 53.75 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 123.684 0.794 . . . . 0.0 112.785 -168.629 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -60.79 138.18 77.67 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 123.748 2.965 . . . . 0.0 111.757 173.892 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 66.39 0.0 7.27 Favored Glycine 0 CA--C 1.533 1.204 0 CA-C-O 119.099 -0.834 . . . . 0.0 114.578 177.79 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -67.51 -29.16 68.5 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 119.077 1.439 . . . . 0.0 111.217 -178.154 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.7 mp -56.07 -15.16 3.24 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 124.23 1.012 . . . . 0.0 112.892 177.591 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.0 -46.04 78.85 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.635 0.774 . . . . 0.0 111.739 170.75 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.25 -42.24 75.88 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.096 0.862 . . . . 0.0 111.417 174.494 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -63.57 -31.05 72.1 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.103 1.361 . . . . 0.0 113.751 -177.48 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 29.9 mt -99.18 -10.38 22.54 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.55 1.54 . . . . 0.0 113.485 175.391 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.63 8.11 55.72 Favored Glycine 0 CA--C 1.537 1.428 0 CA-C-N 118.984 0.811 . . . . 0.0 113.737 -169.303 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 91.3 mt -88.83 162.82 15.96 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 118.615 1.208 . . . . 0.0 111.742 -177.232 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.5 p -70.67 154.81 41.5 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.634 -1.291 . . . . 0.0 110.287 175.26 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 68.0 mtp85 -54.03 -40.47 67.09 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.096 172.019 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 5.6 m -59.2 -49.39 78.04 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.172 0.989 . . . . 0.0 112.877 173.163 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -61.6 -46.62 89.05 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.595 -0.691 . . . . 0.0 110.934 178.657 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 19.3 t -67.18 -37.1 78.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.047 -179.204 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 56.6 m -58.86 -42.91 90.52 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 119.825 1.193 . . . . 0.0 112.855 170.984 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 34.9 m-20 -56.52 -46.57 80.5 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.05 0.841 . . . . 0.0 111.269 176.374 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -66.26 -40.65 90.3 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 121.719 -0.613 . . . . 0.0 112.32 176.759 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 88.2 mt -68.5 -18.49 64.4 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.908 0.883 . . . . 0.0 113.054 175.24 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.03 -53.74 54.28 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.229 1.377 . . . . 0.0 112.225 -179.16 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 17.5 t -65.99 -44.51 84.64 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.244 0.545 . . . . 0.0 110.326 173.86 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 2.5 tp -55.54 -40.53 71.99 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.092 1.757 . . . . 0.0 113.796 -172.816 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 64.5 mtm180 -83.53 -11.86 56.9 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.057 1.343 . . . . 0.0 113.367 176.447 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -85.62 -54.34 2.82 Favored Glycine 0 N--CA 1.47 0.949 0 C-N-CA 124.466 1.031 . . . . 0.0 110.673 170.828 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 31.2 m -58.45 -6.06 0.63 Allowed 'General case' 0 CA--C 1.56 1.356 0 C-N-CA 126.583 1.953 . . . . 0.0 114.519 174.708 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.87 -2.18 42.88 Favored Glycine 0 CA--C 1.531 1.08 0 C-N-CA 124.65 1.119 . . . . 0.0 114.065 -175.396 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 79.6 mt -57.24 -26.4 60.69 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.387 1.875 . . . . 0.0 113.386 -177.281 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -132.43 143.75 38.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 127.276 2.23 . . . . 0.0 110.177 168.508 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 22.1 t -143.3 139.09 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 125.726 1.61 . . . . 0.0 109.624 -172.54 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.7 153.59 40.01 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 178.108 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 93.7 m -162.01 139.67 8.69 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.36 1.464 . . . . 0.0 108.639 -178.828 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -71.12 123.39 22.04 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 119.946 1.248 . . . . 0.0 109.489 169.037 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.296 0.0 OUTLIER -69.97 -76.35 0.1 Allowed 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.711 1.141 . . . . 0.0 110.351 179.251 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -142.29 -29.98 0.14 Allowed Glycine 0 CA--C 1.534 1.277 0 C-N-CA 127.408 2.432 . . . . 0.0 113.282 169.714 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 6.4 ttp85 -145.93 -10.21 0.52 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.703 1.601 . . . . 0.0 113.914 179.067 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -117.56 172.07 7.59 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 127.0 2.12 . . . . 0.0 109.413 170.012 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 27.8 m -97.88 145.88 8.79 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 164.439 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -126.51 175.49 7.87 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 126.864 2.066 . . . . 0.0 109.718 -176.008 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -120.65 117.03 26.47 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 164.349 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -93.03 166.05 12.55 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.488 1.515 . . . . 0.0 109.123 169.525 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -66.93 166.67 13.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.857 0.863 . . . . 0.0 109.428 167.363 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -47.68 -47.52 29.56 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.538 1.135 . . . . 0.0 113.649 174.77 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -176.72 170.36 2.39 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 126.638 1.975 . . . . 0.0 109.427 -179.442 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -34.65 -36.96 0.05 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 129.373 3.069 . . . . 0.0 111.491 162.723 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -43.25 -69.39 0.14 Allowed 'General case' 0 C--N 1.341 0.205 0 C-N-CA 128.698 2.799 . . . . 0.0 113.295 169.626 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 19.0 mt -70.55 -28.76 65.16 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.22 0.918 . . . . 0.0 111.237 177.528 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -66.49 -34.54 78.14 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.001 0.818 . . . . 0.0 111.388 -176.81 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -79.57 -55.51 4.98 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 117.273 -1.346 . . . . 0.0 110.134 171.611 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.92 -32.17 67.51 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -176.019 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.63 -43.89 15.15 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.386 -0.822 . . . . 0.0 110.939 169.796 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.47 -29.51 71.58 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 125.106 1.336 . . . . 0.0 114.776 -170.134 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -82.88 -25.0 32.94 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.827 1.251 . . . . 0.0 112.451 168.556 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 21.4 tp 71.22 142.71 0.06 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 129.962 3.305 . . . . 0.0 112.238 -177.754 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 90' ' ' VAL . . . . . 0.477 HG23 HG12 ' B' ' 92' ' ' VAL . 12.1 m -42.62 -4.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 C-N-CA 129.487 3.115 . . . . 0.0 117.187 168.606 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 71.68 -29.55 0.2 Allowed 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 128.969 2.908 . . . . 0.0 114.565 173.29 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.477 HG12 HG23 ' B' ' 90' ' ' VAL . 4.5 p -58.8 39.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 131.619 3.968 . . . . 0.0 116.488 -175.736 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 60.83 11.63 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 128.779 2.832 . . . . 0.0 113.259 -177.13 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.0 tt 78.85 113.68 0.07 Allowed 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 128.74 2.816 . . . . 0.0 106.35 -166.905 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.28 80.86 0.05 Allowed 'General case' 0 CA--C 1.548 0.887 0 O-C-N 121.045 -1.035 . . . . 0.0 111.868 175.721 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 6.6 m -56.74 146.81 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 127.046 2.138 . . . . 0.0 114.777 -176.322 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -51.11 108.72 0.27 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 127.307 2.243 . . . . 0.0 110.244 169.976 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 3.0 p -158.63 -73.59 0.08 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.138 0.975 . . . . 0.0 109.332 -171.486 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 69.24 36.05 2.48 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.658 1.983 . . . . 0.0 113.133 168.223 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -62.2 164.88 9.75 Favored Pre-proline 0 CA--C 1.545 0.783 0 CA-C-N 114.486 -1.234 . . . . 0.0 111.259 168.543 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 101' ' ' PRO . . . . . 0.402 ' HA ' ' CZ ' ' A' ' 13' ' ' ARG . 37.5 Cg_endo -59.56 162.37 15.28 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.238 2.626 . . . . 0.0 111.92 169.448 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -68.2 151.39 47.03 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.577 0.751 . . . . 0.0 109.351 177.065 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 27.4 t -65.22 -38.8 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 O-C-N 120.924 -1.11 . . . . 0.0 111.574 -168.729 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.36 -13.54 62.43 Favored 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 175.583 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -128.0 -154.76 0.65 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 126.103 1.761 . . . . 0.0 112.328 -176.253 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 1.2 ptp85 . . . . . 0 N--CA 1.486 1.349 0 C-N-CA 125.943 1.697 . . . . 0.0 115.33 -168.318 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.471 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -70.76 -19.6 62.7 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.304 -0.872 . . . . 0.0 110.624 168.226 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.11 -42.29 96.92 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 120.661 -1.274 . . . . 0.0 113.363 168.962 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.5 mmt180 -59.93 -43.93 94.64 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 121.461 -0.774 . . . . 0.0 110.367 173.129 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -58.93 -42.26 89.3 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.421 1.888 . . . . 0.0 112.551 176.25 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.7 -30.11 76.59 Favored Glycine 0 N--CA 1.47 0.904 0 O-C-N 120.689 -1.257 . . . . 0.0 112.999 177.199 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.7 ttt-85 -73.44 -41.3 63.39 Favored 'General case' 0 C--O 1.221 -0.395 0 O-C-N 121.725 -0.867 . . . . 0.0 110.817 169.991 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.83 -32.65 65.97 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 176.554 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.5 mt -75.15 -44.93 44.15 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.344 1.058 . . . . 0.0 112.772 172.122 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -84.28 -14.24 50.35 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 116.56 2.059 . . . . 0.0 116.56 -175.507 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -50.94 148.7 7.21 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 126.74 2.016 . . . . 0.0 115.082 -170.843 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -49.41 -64.97 0.18 Allowed 'Trans proline' 0 C--N 1.351 0.666 1 C-N-CA 125.889 4.393 . . . . 0.0 112.652 -173.538 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 52.8 m -82.39 -31.58 29.61 Favored 'General case' 0 C--O 1.226 -0.145 0 CA-C-O 118.452 -0.785 . . . . 0.0 111.756 175.054 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.514 ' CD ' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -72.89 -32.06 65.12 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 120.313 1.415 . . . . 0.0 114.406 -171.304 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.8 t -61.46 -50.38 73.02 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.0 0.818 . . . . 0.0 110.39 170.438 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -57.63 -45.48 85.36 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.812 1.245 . . . . 0.0 113.044 174.363 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 mm -51.6 -53.39 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.388 1.075 . . . . 0.0 110.607 169.515 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.6 mt -56.28 -51.91 66.43 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 117.617 -1.183 . . . . 0.0 111.74 178.993 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -61.21 -38.18 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 CA-C-N 119.532 1.06 . . . . 0.0 112.404 -178.645 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.83 -15.41 61.17 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 176.327 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.0 tp -74.12 -40.16 62.85 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 120.778 1.626 . . . . 0.0 112.806 175.487 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.434 HD12 HD22 ' A' ' 86' ' ' LEU . 3.4 mt -51.56 -46.61 63.47 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.596 1.559 . . . . 0.0 110.978 175.116 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -86.12 11.98 10.64 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 126.533 1.933 . . . . 0.0 113.277 176.305 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.41 -92.79 0.92 Allowed Glycine 0 N--CA 1.468 0.794 0 C-N-CA 126.848 2.166 . . . . 0.0 114.447 -174.345 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.465 HG12 ' HA ' ' A' ' 76' ' ' ALA . 30.4 m 36.04 41.12 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 127.182 2.193 . . . . 0.0 114.75 -167.326 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 98.9 m -87.38 -102.99 0.07 Allowed 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 124.14 0.976 . . . . 0.0 110.679 175.761 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -112.52 168.87 7.03 Favored Pre-proline 0 CA--C 1.55 0.976 0 O-C-N 120.034 -1.666 . . . . 0.0 114.356 -170.17 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.25 111.4 2.26 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.14 1.893 . . . . 0.0 109.899 -176.002 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.54 7.21 76.05 Favored Glycine 0 CA--C 1.532 1.096 0 CA-C-O 119.166 -0.797 . . . . 0.0 114.354 -175.974 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.01 -21.79 23.4 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 119.45 1.625 . . . . 0.0 115.076 177.97 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.7 mp -63.72 -17.04 62.6 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 123.384 0.674 . . . . 0.0 111.845 175.971 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.33 -25.2 67.76 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.915 0.78 . . . . 0.0 112.992 173.607 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.55 -50.17 14.58 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.656 0.662 . . . . 0.0 110.146 168.706 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -56.29 -38.78 71.68 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 179.752 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.4 mt -99.36 -19.83 16.81 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.42 1.088 . . . . 0.0 113.438 -172.515 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.64 -11.03 3.51 Favored Glycine 0 CA--C 1.539 1.544 0 C-N-CA 124.525 1.059 . . . . 0.0 113.254 -168.303 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.38 128.15 34.81 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 125.147 1.379 . . . . 0.0 108.051 175.461 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.2 t -56.33 154.99 7.42 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 122.29 1.043 . . . . 0.0 112.019 -176.649 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.6 ptt-85 -54.93 -16.53 2.78 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.129 0.971 . . . . 0.0 113.316 175.02 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.6 t -65.32 -67.79 0.41 Allowed 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.404 1.002 . . . . 0.0 109.48 167.766 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -54.5 -42.81 71.22 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.604 1.093 . . . . 0.0 112.836 176.947 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.3 t -63.4 -45.48 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-O 118.389 -0.815 . . . . 0.0 111.41 177.005 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 26.0 m -71.57 -35.4 70.56 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.793 1.633 . . . . 0.0 112.837 178.311 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -56.15 -56.79 16.56 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.595 1.558 . . . . 0.0 110.094 173.746 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -73.0 -28.65 62.5 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -179.87 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 44.0 mt -64.3 -33.9 76.89 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.895 1.225 . . . . 0.0 111.72 169.671 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 66.7 m -62.04 -45.31 94.13 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.368 1.44 . . . . 0.0 113.683 -170.795 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 17.6 t -72.14 -21.07 61.52 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 119.432 1.015 . . . . 0.0 112.293 170.816 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.514 HD13 ' CD ' ' A' ' 23' ' ' ARG . 8.2 tp -67.31 -38.12 84.45 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 120.525 1.511 . . . . 0.0 110.439 171.528 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.423 ' HG2' HG23 ' A' ' 64' ' ' VAL . 90.9 mtm-85 -73.78 -15.24 61.2 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.078 1.351 . . . . 0.0 112.305 172.889 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.18 -58.51 1.56 Allowed Glycine 0 C--N 1.338 0.69 0 N-CA-C 109.323 -1.511 . . . . 0.0 109.323 179.499 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 69.7 m -60.89 10.82 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 128.113 2.565 . . . . 0.0 114.375 173.191 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 62.87 16.12 56.3 Favored Glycine 0 N--CA 1.469 0.864 0 C-N-CA 127.229 2.347 . . . . 0.0 115.631 173.668 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 82.6 mt -78.45 -26.91 46.3 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.532 1.166 . . . . 0.0 112.941 -179.566 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.423 HG23 ' HG2' ' A' ' 59' ' ' ARG . 2.8 m -132.54 142.81 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.771 1.228 . . . . 0.0 113.686 178.249 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 20.5 t -129.78 139.88 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.979 2.112 . . . . 0.0 109.893 -177.987 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.03 138.16 43.88 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.272 0.629 . . . . 0.0 112.272 170.726 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.98 161.51 35.47 Favored 'General case' 0 CA--C 1.509 -0.604 0 CA-C-O 121.706 0.765 . . . . 0.0 110.191 170.503 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -73.69 122.66 22.7 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 105.893 -1.892 . . . . 0.0 105.893 165.152 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -75.39 -22.99 57.02 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.773 1.169 . . . . 0.0 112.542 169.804 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 118.69 105.32 2.21 Favored Glycine 0 C--N 1.337 0.584 0 N-CA-C 106.798 -2.521 . . . . 0.0 106.798 -168.344 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 13.8 ttt85 76.01 -57.33 0.57 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.615 1.966 . . . . 0.0 111.621 -169.209 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -98.14 -166.95 1.44 Allowed 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 119.13 0.877 . . . . 0.0 111.249 -179.426 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 10.4 p -128.67 149.63 33.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 126.255 1.822 . . . . 0.0 108.649 -176.797 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.5 ptt180 -136.0 169.73 17.14 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 126.268 1.827 . . . . 0.0 110.998 -177.732 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -112.34 139.5 47.85 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 164.012 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.465 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -139.81 150.86 45.21 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.533 1.133 . . . . 0.0 110.394 -178.142 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.05 129.41 20.72 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.28 1.032 . . . . 0.0 108.302 170.031 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.9 -24.34 66.83 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -170.533 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -161.09 156.61 24.76 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 123.217 1.484 . . . . 0.0 112.9 -179.817 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 91.2 p -43.04 -36.48 1.61 Allowed 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 128.809 2.844 . . . . 0.0 114.87 168.519 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 -58.5 -42.88 88.62 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.08 -1.012 . . . . 0.0 112.559 175.904 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.3 mt -73.06 -38.3 66.51 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 118.685 0.675 . . . . 0.0 109.389 179.062 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.55 89.05 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.469 0.708 . . . . 0.0 109.23 -179.53 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -70.98 -51.97 22.47 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.951 1.7 . . . . 0.0 113.495 175.581 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.2 -45.19 95.62 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.734 1.152 . . . . 0.0 112.736 -179.654 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.434 HD22 HD12 ' A' ' 31' ' ' LEU . 2.0 tt -56.49 -55.59 31.88 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.836 0.855 . . . . 0.0 108.99 169.468 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.78 -17.54 78.32 Favored Glycine 0 CA--C 1.543 1.835 0 C-N-CA 125.601 1.572 . . . . 0.0 115.603 -167.93 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -73.58 -23.25 59.92 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 119.36 1.58 . . . . 0.0 110.361 166.998 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 52.7 tp 72.81 117.83 0.05 OUTLIER 'General case' 0 C--N 1.343 0.314 0 C-N-CA 129.261 3.024 . . . . 0.0 107.68 -171.872 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 21.7 t -69.1 18.78 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 125.902 1.681 . . . . 0.0 113.591 -169.078 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 91.19 -21.64 0.1 Allowed 'General case' 0 C--O 1.221 -0.446 0 O-C-N 119.494 -2.004 . . . . 0.0 110.349 126.319 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.413 ' C ' ' H ' ' A' ' 94' ' ' LEU . 7.7 p -72.44 41.61 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 127.628 2.371 . . . . 0.0 111.43 165.376 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER 68.6 -27.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 C-N-CA 129.608 3.163 . . . . 0.0 113.57 -173.162 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.413 ' H ' ' C ' ' A' ' 92' ' ' VAL . 45.8 tp 138.28 112.67 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.35 1 C-N-CA 133.116 4.566 . . . . 0.0 106.032 -169.644 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.41 106.84 0.27 Allowed 'General case' 0 CA--C 1.546 0.813 0 O-C-N 121.603 -0.686 . . . . 0.0 111.356 169.432 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.2 t -58.87 158.8 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 127.494 2.317 . . . . 0.0 110.916 169.89 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -85.85 18.83 2.76 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.261 1.824 . . . . 0.0 115.015 -179.568 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.4 p -75.36 96.99 3.5 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.198 0.999 . . . . 0.0 111.906 -178.347 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.79 49.34 1.77 Allowed 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 126.662 1.985 . . . . 0.0 110.534 170.503 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.422 ' HB3' ' HD2' ' A' ' 101' ' ' PRO . 66.6 mm-40 -103.1 -174.41 0.34 Allowed Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 127.674 2.389 . . . . 0.0 112.43 -169.738 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.422 ' HD2' ' HB3' ' A' ' 100' ' ' GLN . 36.9 Cg_endo -65.28 149.7 88.2 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.988 2.459 . . . . 0.0 110.495 164.207 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.9 t -61.13 172.81 0.94 Allowed 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 124.303 2.002 . . . . 0.0 114.994 -170.339 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 2.4 t -72.69 -17.36 18.35 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 CA-C-N 113.387 -1.733 . . . . 0.0 110.91 172.511 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.96 -24.5 40.92 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.739 1.216 . . . . 0.0 112.099 168.121 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -91.71 -122.48 0.08 Allowed 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 128.756 2.823 . . . . 0.0 105.345 173.119 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.335 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.507 0 C-N-CA 131.174 3.789 . . . . 0.0 114.8 165.149 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.541 0 N-CA-C 117.224 2.305 . . . . 0.0 117.224 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -88.45 -17.74 29.76 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.339 1.056 . . . . 0.0 112.487 168.963 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.62 -29.08 69.82 Favored 'General case' 0 CA--C 1.546 0.793 0 O-C-N 119.605 -1.934 . . . . 0.0 112.45 170.44 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 11.8 mmt-85 -66.04 -39.52 90.24 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.94 0.896 . . . . 0.0 111.691 170.39 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -57.32 -41.29 79.67 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.146 1.378 . . . . 0.0 111.879 -178.55 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -61.77 -37.24 93.97 Favored Glycine 0 N--CA 1.476 1.305 0 CA-C-N 120.339 1.427 . . . . 0.0 113.535 -178.391 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 9.2 ttt-85 -80.58 -24.11 39.41 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 118.054 0.927 . . . . 0.0 111.937 170.611 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.39 -33.94 74.51 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.138 -1.601 . . . . 0.0 112.498 170.289 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 17.5 mt -83.62 -42.14 17.04 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.163 0.985 . . . . 0.0 111.242 174.409 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -100.08 65.23 1.26 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.833 1.253 . . . . 0.0 112.746 173.307 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -120.81 149.56 50.96 Favored Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 126.082 1.753 . . . . 0.0 108.974 176.881 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -59.74 -63.73 0.12 Allowed 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 124.601 3.534 . . . . 0.0 112.725 -171.839 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.3 m -77.99 -37.75 46.49 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-O 118.709 -0.662 . . . . 0.0 110.066 174.877 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.666 ' CD ' HD13 ' B' ' 58' ' ' LEU . 0.5 OUTLIER -67.0 -37.2 83.77 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -169.6 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 22.2 t -62.7 -49.53 74.74 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.644 1.111 . . . . 0.0 111.139 171.811 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 64.5 mtt180 -53.81 -46.67 71.18 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.243 1.017 . . . . 0.0 112.982 172.841 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 11.3 mm -51.9 -53.27 18.36 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 C-N-CA 124.63 1.172 . . . . 0.0 110.787 170.47 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 78.2 mt -57.85 -47.38 82.86 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 117.837 -1.077 . . . . 0.0 111.667 179.131 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.5 m -64.29 -39.52 85.81 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 119.914 1.233 . . . . 0.0 112.813 -179.995 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.32 -8.64 59.78 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -179.274 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' B' ' 30' ' ' LEU . 13.2 mt -69.42 -45.17 69.8 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 118.279 -0.867 . . . . 0.0 112.907 169.207 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 31' ' ' LEU . . . . . 0.409 HD12 HD22 ' B' ' 86' ' ' LEU . 0.9 OUTLIER -44.48 -63.29 0.92 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.27 2.628 . . . . 0.0 112.569 -176.525 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -95.63 8.31 43.76 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 126.53 1.932 . . . . 0.0 112.788 -177.365 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.14 -85.88 1.83 Allowed Glycine 0 C--N 1.338 0.66 0 C-N-CA 127.818 2.628 . . . . 0.0 110.435 173.185 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 34.11 44.53 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.754 1.621 . . . . 0.0 113.552 -167.728 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 88.6 m -105.18 -145.54 0.38 Allowed 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 123.571 1.653 . . . . 0.0 109.655 170.038 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.79 166.03 13.42 Favored Pre-proline 0 C--N 1.317 -0.847 0 N-CA-C 117.609 2.448 . . . . 0.0 117.609 -160.47 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -72.32 110.9 3.07 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 122.25 1.966 . . . . 0.0 107.797 -175.996 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.81 13.27 75.61 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-O 118.227 -1.319 . . . . 0.0 114.908 -171.676 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.59 -36.82 64.83 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.603 1.701 . . . . 0.0 111.297 171.013 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.5 mp -56.14 -15.8 4.26 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 124.634 1.174 . . . . 0.0 113.926 -179.756 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.16 -43.74 92.09 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 119.233 0.924 . . . . 0.0 111.507 172.933 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.43 -25.04 54.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.764 0.826 . . . . 0.0 113.125 175.347 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -70.26 -32.71 70.67 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.422 -0.799 . . . . 0.0 112.813 172.288 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 12.8 mt -111.0 -20.18 12.51 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -169.426 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.88 4.83 78.12 Favored Glycine 0 CA--C 1.535 1.285 0 CA-C-N 119.926 1.239 . . . . 0.0 113.75 -169.731 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -100.24 135.67 41.32 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 125.065 1.346 . . . . 0.0 110.82 178.503 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 6.2 t -55.9 154.47 7.24 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.385 -0.822 . . . . 0.0 112.544 177.796 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 32.9 ptt-85 -51.57 -23.76 4.57 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.251 1.42 . . . . 0.0 113.539 174.88 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 25.7 t -63.66 -67.08 0.46 Allowed 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 118.526 0.603 . . . . 0.0 110.751 169.484 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -58.07 -35.73 71.79 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.209 1.003 . . . . 0.0 113.455 -179.892 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 15.4 t -59.43 -47.96 88.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 118.767 0.712 . . . . 0.0 111.793 169.899 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 35.7 m -78.31 -32.54 49.36 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -175.638 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -60.15 -49.85 76.01 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.053 0.941 . . . . 0.0 110.176 176.477 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -72.95 -34.36 66.47 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 117.981 -1.009 . . . . 0.0 113.68 175.363 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 28.3 mt -56.38 -30.72 63.06 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 120.643 1.565 . . . . 0.0 112.526 169.571 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 67.7 m -69.54 -49.8 51.0 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 120.144 1.338 . . . . 0.0 114.571 -170.79 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 16.6 t -63.19 -27.55 69.44 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 119.708 1.14 . . . . 0.0 111.678 171.599 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.666 HD13 ' CD ' ' B' ' 23' ' ' ARG . 11.8 tp -66.36 -39.98 89.47 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.108 2.163 . . . . 0.0 112.35 177.271 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.472 ' HG2' HG23 ' B' ' 64' ' ' VAL . 82.2 mtm-85 -67.65 -33.52 75.11 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 119.145 0.884 . . . . 0.0 110.327 173.228 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -71.46 -53.64 9.87 Favored Glycine 0 N--CA 1.466 0.634 0 N-CA-C 110.251 -1.14 . . . . 0.0 110.251 179.226 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 57.1 m -55.98 -4.6 0.13 Allowed 'General case' 0 CA--C 1.56 1.332 0 C-N-CA 128.112 2.565 . . . . 0.0 113.961 173.877 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.78 16.66 67.47 Favored Glycine 0 C--N 1.343 0.953 0 C-N-CA 127.347 2.403 . . . . 0.0 113.645 170.083 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.618 HD12 HD12 ' B' ' 58' ' ' LEU . 90.7 mt -94.52 -21.11 19.08 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 -169.648 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.472 HG23 ' HG2' ' B' ' 59' ' ' ARG . 4.5 m -140.44 156.17 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -173.77 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 96.2 t -147.21 149.48 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 125.702 1.601 . . . . 0.0 111.019 -173.144 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.4 125.2 41.89 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.012 0.925 . . . . 0.0 111.906 169.168 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.15 165.85 16.84 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.254 1.021 . . . . 0.0 110.313 -176.154 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -76.04 122.57 24.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.817 168.675 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -85.78 -24.97 26.63 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 118.316 0.507 . . . . 0.0 111.357 167.067 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 125.96 105.33 1.47 Allowed Glycine 0 C--N 1.34 0.778 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -174.191 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 71.15 -52.1 0.69 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.999 2.12 . . . . 0.0 111.403 -169.639 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -91.45 -178.04 4.99 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.643 1.177 . . . . 0.0 110.444 177.568 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 11.2 p -125.61 138.24 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 125.976 1.71 . . . . 0.0 108.884 179.896 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 38.1 ptt180 -115.17 166.28 12.0 Favored 'General case' 0 CA--C 1.509 -0.628 0 C-N-CA 124.708 1.203 . . . . 0.0 109.415 -176.78 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -115.75 135.94 53.54 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 168.979 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -141.77 160.91 39.22 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.88 1.672 . . . . 0.0 112.055 -169.098 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 49.7 mt -68.19 152.67 45.13 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.803 0.841 . . . . 0.0 109.271 167.421 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.22 -22.35 38.86 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 -169.5 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -167.07 158.14 12.0 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.383 1.473 . . . . 0.0 112.76 179.068 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 89.5 p -40.01 -39.84 0.94 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 128.811 2.845 . . . . 0.0 114.949 168.221 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -55.97 -43.81 77.92 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.701 0.8 . . . . 0.0 111.571 175.9 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 1.9 mt -78.0 -42.14 33.61 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.408 1.004 . . . . 0.0 110.194 -176.471 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.12 -38.9 63.06 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.852 0.861 . . . . 0.0 111.043 171.777 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 18.5 tpt180 -70.95 -52.72 18.15 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.574 1.55 . . . . 0.0 113.659 177.041 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.94 -40.38 88.73 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 118.89 0.768 . . . . 0.0 112.43 177.622 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.409 HD22 HD12 ' B' ' 31' ' ' LEU . 0.8 OUTLIER -57.88 -49.32 77.13 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.971 1.308 . . . . 0.0 109.883 169.564 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.05 -29.95 63.94 Favored Glycine 0 CA--C 1.536 1.384 0 C-N-CA 125.636 1.588 . . . . 0.0 114.768 -169.552 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -73.75 -14.63 61.15 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 118.971 1.385 . . . . 0.0 111.128 167.197 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 28.2 tp 70.78 157.08 0.16 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 129.001 2.921 . . . . 0.0 107.922 -166.861 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 90' ' ' VAL . . . . . 0.535 HG21 ' H ' ' B' ' 95' ' ' ALA . 27.8 m -53.91 -11.84 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 O-C-N 121.055 -1.028 . . . . 0.0 112.654 167.397 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 91' ' ' GLN . . . . . 0.427 ' C ' ' H ' ' B' ' 93' ' ' VAL . 3.6 tp-100 76.5 -20.04 0.39 Allowed 'General case' 0 C--N 1.345 0.376 0 C-N-CA 127.742 2.417 . . . . 0.0 112.287 161.487 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.412 HG13 ' O ' ' B' ' 92' ' ' VAL . 3.9 p -68.05 38.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 128.593 2.757 . . . . 0.0 113.903 169.515 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 93' ' ' VAL . . . . . 0.427 ' H ' ' C ' ' B' ' 91' ' ' GLN . 2.3 t 74.72 -34.42 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 C-N-CA 130.039 3.336 . . . . 0.0 112.301 -178.718 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 38.3 tp 155.3 111.12 0.0 OUTLIER 'General case' 0 C--N 1.341 0.236 0 C-N-CA 131.664 3.986 . . . . 0.0 108.123 178.073 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.535 ' H ' HG21 ' B' ' 90' ' ' VAL . . . -64.07 87.11 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.82 0 O-C-N 121.638 -0.664 . . . . 0.0 109.557 165.943 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 4.2 t -53.7 162.04 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 128.091 2.556 . . . . 0.0 111.237 173.293 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -73.61 8.09 2.06 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 127.625 2.37 . . . . 0.0 116.544 -179.533 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 45.1 p -73.59 114.73 12.18 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.247 0.931 . . . . 0.0 113.351 -171.22 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -102.0 113.84 27.42 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 105.68 -1.97 . . . . 0.0 105.68 166.062 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 100' ' ' GLN . . . . . 0.4 ' HG3' ' HD2' ' B' ' 101' ' ' PRO . 1.3 tp-100 -161.78 -169.04 0.21 Allowed Pre-proline 0 CA--C 1.551 0.982 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 -163.933 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 101' ' ' PRO . . . . . 0.4 ' HD2' ' HG3' ' B' ' 100' ' ' GLN . 87.2 Cg_endo -75.43 -174.39 1.97 Allowed 'Trans proline' 0 N--CA 1.45 -1.056 0 C-N-CA 121.371 1.38 . . . . 0.0 111.43 175.124 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 5.2 t -68.16 171.54 6.89 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-O 123.339 1.542 . . . . 0.0 110.655 168.936 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 17.3 t -77.47 -22.11 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 C-N-CA 127.105 2.162 . . . . 0.0 111.7 175.389 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -76.69 -37.27 56.41 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.419 1.087 . . . . 0.0 111.681 169.373 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -68.27 175.86 3.07 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.985 1.714 . . . . 0.0 110.248 169.304 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.819 0 O-C-N 120.498 -1.376 . . . . 0.0 113.819 -179.851 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.842 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . 0.258 4.0 pp -67.19 -33.45 75.4 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -172.373 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.53 -46.75 89.01 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.465 1.03 . . . . 0.0 111.004 168.613 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -59.11 -38.31 79.26 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 120.452 1.478 . . . . 0.0 112.679 174.705 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -63.36 -57.47 10.23 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.036 0.834 . . . . 0.0 110.853 177.366 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -61.15 -32.34 80.12 Favored Glycine 0 CA--C 1.533 1.178 0 O-C-N 121.335 -0.853 . . . . 0.0 113.007 178.267 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -68.15 -4.04 12.47 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.295 1.548 . . . . 0.0 114.144 -178.807 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -128.31 -15.87 4.54 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 167.898 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.6 mp -101.39 -15.76 17.1 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 178.641 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.23 75.09 4.62 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.571 1.548 . . . . 0.0 107.329 167.281 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -164.46 147.92 7.69 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 123.757 0.823 . . . . 0.0 113.125 -168.441 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -63.63 -96.87 0.0 OUTLIER 'Trans proline' 0 CA--C 1.547 1.145 1 C-N-CA 125.45 4.1 . . . . 0.0 111.512 174.065 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.3 p -47.98 -35.6 11.17 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 128.12 2.568 . . . . 0.0 112.912 169.677 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.552 ' CG ' HD11 ' A' ' 58' ' ' LEU . 5.5 ttm180 -75.96 -46.71 28.33 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 121.532 1.969 . . . . 0.0 113.94 -169.17 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 37.3 t -59.17 -42.42 90.76 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.93 0.786 . . . . 0.0 109.514 169.943 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -54.66 -43.37 72.34 Favored 'General case' 0 CA--C 1.555 1.163 0 CA-C-O 117.93 -1.033 . . . . 0.0 112.641 171.251 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.1 mt -56.28 -51.7 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 CA-C-N 121.858 2.117 . . . . 0.0 110.338 172.338 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.17 -40.05 88.56 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 118.486 -0.769 . . . . 0.0 112.796 -177.165 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.6 p -81.67 -24.62 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 CA-C-N 119.637 1.108 . . . . 0.0 113.067 178.324 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.75 -31.03 63.14 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.638 1.175 . . . . 0.0 111.972 172.844 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.587 ' O ' HG13 ' A' ' 34' ' ' VAL . 1.1 tp -64.64 -39.68 94.12 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 120.787 -1.196 . . . . 0.0 113.513 170.441 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -44.6 -44.41 8.87 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.626 2.37 . . . . 0.0 114.283 -174.753 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -103.56 -19.31 14.41 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.36 1.064 . . . . 0.0 112.978 169.089 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.71 -2.28 57.41 Favored Glycine 0 C--O 1.218 -0.871 0 CA-C-O 114.992 -3.115 . . . . 0.0 117.257 -165.076 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.587 HG13 ' O ' ' A' ' 30' ' ' LEU . 19.7 m -32.99 54.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 N-CA-C 119.668 3.21 . . . . 0.0 119.668 169.418 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.9 m -109.42 -67.47 0.98 Allowed 'General case' 0 C--O 1.224 -0.287 0 O-C-N 119.828 -1.795 . . . . 0.0 110.728 -174.167 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -148.78 157.14 41.13 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-O 117.901 -1.047 . . . . 0.0 110.976 -174.456 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -55.98 -31.93 83.94 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.166 2.578 . . . . 0.0 113.827 179.121 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -81.33 -8.26 87.36 Favored Glycine 0 CA--C 1.532 1.135 0 CA-C-O 118.352 -1.249 . . . . 0.0 114.851 176.338 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.85 -37.58 84.73 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 119.554 1.677 . . . . 0.0 111.531 -170.881 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.5 mt -58.5 -24.58 60.84 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 123.699 0.8 . . . . 0.0 111.33 178.996 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.59 -36.67 67.14 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 119.265 0.938 . . . . 0.0 111.427 -175.366 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.39 -51.94 10.88 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.933 0.893 . . . . 0.0 112.529 172.756 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 3.1 m170 -53.57 -32.92 52.89 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 178.239 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.485 HD12 HG22 ' A' ' 51' ' ' VAL . 55.6 mt -97.33 -11.31 24.19 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 126.442 1.897 . . . . 0.0 112.617 -179.104 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 61.69 18.42 56.41 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-O 118.598 -1.112 . . . . 0.0 113.867 -170.812 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.8 mt -122.19 148.17 45.28 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 119.277 1.539 . . . . 0.0 113.733 -169.661 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.3 t -58.79 138.12 57.35 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.074 178.572 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.4 -24.82 65.44 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -171.325 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.7 m -63.8 -47.89 79.06 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.4 1.08 . . . . 0.0 112.687 170.196 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -75.2 -32.83 61.31 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 118.76 0.709 . . . . 0.0 111.712 178.341 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.485 HG22 HD12 ' A' ' 44' ' ' LEU . 24.9 t -58.89 -41.52 83.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 120.982 -1.074 . . . . 0.0 110.343 167.848 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 57.8 m -63.1 -40.29 97.19 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 177.844 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -51.07 -50.52 58.53 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.488 1.115 . . . . 0.0 111.572 173.405 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -69.87 -37.23 76.01 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 115.4 -2.238 . . . . 0.0 113.598 176.205 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.445 ' HA ' HD13 ' A' ' 58' ' ' LEU . 37.7 mt -61.25 -34.09 74.58 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 121.437 1.926 . . . . 0.0 113.279 175.464 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.4 m -53.12 -39.26 63.34 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.184 -0.947 . . . . 0.0 113.441 -177.797 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 3.2 t -66.99 -51.08 59.45 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 118.878 0.763 . . . . 0.0 111.085 176.603 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.618 ' H ' HD12 ' A' ' 58' ' ' LEU . 2.6 mp -59.64 -36.2 75.9 Favored 'General case' 0 N--CA 1.484 1.259 0 O-C-N 120.792 -1.192 . . . . 0.0 111.885 -175.394 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 90.4 mtm180 -76.17 -21.7 56.22 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.336 1.055 . . . . 0.0 112.71 -176.721 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.3 -36.11 4.5 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.893 1.235 . . . . 0.0 114.49 176.991 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 59.9 m -70.63 -17.03 62.88 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 125.003 1.321 . . . . 0.0 112.441 173.396 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 95.17 20.14 28.7 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 128.137 2.78 . . . . 0.0 115.782 172.295 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.1 mt -83.4 -20.38 34.27 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 119.333 1.567 . . . . 0.0 114.499 177.091 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.531 HG23 ' HB3' ' A' ' 58' ' ' LEU . 61.9 t -134.33 140.74 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 124.637 1.175 . . . . 0.0 110.612 -179.057 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.6 t -135.31 135.93 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 126.273 1.829 . . . . 0.0 108.672 -170.977 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.09 157.57 37.52 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 122.628 1.204 . . . . 0.0 112.214 172.399 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 30.3 m -153.54 154.34 34.11 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.842 1.657 . . . . 0.0 106.587 175.301 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -74.23 162.44 28.93 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.936 0.789 . . . . 0.0 112.379 169.758 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -139.91 171.32 14.38 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 126.309 1.844 . . . . 0.0 111.911 178.246 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -68.14 75.42 0.26 Allowed Glycine 0 CA--C 1.527 0.834 0 C-N-CA 125.837 1.684 . . . . 0.0 112.525 179.366 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 95.9 18.96 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 129.945 3.298 . . . . 0.0 111.987 179.7 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -158.06 -178.63 7.44 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 120.972 -1.08 . . . . 0.0 110.551 -175.17 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 32.5 m -121.76 156.48 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 124.148 0.979 . . . . 0.0 109.198 167.257 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -132.51 178.3 6.95 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 124.767 1.227 . . . . 0.0 110.452 -170.23 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -129.54 134.92 48.01 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.525 168.862 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.583 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -130.09 151.64 50.4 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 126.414 1.886 . . . . 0.0 108.834 179.596 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.12 157.76 15.22 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.257 0.48 . . . . 0.0 110.708 175.536 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -43.04 -54.61 4.23 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.748 1.619 . . . . 0.0 113.544 -178.201 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -165.7 165.66 18.47 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.834 1.653 . . . . 0.0 110.137 -173.843 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.16 -35.72 0.08 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 129.687 3.195 . . . . 0.0 111.642 165.803 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -46.53 -69.2 0.14 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.307 1.843 . . . . 0.0 113.145 169.172 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.4 mt -71.57 -34.01 69.57 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.083 0.856 . . . . 0.0 110.771 -174.487 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.65 -45.91 90.61 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 118.673 -0.68 . . . . 0.0 111.923 175.612 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.03 -43.28 71.63 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 117.318 -1.325 . . . . 0.0 111.651 176.416 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.37 -47.86 80.53 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.785 1.175 . . . . 0.0 113.238 177.063 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.25 -39.62 74.92 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.763 -0.585 . . . . 0.0 111.136 178.472 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.69 -36.79 61.83 Favored Glycine 0 CA--C 1.531 1.059 0 C-N-CA 125.311 1.434 . . . . 0.0 114.565 -176.7 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -72.68 -5.96 41.15 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.651 1.226 . . . . 0.0 112.521 172.655 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 52.0 tp 75.01 107.62 0.07 Allowed 'General case' 0 C--N 1.345 0.392 0 C-N-CA 129.764 3.226 . . . . 0.0 112.459 166.349 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.81 32.67 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 125.81 1.644 . . . . 0.0 112.328 -169.756 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 79.93 -10.8 1.25 Allowed 'General case' 0 C--O 1.221 -0.433 0 O-C-N 120.387 -1.445 . . . . 0.0 113.824 122.123 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.427 HG13 ' O ' ' A' ' 92' ' ' VAL . 12.3 p -71.94 54.08 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 C-N-CA 130.218 3.407 . . . . 0.0 109.963 166.647 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 71.92 -10.87 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 126.632 1.973 . . . . 0.0 114.355 178.268 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.3 tt 117.47 103.67 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 131.291 3.836 . . . . 0.0 106.755 -169.355 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.81 76.72 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.173 0 C-N-CA 125.115 1.366 . . . . 0.0 114.383 174.269 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.1 t -82.08 145.4 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 125.686 1.594 . . . . 0.0 107.728 167.269 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -69.82 13.99 0.12 Allowed 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 178.137 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.82 34.48 0.12 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.966 1.306 . . . . 0.0 109.771 166.74 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -57.83 130.54 46.92 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 125.254 1.422 . . . . 0.0 109.245 -166.742 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -132.31 132.78 23.1 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.958 -160.693 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -53.39 150.71 25.56 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 125.142 3.894 . . . . 0.0 117.968 -163.499 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 41.5 t -90.98 -134.47 0.13 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 127.066 2.146 . . . . 0.0 112.727 177.171 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 10.0 t 58.54 -116.17 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 127.917 2.487 . . . . 0.0 106.163 -168.472 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -175.67 149.42 0.97 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 129.603 3.161 . . . . 0.0 108.38 171.303 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -153.01 141.13 20.41 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.45 1.1 . . . . 0.0 108.674 -169.601 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 7.5 ttm180 . . . . . 0 CA--C 1.548 0.884 0 C-N-CA 123.666 0.786 . . . . 0.0 112.025 175.903 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.736 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 pp -60.96 -33.86 73.86 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 116.827 2.158 . . . . 0.0 116.827 -167.314 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.01 -30.21 62.33 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 121.048 1.749 . . . . 0.0 112.404 174.0 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -57.57 -51.23 70.34 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.369 0.986 . . . . 0.0 109.69 171.305 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -58.9 -63.36 1.32 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.827 0.851 . . . . 0.0 109.563 175.797 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -59.98 -40.84 97.49 Favored Glycine 0 C--O 1.219 -0.825 0 CA-C-O 117.64 -1.644 . . . . 0.0 112.831 -169.868 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -87.07 -12.31 47.59 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.212 2.006 . . . . 0.0 114.085 -179.428 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -86.95 -31.56 20.59 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.773 1.17 . . . . 0.0 111.467 168.103 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.6 mp -83.77 -19.12 35.64 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.616 0.766 . . . . 0.0 111.207 171.899 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.16 63.73 1.89 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.29 1.836 . . . . 0.0 110.597 167.713 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -144.22 137.39 13.96 Favored Pre-proline 0 CA--C 1.547 0.841 0 N-CA-C 104.19 -2.522 . . . . 0.0 104.19 167.831 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 21' ' ' PRO . . . . . 0.406 ' HG2' ' H ' ' B' ' 22' ' ' THR . 57.1 Cg_endo -52.13 -77.42 0.02 OUTLIER 'Trans proline' 0 CA--C 1.548 1.183 1 C-N-CA 125.816 4.344 . . . . 0.0 112.703 -175.853 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.406 ' H ' ' HG2' ' B' ' 21' ' ' PRO . 2.0 p -41.19 -49.89 3.56 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 129.605 3.162 . . . . 0.0 112.586 168.251 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 37.6 ttt180 -72.95 -34.83 66.77 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.12 0.968 . . . . 0.0 111.979 -168.076 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 46.8 t -63.09 -51.48 66.46 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.19 0.905 . . . . 0.0 109.802 167.595 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -57.99 -35.01 70.61 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.034 1.334 . . . . 0.0 112.364 178.729 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 26' ' ' ILE . . . . . 0.402 HD13 HD11 ' B' ' 44' ' ' LEU . 5.3 mm -56.1 -61.87 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 125.629 1.571 . . . . 0.0 108.644 169.085 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 82.1 mt -64.36 -40.2 95.37 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.585 0.754 . . . . 0.0 111.997 -169.366 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 8.6 p -70.96 -23.97 24.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 177.311 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 29' ' ' ALA . . . . . 0.544 ' HB1' ' CD2' ' B' ' 43' ' ' HIS . . . -92.38 -21.0 20.47 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 175.32 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.469 ' O ' HG13 ' B' ' 34' ' ' VAL . 11.6 mt -58.2 -46.37 85.95 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.112 -0.993 . . . . 0.0 110.021 168.664 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.7 mt -44.66 -36.62 3.19 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 129.355 3.062 . . . . 0.0 114.484 175.193 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -100.01 -18.79 16.86 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.276 1.831 . . . . 0.0 112.751 -177.963 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -108.32 -66.97 0.6 Allowed Glycine 0 C--N 1.341 0.861 0 C-N-CA 125.203 1.382 . . . . 0.0 115.033 -170.509 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 34' ' ' VAL . . . . . 0.469 HG13 ' O ' ' B' ' 30' ' ' LEU . 15.7 m 34.3 36.1 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 C-N-CA 127.069 2.147 . . . . 0.0 115.815 -169.182 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 72.7 m -85.02 -72.63 0.47 Allowed 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.066 0.947 . . . . 0.0 112.68 -176.587 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -148.29 153.08 40.41 Favored Pre-proline 0 N--CA 1.474 0.769 0 CA-C-O 117.767 -1.111 . . . . 0.0 112.306 -169.932 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -54.39 -31.31 67.44 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 123.127 2.551 . . . . 0.0 113.783 -178.063 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -84.46 -7.04 85.25 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-O 117.868 -1.518 . . . . 0.0 115.301 175.53 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -30.4 70.9 Favored 'General case' 0 C--N 1.347 0.498 0 CA-C-N 120.534 2.167 . . . . 0.0 112.224 -170.704 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.4 mt -67.09 -13.33 61.83 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 119.082 -0.485 . . . . 0.0 111.567 -175.444 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.63 -31.71 66.53 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.286 0.948 . . . . 0.0 112.358 171.473 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.84 -48.91 13.83 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.312 0.645 . . . . 0.0 111.422 171.533 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 43' ' ' HIS . . . . . 0.544 ' CD2' ' HB1' ' B' ' 29' ' ' ALA . 5.5 m-70 -55.05 -32.38 61.84 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.731 HD12 HG22 ' B' ' 51' ' ' VAL . 67.0 mt -104.16 -23.43 13.27 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.751 1.62 . . . . 0.0 112.095 -176.077 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.65 8.63 72.6 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 124.271 0.938 . . . . 0.0 113.402 -169.073 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 92.0 mt -111.1 148.95 31.56 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 125.48 1.512 . . . . 0.0 110.674 -170.554 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.3 t -59.57 150.79 26.18 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -177.862 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -21.77 64.72 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -174.993 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 9.4 m -73.7 -41.26 62.85 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 120.952 -1.093 . . . . 0.0 112.526 169.164 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -68.82 -39.72 79.89 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.599 0.76 . . . . 0.0 110.955 174.781 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 51' ' ' VAL . . . . . 0.731 HG22 HD12 ' B' ' 44' ' ' LEU . 43.7 t -54.3 -50.46 56.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.896 0.878 . . . . 0.0 109.725 167.09 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 68.6 m -60.56 -40.38 91.44 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -178.868 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -53.99 -50.56 66.29 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.265 1.026 . . . . 0.0 112.217 -178.788 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 73.1 m-70 -79.04 -10.91 59.96 Favored 'General case' 0 CA--C 1.552 1.025 0 O-C-N 120.847 -1.158 . . . . 0.0 114.044 175.865 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 81.2 mt -80.26 -28.84 38.35 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.592 1.542 . . . . 0.0 111.651 167.422 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 68.9 m -53.74 -46.1 70.76 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 117.754 -1.117 . . . . 0.0 113.064 -176.65 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 4.0 t -72.16 -44.5 62.98 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.803 1.183 . . . . 0.0 109.579 176.91 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 3.6 tp -50.82 -38.23 47.52 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.873 2.469 . . . . 0.0 114.572 -173.26 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 47.3 mtp180 -80.74 -9.93 59.77 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.318 1.847 . . . . 0.0 112.604 -179.785 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -105.68 -32.93 3.71 Favored Glycine 0 CA--C 1.539 1.592 0 C-N-CA 127.166 2.317 . . . . 0.0 113.825 169.212 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 86.9 m -55.72 -27.68 51.76 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 126.389 1.876 . . . . 0.0 112.052 169.387 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.95 25.17 58.47 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 126.089 1.804 . . . . 0.0 112.488 -173.398 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 91.4 mt -86.83 -25.32 24.61 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.19 1.495 . . . . 0.0 113.279 175.562 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.1 m -127.61 131.85 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 124.772 1.229 . . . . 0.0 112.544 179.074 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 49.6 t -121.0 136.48 57.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.493 1.517 . . . . 0.0 109.83 -179.863 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.06 155.73 28.67 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.13 1.372 . . . . 0.0 113.35 170.571 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 87.3 m -155.15 151.55 28.38 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.853 1.661 . . . . 0.0 107.435 178.728 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -76.84 150.58 36.08 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.792 0.723 . . . . 0.0 112.25 173.886 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -125.12 170.76 10.89 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 127.001 2.12 . . . . 0.0 112.377 178.972 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -67.46 78.86 0.17 Allowed Glycine 0 CA--C 1.528 0.846 0 C-N-CA 125.221 1.391 . . . . 0.0 112.209 177.16 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 93.62 17.43 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 129.418 3.087 . . . . 0.0 112.359 178.802 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -157.07 -179.67 8.43 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.806 1.242 . . . . 0.0 109.974 -176.727 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 27.2 m -117.68 158.61 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.122 0.969 . . . . 0.0 109.328 166.608 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -131.83 176.93 7.93 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 124.851 1.26 . . . . 0.0 110.653 -175.082 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -136.34 153.88 51.01 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 125.193 1.397 . . . . 0.0 109.236 170.607 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -157.3 154.91 29.81 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 124.278 1.031 . . . . 0.0 110.871 -172.742 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -50.71 129.47 22.87 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.02 1.328 . . . . 0.0 107.581 168.362 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.18 -38.89 74.28 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 -169.563 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -151.13 163.68 38.25 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 123.1 1.428 . . . . 0.0 111.775 174.892 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.53 -36.79 0.11 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 129.761 3.225 . . . . 0.0 111.603 165.867 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -47.75 -63.94 0.92 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.198 1.799 . . . . 0.0 112.468 169.835 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 9.4 mt -71.59 -38.74 70.85 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.201 0.91 . . . . 0.0 110.369 -177.828 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.73 -47.13 77.45 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.307 0.643 . . . . 0.0 112.198 177.538 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 4.8 ppt_? -71.58 -47.54 54.14 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 117.868 -1.063 . . . . 0.0 111.589 178.706 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.62 -44.23 72.95 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.484 1.038 . . . . 0.0 113.387 176.776 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.82 -40.05 66.13 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.451 -0.781 . . . . 0.0 111.804 177.003 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.34 -36.38 50.22 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 124.935 1.255 . . . . 0.0 114.348 -174.727 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -74.01 -5.38 41.04 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 118.632 1.216 . . . . 0.0 112.548 169.855 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 50.3 tp 72.27 112.56 0.06 Allowed 'General case' 0 C--N 1.343 0.303 0 C-N-CA 129.582 3.153 . . . . 0.0 112.751 166.891 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.6 t -70.93 23.8 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 127.272 2.229 . . . . 0.0 113.186 -175.38 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 84.78 -14.89 0.58 Allowed 'General case' 0 N--CA 1.472 0.656 0 O-C-N 119.726 -1.859 . . . . 0.0 114.314 121.697 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.425 HG13 ' O ' ' B' ' 92' ' ' VAL . 8.1 p -64.34 49.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 130.492 3.517 . . . . 0.0 112.058 167.741 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 63.38 13.41 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 126.682 1.993 . . . . 0.0 114.306 -176.388 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt 100.73 108.35 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 130.004 3.322 . . . . 0.0 107.686 -169.519 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.97 67.93 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 125.226 1.41 . . . . 0.0 113.022 171.181 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 12.4 t -69.73 144.73 13.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 124.974 1.309 . . . . 0.0 109.418 172.441 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -76.07 18.36 0.28 Allowed 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 115.024 1.491 . . . . 0.0 115.024 177.684 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.31 45.81 0.58 Allowed 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 164.884 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -57.96 131.52 50.68 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 125.025 1.33 . . . . 0.0 110.728 -163.911 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -139.22 139.02 21.73 Favored Pre-proline 0 CA--C 1.556 1.191 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.905 -161.751 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.3 151.62 72.63 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 125.132 3.888 . . . . 0.0 119.656 -163.369 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 1.5 t -88.33 164.98 15.3 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 129.224 3.009 . . . . 0.0 112.182 169.378 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 26.3 t 88.44 138.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 129.15 2.98 . . . . 0.0 108.757 179.297 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.67 69.28 1.75 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.154 1.782 . . . . 0.0 113.765 -174.456 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -62.03 132.82 54.17 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.652 168.893 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? . . . . . 0 CA--C 1.551 0.998 0 C-N-CA 124.485 1.114 . . . . 0.0 112.905 175.702 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.252 0 N-CA-C 111.833 0.308 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.8 mt -46.43 -63.22 1.06 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.576 1.15 . . . . 0.0 112.422 -179.205 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.23 9.94 4.11 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -178.472 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.42 -35.26 6.82 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.378 0.671 . . . . 0.0 111.781 167.339 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -61.05 -51.92 67.16 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.213 1.405 . . . . 0.0 110.254 176.921 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.67 -23.83 69.2 Favored Glycine 0 CA--C 1.534 1.255 0 O-C-N 121.136 -0.977 . . . . 0.0 113.058 173.489 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.18 -33.62 65.52 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 118.872 1.336 . . . . 0.0 110.761 172.714 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -79.99 -34.46 38.54 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.637 1.175 . . . . 0.0 113.542 177.846 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 mt -63.82 -41.88 97.76 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.705 0.802 . . . . 0.0 112.486 174.895 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -94.28 -10.01 34.2 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -173.474 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.429 ' CG ' ' HD2' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -51.76 147.22 12.14 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.006 1.722 . . . . 0.0 111.344 -178.845 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.429 ' HD2' ' CG ' ' A' ' 20' ' ' ASP . 55.8 Cg_endo -35.57 -79.13 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.709 1 C-N-CA 127.864 5.71 . . . . 0.0 113.112 -166.804 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.9 p -81.24 -22.26 38.89 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 116.42 -1.752 . . . . 0.0 113.23 178.385 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.4 mtm-85 -63.33 -45.6 90.55 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 121.531 1.968 . . . . 0.0 111.67 175.98 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 25.1 t -50.8 -48.63 59.51 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.611 1.096 . . . . 0.0 110.749 169.545 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.1 mtm-85 -62.41 -47.75 82.72 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.467 1.107 . . . . 0.0 113.521 176.997 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.1 mm -53.13 -47.11 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.613 1.565 . . . . 0.0 110.863 170.319 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.567 HD22 HD21 ' A' ' 77' ' ' LEU . 48.8 mt -70.15 -43.02 71.74 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 117.746 -1.121 . . . . 0.0 112.769 -177.711 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.4 p -73.0 -25.99 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 119.95 1.25 . . . . 0.0 111.195 179.21 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.49 -12.95 59.48 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.743 1.217 . . . . 0.0 113.014 169.473 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.496 ' O ' HG13 ' A' ' 34' ' ' VAL . 13.1 tp -82.42 -36.49 26.61 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 116.948 -1.501 . . . . 0.0 112.139 169.223 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -43.48 -58.17 2.73 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.005 2.122 . . . . 0.0 112.881 -175.463 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -98.22 9.28 43.33 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.662 1.585 . . . . 0.0 112.403 172.975 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -108.54 -33.89 2.79 Favored Glycine 0 C--N 1.342 0.865 0 CA-C-O 114.585 -3.342 . . . . 0.0 117.92 -168.344 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.496 HG13 ' O ' ' A' ' 30' ' ' LEU . 33.9 m -15.59 43.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.069 2 C-N-CA 132.251 4.22 . . . . 0.0 122.122 175.801 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.8 m -95.78 -60.39 1.66 Allowed 'General case' 0 C--N 1.327 -0.386 0 O-C-N 118.763 -2.461 . . . . 0.0 111.514 178.205 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -146.41 151.55 43.9 Favored Pre-proline 0 N--CA 1.476 0.845 0 N-CA-C 116.633 2.086 . . . . 0.0 116.633 -169.214 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -63.83 133.1 37.45 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 123.479 2.786 . . . . 0.0 110.744 178.321 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.5 -2.62 52.52 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-O 118.753 -1.026 . . . . 0.0 114.444 -176.882 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -58.52 -28.91 65.88 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.344 1.572 . . . . 0.0 112.882 179.272 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mp -69.25 -2.52 10.81 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 122.481 0.312 . . . . 0.0 111.499 -172.067 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.99 -38.16 90.05 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.13 0.572 . . . . 0.0 110.541 169.091 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.94 -36.06 64.63 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.441 0.697 . . . . 0.0 111.999 170.708 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -66.73 -36.52 82.67 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 177.301 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.1 mt -105.03 -20.72 13.44 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -172.563 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.79 11.22 83.49 Favored Glycine 0 CA--C 1.537 1.416 0 CA-C-N 119.46 1.027 . . . . 0.0 113.091 -168.451 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.5 mt -100.75 148.18 25.19 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.697 1.199 . . . . 0.0 111.46 -176.963 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.435 HG23 ' H ' ' A' ' 50' ' ' ASN . 4.2 t -61.15 144.04 54.38 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 122.16 0.981 . . . . 0.0 111.891 -172.84 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.78 -20.15 54.91 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.222 1.009 . . . . 0.0 113.589 179.468 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.5 p -70.78 -60.12 2.42 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.442 1.019 . . . . 0.0 109.414 167.083 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.435 ' H ' HG23 ' A' ' 47' ' ' THR . 18.5 t-20 -54.32 -42.08 69.76 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.71 1.604 . . . . 0.0 114.684 178.481 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 5.0 t -64.32 -41.21 91.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 O-C-N 119.876 -1.765 . . . . 0.0 111.813 171.898 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 55.0 m -62.45 -43.36 99.01 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 119.159 0.89 . . . . 0.0 112.071 173.612 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -55.74 -45.36 78.02 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 127.004 2.121 . . . . 0.0 112.261 175.678 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 23.6 m170 -64.33 -40.51 96.04 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.149 -0.969 . . . . 0.0 112.863 171.693 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.6 mt -67.36 -25.32 65.92 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 118.691 0.678 . . . . 0.0 112.349 178.068 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.3 m -62.08 -44.76 95.97 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.213 1.37 . . . . 0.0 114.364 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 42.8 t -60.37 -54.0 50.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.975 1.31 . . . . 0.0 110.482 169.508 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.437 ' HG ' HD21 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -51.22 -42.59 61.06 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 128.535 2.734 . . . . 0.0 113.677 -177.668 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 9.1 mtm-85 -83.26 -4.4 58.39 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.538 1.535 . . . . 0.0 113.143 178.802 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -110.05 -26.31 5.0 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 126.236 1.874 . . . . 0.0 114.107 174.092 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 2.6 m -74.51 -1.46 21.44 Favored 'General case' 0 CA--C 1.564 1.504 0 C-N-CA 129.928 3.291 . . . . 0.0 111.724 168.86 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.82 14.45 37.37 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 126.184 1.849 . . . . 0.0 113.571 -175.122 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.9 mt -69.07 -30.23 68.51 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.458 -1.025 . . . . 0.0 111.676 172.777 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.8 t -134.43 132.44 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.902 0.881 . . . . 0.0 112.814 -167.472 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 89.0 t -126.61 141.13 46.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 126.058 1.743 . . . . 0.0 111.098 -168.074 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -93.68 148.7 21.86 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.202 1.401 . . . . 0.0 113.045 173.99 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.8 m -169.61 152.77 4.78 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.649 1.98 . . . . 0.0 107.119 -175.713 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -79.91 141.42 36.1 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 119.853 1.206 . . . . 0.0 112.895 174.788 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.263 0.0 OUTLIER -89.47 -17.94 27.7 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 122.603 0.361 . . . . 0.0 111.444 166.588 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 123.0 -30.26 5.1 Favored Glycine 0 N--CA 1.474 1.208 0 C-N-CA 126.592 2.044 . . . . 0.0 114.24 169.444 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.38 -15.96 14.88 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 128.226 2.611 . . . . 0.0 112.08 172.919 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -158.6 167.0 30.75 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 129.397 3.079 . . . . 0.0 109.469 -176.256 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 6.0 p -91.96 150.62 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.221 1.009 . . . . 0.0 109.908 168.543 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 12.3 ptt85 -126.49 163.93 22.28 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.95 0.881 . . . . 0.0 111.405 -176.422 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -111.28 156.41 21.55 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 114.294 -1.321 . . . . 0.0 107.584 164.519 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.474 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -163.19 151.22 13.57 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.143 0.977 . . . . 0.0 109.902 -176.413 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.567 HD21 HD22 ' A' ' 27' ' ' LEU . 14.5 mt -57.44 152.14 15.11 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 119.009 0.822 . . . . 0.0 109.02 167.314 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.14 -33.11 73.87 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -170.065 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -169.85 163.21 9.66 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.396 1.478 . . . . 0.0 112.684 -174.243 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 98.3 p -42.69 -33.81 0.79 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 128.491 2.717 . . . . 0.0 114.34 166.931 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -52.98 -52.09 59.42 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.864 1.666 . . . . 0.0 112.25 170.494 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 35.2 mt -73.0 -39.66 65.85 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 118.934 -0.555 . . . . 0.0 109.794 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.46 -44.52 72.61 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.441 1.096 . . . . 0.0 113.295 178.905 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -65.71 -49.8 67.18 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 120.007 1.276 . . . . 0.0 112.615 178.865 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.81 -44.99 83.98 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.46 1.027 . . . . 0.0 112.471 -179.46 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -64.84 -37.88 89.09 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.879 0.872 . . . . 0.0 110.714 176.605 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.9 -22.06 64.11 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 126.118 1.818 . . . . 0.0 114.102 176.996 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -115.75 23.5 12.25 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.129 1.372 . . . . 0.0 112.659 170.098 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.536 ' O ' HG13 ' A' ' 90' ' ' VAL . 30.6 tp 76.53 -38.85 0.33 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 128.969 2.908 . . . . 0.0 112.92 171.205 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.536 HG13 ' O ' ' A' ' 89' ' ' LEU . 2.6 m 160.96 -19.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.262 1 C-N-CA 132.312 4.245 . . . . 0.0 111.207 -170.389 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 93.59 -8.18 0.14 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 129.486 3.115 . . . . 0.0 113.533 175.96 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.1 p -66.85 41.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 C-N-CA 128.105 2.562 . . . . 0.0 116.646 -172.339 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER 71.09 13.5 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 C-N-CA 126.56 1.944 . . . . 0.0 112.371 174.138 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 88.91 95.13 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 130.111 3.364 . . . . 0.0 108.883 179.521 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.4 139.8 49.88 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.155 179.156 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.4 m -85.34 152.87 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 122.378 1.085 . . . . 0.0 111.492 179.239 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -79.84 12.35 2.72 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.472 1.509 . . . . 0.0 114.925 -168.749 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.9 m -104.29 47.35 0.88 Allowed 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.587 1.555 . . . . 0.0 109.863 -176.243 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -49.93 88.57 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 129.123 2.969 . . . . 0.0 113.14 -167.734 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -106.96 152.88 41.11 Favored Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 113.998 1.111 . . . . 0.0 113.998 -164.985 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -88.58 117.94 0.98 Allowed 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 122.087 1.858 . . . . 0.0 113.746 -175.24 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . 0.558 3.3 t 43.17 -179.18 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 111.344 -2.662 . . . . 0.0 113.854 -161.302 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 3.6 p -169.38 -16.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 CA-C-N 110.531 -3.031 . . . . 0.0 112.701 -155.855 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.48 110.26 7.64 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 166.037 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 81.85 -43.51 0.16 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.849 2.06 . . . . 0.0 112.338 177.082 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.545 0.76 0 C-N-CA 125.457 1.503 . . . . 0.0 113.945 -173.274 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.724 0 N-CA-C 116.154 1.909 . . . . 0.0 116.154 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 87.8 mt -119.73 -82.6 0.65 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.797 1.639 . . . . 0.0 109.18 171.712 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.28 -4.24 13.59 Favored 'General case' 0 CA--C 1.549 0.904 0 O-C-N 120.71 -1.244 . . . . 0.0 114.104 172.525 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.74 -43.74 13.11 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 120.597 -1.314 . . . . 0.0 109.038 163.078 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.12 -49.1 73.51 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.148 1.779 . . . . 0.0 111.21 -174.539 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.56 -7.27 46.34 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 123.866 0.746 . . . . 0.0 114.443 172.618 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.38 -45.22 9.63 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.158 1.383 . . . . 0.0 108.75 168.143 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.16 -42.35 76.03 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.187 1.795 . . . . 0.0 114.446 -176.867 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -39.54 94.49 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.147 0.979 . . . . 0.0 111.29 178.59 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -98.37 -2.99 37.97 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.929 1.291 . . . . 0.0 114.449 -173.415 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 20' ' ' ASP . . . . . 0.481 ' CG ' ' HD2' ' B' ' 21' ' ' PRO . 0.3 OUTLIER -55.12 147.72 33.45 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 125.623 1.569 . . . . 0.0 112.525 177.882 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 21' ' ' PRO . . . . . 0.481 ' HD2' ' CG ' ' B' ' 20' ' ' ASP . 41.0 Cg_endo -37.66 -69.89 0.07 OUTLIER 'Trans proline' 0 C--N 1.354 0.824 1 C-N-CA 127.416 5.411 . . . . 0.0 113.407 -167.629 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.407 ' H ' ' HG2' ' B' ' 21' ' ' PRO . 2.2 p -90.65 -20.7 22.22 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 125.863 1.665 . . . . 0.0 112.95 179.731 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 9.3 mtm-85 -66.34 -42.85 87.56 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 121.493 1.951 . . . . 0.0 111.848 177.266 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 40.5 t -54.61 -49.67 69.91 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.36 0.982 . . . . 0.0 110.97 169.88 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -58.05 -54.23 49.34 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.157 0.983 . . . . 0.0 112.65 177.178 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 4.4 mm -45.76 -54.02 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 126.221 1.808 . . . . 0.0 111.175 169.87 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.592 HD22 HD21 ' B' ' 77' ' ' LEU . 42.5 mt -68.3 -37.44 80.61 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 117.806 -1.093 . . . . 0.0 113.434 -173.72 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.1 p -76.2 -27.4 17.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 CA-C-N 119.731 1.151 . . . . 0.0 111.434 176.961 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.97 -23.06 52.34 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.107 0.963 . . . . 0.0 112.858 173.075 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.435 ' O ' HG13 ' B' ' 34' ' ' VAL . 5.5 tp -73.5 -33.51 64.83 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 119.807 1.185 . . . . 0.0 113.76 171.187 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -45.52 -54.51 7.4 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.03 2.132 . . . . 0.0 113.299 -168.781 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -97.2 -11.42 24.26 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.415 1.486 . . . . 0.0 112.138 169.507 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -97.61 2.51 60.61 Favored Glycine 0 C--N 1.342 0.889 0 CA-C-O 116.64 -2.2 . . . . 0.0 118.235 -167.907 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 34' ' ' VAL . . . . . 0.435 HG13 ' O ' ' B' ' 30' ' ' LEU . 29.7 m -38.49 40.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.059 1 C-N-CA 131.81 4.044 . . . . 0.0 119.014 167.537 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 51.2 m -83.78 -74.5 0.37 Allowed 'General case' 0 C--O 1.223 -0.318 0 O-C-N 119.713 -1.867 . . . . 0.0 111.309 179.173 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.51 163.39 50.21 Favored Pre-proline 0 CA--C 1.547 0.829 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -169.889 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -63.1 130.18 28.12 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.158 1.906 . . . . 0.0 110.104 178.881 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.35 5.62 67.59 Favored Glycine 0 CA--C 1.538 1.49 0 CA-C-O 118.133 -1.371 . . . . 0.0 115.708 -178.304 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -25.2 64.43 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 120.124 1.962 . . . . 0.0 113.24 -177.457 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.8 mt -52.96 -20.1 3.13 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 125.946 1.698 . . . . 0.0 112.01 176.712 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.36 -30.44 70.53 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.312 0.645 . . . . 0.0 112.532 177.738 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.99 -50.82 11.38 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.39 0.676 . . . . 0.0 110.791 169.43 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -55.37 -38.38 68.76 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 -177.798 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.2 mt -96.83 -19.65 18.73 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.707 1.603 . . . . 0.0 112.756 -177.125 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.07 11.66 67.32 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-N 119.205 0.911 . . . . 0.0 113.2 -168.997 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 97.0 mt -102.13 141.11 35.5 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.115 1.366 . . . . 0.0 110.973 -174.276 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.401 HG23 ' H ' ' B' ' 50' ' ' ASN . 4.0 t -57.69 143.09 42.94 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.158 0.98 . . . . 0.0 112.186 -171.23 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.94 -19.13 39.96 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.755 1.222 . . . . 0.0 113.634 -179.463 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 7.5 p -72.29 -62.8 1.31 Allowed 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.656 1.116 . . . . 0.0 109.255 166.904 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 50' ' ' ASN . . . . . 0.401 ' H ' HG23 ' B' ' 47' ' ' THR . 10.1 t-20 -46.99 -46.84 21.95 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.433 1.493 . . . . 0.0 113.658 176.091 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.87 -40.52 89.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 O-C-N 120.474 -1.391 . . . . 0.0 112.661 175.507 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.0 m -66.74 -37.81 85.38 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 118.588 0.631 . . . . 0.0 111.645 176.156 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 9.5 m-20 -58.96 -45.03 91.51 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.0 1.72 . . . . 0.0 112.19 173.322 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -64.63 -40.93 96.33 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 120.403 -1.435 . . . . 0.0 112.967 172.129 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 49.6 mt -67.3 -31.32 71.53 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 179.291 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 37.6 m -61.22 -28.11 68.92 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -178.569 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 47.8 t -71.36 -51.31 24.89 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.075 0.95 . . . . 0.0 110.747 169.379 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.412 ' HB3' HG22 ' B' ' 64' ' ' VAL . 4.5 mp -63.43 -40.3 96.81 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.389 2.275 . . . . 0.0 112.746 -171.957 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 60.7 mtm-85 -75.06 -5.7 45.53 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.593 1.157 . . . . 0.0 112.965 174.321 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -104.53 -38.07 2.68 Favored Glycine 0 N--CA 1.472 1.07 0 C-N-CA 124.718 1.151 . . . . 0.0 112.146 171.809 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 7.3 m -61.51 -6.94 2.69 Favored 'General case' 0 CA--C 1.56 1.353 0 C-N-CA 128.349 2.66 . . . . 0.0 113.409 169.471 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.02 13.66 62.21 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 125.217 1.389 . . . . 0.0 113.716 -175.561 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 83.6 mt -70.94 -26.12 63.04 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.593 1.196 . . . . 0.0 112.632 178.003 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.412 HG22 ' HB3' ' B' ' 58' ' ' LEU . 2.6 m -141.41 142.8 28.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.353 1.461 . . . . 0.0 111.558 -174.595 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 68.9 t -122.83 140.19 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 127.433 2.293 . . . . 0.0 109.253 -174.335 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -92.97 146.5 23.57 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.343 1.057 . . . . 0.0 112.425 170.126 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 2.4 m -167.47 168.42 12.97 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.079 2.151 . . . . 0.0 107.534 -172.888 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.44 ' HA ' ' HA ' ' B' ' 73' ' ' VAL . 13.0 m-85 -81.19 155.35 26.2 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 174.746 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.04 -26.58 14.19 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.629 0.772 . . . . 0.0 109.144 162.28 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 141.19 -31.74 2.14 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 127.575 2.512 . . . . 0.0 113.738 171.412 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.58 -18.9 11.82 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 129.518 3.127 . . . . 0.0 112.503 178.604 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -150.72 167.71 26.55 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 129.696 3.198 . . . . 0.0 109.026 -179.576 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 73' ' ' VAL . . . . . 0.44 ' HA ' ' HA ' ' B' ' 68' ' ' TYR . 14.3 m -85.1 165.31 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 O-C-N 121.666 -0.646 . . . . 0.0 111.087 167.544 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 21.6 ptt85 -138.11 167.91 20.82 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 127.07 2.148 . . . . 0.0 109.872 -179.438 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -119.02 133.03 56.07 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.738 1.215 . . . . 0.0 108.326 168.167 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.432 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -136.25 151.25 49.47 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.479 1.112 . . . . 0.0 109.82 179.097 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.592 HD21 HD22 ' B' ' 27' ' ' LEU . 13.0 mt -55.5 149.0 14.32 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 168.735 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.43 -36.59 82.89 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -169.903 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -162.34 163.37 27.95 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.624 1.57 . . . . 0.0 112.23 178.366 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 95.6 p -44.22 -32.47 1.27 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.109 2.564 . . . . 0.0 113.546 167.643 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -52.89 -49.71 65.34 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 125.245 1.418 . . . . 0.0 112.507 170.512 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 21.4 mt -72.47 -46.94 52.48 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.964 0.802 . . . . 0.0 109.636 179.11 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.17 -40.2 64.18 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 117.776 -1.107 . . . . 0.0 113.738 -177.041 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -69.48 -47.35 64.18 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 120.408 1.458 . . . . 0.0 113.385 178.248 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.1 -43.26 95.89 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 118.928 0.785 . . . . 0.0 111.192 -179.267 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.54 -52.3 64.18 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.776 1.63 . . . . 0.0 110.374 170.919 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.94 -14.03 58.1 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.812 1.196 . . . . 0.0 114.567 -176.048 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . 0.257 20.7 pt-20 -114.91 18.48 16.42 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 169.876 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 21.4 tp 63.66 2.12 1.2 Allowed 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 128.522 2.729 . . . . 0.0 115.361 167.269 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 1.7 t 74.31 33.47 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 126.586 1.954 . . . . 0.0 110.37 -171.511 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 91' ' ' GLN . . . . . 0.405 ' C ' ' H ' ' B' ' 93' ' ' VAL . 0.8 OUTLIER 81.68 -14.07 0.83 Allowed 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 115.241 1.571 . . . . 0.0 115.241 118.417 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 13.1 p -67.46 39.09 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 129.558 3.143 . . . . 0.0 113.415 174.103 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 93' ' ' VAL . . . . . 0.405 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.2 OUTLIER 72.44 26.67 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 128.063 2.545 . . . . 0.0 113.182 177.001 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 84.36 90.15 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.77 2.028 . . . . 0.0 109.368 -177.724 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.47 149.52 45.89 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 114.521 -1.218 . . . . 0.0 113.421 178.517 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 30.2 m -56.91 156.05 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 125.625 1.57 . . . . 0.0 113.88 176.301 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -83.16 64.22 7.58 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.54 1.136 . . . . 0.0 109.927 169.87 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 41.8 m -160.09 148.09 16.77 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.579 1.551 . . . . 0.0 111.084 -174.062 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -116.8 137.82 51.93 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.831 1.652 . . . . 0.0 107.44 166.222 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -160.95 170.49 8.36 Favored Pre-proline 0 CA--C 1.557 1.233 0 CA-C-O 117.386 -1.292 . . . . 0.0 111.38 -167.566 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -95.36 120.22 0.26 Allowed 'Trans proline' 0 C--N 1.358 1.064 0 CA-C-N 122.315 1.863 . . . . 0.0 116.549 -167.27 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 28.7 t 45.68 -113.03 0.38 Allowed 'General case' 0 C--N 1.347 0.489 0 N-CA-C 105.279 -2.119 . . . . 0.0 105.279 -163.703 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 5.4 p 165.71 -33.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.843 0 C-N-CA 130.313 3.445 . . . . 0.0 111.758 168.758 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.42 123.73 15.71 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.29 0.95 . . . . 0.0 111.077 178.376 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 69.2 -49.21 0.6 Allowed 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 128.681 2.792 . . . . 0.0 113.019 -174.156 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.656 0 CA-C-O 123.157 1.456 . . . . 0.0 113.711 -170.001 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.351 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.71 -38.2 66.77 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.596 0.759 . . . . 0.0 111.317 168.801 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.79 -18.22 60.5 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.281 1.832 . . . . 0.0 113.946 179.504 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.31 -57.23 3.46 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.464 1.105 . . . . 0.0 109.195 167.402 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -55.25 -63.53 1.13 Allowed 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 126.645 1.978 . . . . 0.0 110.331 -174.225 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -60.81 -36.21 91.5 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.641 -0.583 . . . . 0.0 111.641 -172.281 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 16.3 ttt85 -67.33 -50.97 57.88 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.839 0.856 . . . . 0.0 111.226 179.761 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.85 -27.02 67.79 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 176.641 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.4 mp -90.98 -12.47 35.81 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.447 1.099 . . . . 0.0 113.567 174.282 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.56 -20.15 40.52 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.7 1.2 . . . . 0.0 114.058 169.888 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -72.63 140.41 81.57 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 126.835 2.054 . . . . 0.0 109.424 174.261 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -53.03 -84.89 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.647 1 C-N-CA 126.696 4.931 . . . . 0.0 113.738 -166.621 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 52.1 m -70.3 -15.43 62.89 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 124.551 1.141 . . . . 0.0 111.134 -179.701 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -68.63 -40.2 80.42 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 120.378 -1.452 . . . . 0.0 113.312 -177.854 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 13.2 t -59.28 -40.21 85.38 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 121.806 0.812 . . . . 0.0 110.806 169.432 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.484 ' HB3' HD22 ' A' ' 44' ' ' LEU . 12.4 mmp_? -66.64 -41.27 88.54 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 172.879 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.424 HD11 ' HA ' ' A' ' 51' ' ' VAL . 5.1 mm -50.63 -44.38 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 120.077 -1.639 . . . . 0.0 111.412 171.328 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.26 -24.95 67.46 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 175.28 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -78.66 -29.51 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 124.77 1.228 . . . . 0.0 112.729 171.25 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.89 -32.46 63.6 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.494 0.717 . . . . 0.0 112.717 178.855 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.471 HD23 HG11 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -85.92 -10.42 55.26 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 173.226 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.07 -23.52 63.83 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-O 119.505 -0.283 . . . . 0.0 111.401 165.622 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -124.19 -59.52 1.48 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 127.768 2.427 . . . . 0.0 114.564 -171.92 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.05 -74.77 0.63 Allowed Glycine 0 N--CA 1.468 0.818 0 C-N-CA 125.354 1.455 . . . . 0.0 113.226 -165.86 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.9 m 45.88 33.66 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 C-N-CA 125.851 1.66 . . . . 0.0 113.815 -179.001 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.2 m -82.61 -51.63 7.57 Favored 'General case' 0 C--O 1.226 -0.157 0 O-C-N 120.932 -1.105 . . . . 0.0 112.046 -175.56 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 50.3 p90 -165.69 157.2 12.42 Favored Pre-proline 0 N--CA 1.477 0.894 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -169.78 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -61.73 104.43 0.32 Allowed 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 123.868 3.045 . . . . 0.0 110.128 173.937 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 113.86 -11.5 22.87 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-O 118.021 -1.433 . . . . 0.0 114.651 -175.01 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.72 -34.08 69.11 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.651 2.226 . . . . 0.0 111.349 175.079 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.688 HD12 ' H ' ' A' ' 40' ' ' LEU . 0.5 OUTLIER -62.8 -21.06 65.61 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 126.22 1.808 . . . . 0.0 111.985 -178.317 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.19 -30.02 69.02 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.431 0.692 . . . . 0.0 111.786 -179.581 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.37 -44.85 61.97 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.527 0.331 . . . . 0.0 110.344 169.87 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -62.59 -35.53 79.82 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -179.174 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.484 HD22 ' HB3' ' A' ' 25' ' ' ARG . 26.0 mt -103.27 -16.38 15.69 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -174.363 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.56 -2.08 54.99 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-O 118.072 -1.404 . . . . 0.0 114.341 -175.409 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 mp -105.6 148.43 27.32 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.561 1.68 . . . . 0.0 110.947 177.23 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.444 HG23 ' H ' ' A' ' 50' ' ' ASN . 13.5 t -54.83 151.24 8.77 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.356 1.063 . . . . 0.0 113.005 -173.252 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -50.13 -23.25 2.04 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.054 1.741 . . . . 0.0 113.839 169.498 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 14.7 m -69.22 -56.99 5.96 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.461 1.028 . . . . 0.0 111.85 170.395 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.444 ' H ' HG23 ' A' ' 47' ' ' THR . 16.0 t-20 -61.9 -42.85 99.56 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.461 1.028 . . . . 0.0 112.074 176.113 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.424 ' HA ' HD11 ' A' ' 26' ' ' ILE . 2.5 t -53.26 -48.16 55.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 123.834 0.854 . . . . 0.0 111.166 172.01 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 51.1 m -66.26 -35.96 81.75 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 177.559 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -60.4 -52.46 65.13 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.006 0.922 . . . . 0.0 110.097 176.579 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -68.36 -27.38 66.2 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 120.332 -1.48 . . . . 0.0 113.777 176.648 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 36.4 mt -70.42 -20.86 62.89 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 120.378 1.444 . . . . 0.0 113.311 167.862 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.2 t -63.19 -51.81 64.86 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 120.189 1.359 . . . . 0.0 112.973 -169.175 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 42.0 t -54.74 -51.25 66.25 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 123.956 1.836 . . . . 0.0 110.018 174.822 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.411 ' HB3' ' CG2' ' A' ' 64' ' ' VAL . 1.0 OUTLIER -48.36 -41.48 28.8 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 130.797 3.639 . . . . 0.0 113.628 -177.081 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 80.1 mtm-85 -78.86 -24.14 44.52 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 179.423 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.12 -54.69 2.1 Favored Glycine 0 N--CA 1.471 0.974 0 CA-C-N 119.181 0.9 . . . . 0.0 111.271 177.78 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 73.0 m -67.29 -3.69 8.69 Favored 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 127.119 2.168 . . . . 0.0 112.135 -178.853 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 86.01 10.57 74.99 Favored Glycine 0 C--N 1.34 0.792 0 C-N-CA 127.293 2.378 . . . . 0.0 116.304 164.791 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.8 mt -70.56 -22.75 62.56 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 119.6 1.7 . . . . 0.0 113.127 178.024 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.471 HG11 HD23 ' A' ' 30' ' ' LEU . 2.8 m -133.53 156.13 41.2 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 126.952 2.101 . . . . 0.0 113.088 171.454 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.3 t -133.47 153.44 37.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 127.744 2.418 . . . . 0.0 109.748 -179.57 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.52 145.65 26.02 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.822 1.649 . . . . 0.0 112.512 175.224 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.466 ' HB ' ' HG2' ' A' ' 74' ' ' ARG . 9.6 m -140.86 144.66 35.43 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.677 1.191 . . . . 0.0 109.285 -177.836 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -80.75 115.86 20.46 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.985 0.421 . . . . 0.0 110.803 167.89 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -88.54 166.08 14.41 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.25 1.42 . . . . 0.0 110.531 168.854 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -66.69 15.28 0.32 Allowed Glycine 0 N--CA 1.481 1.677 0 N-CA-C 117.035 1.574 . . . . 0.0 117.035 -169.59 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.61 -1.13 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.831 2.053 . . . . 0.0 114.185 178.229 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -168.55 164.8 12.49 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 126.172 1.789 . . . . 0.0 108.783 -168.959 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 34.5 m -94.68 156.42 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 CA-C-N 119.856 1.207 . . . . 0.0 110.626 168.834 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.466 ' HG2' ' HB ' ' A' ' 67' ' ' THR . 9.8 ptt180 -127.26 178.34 6.11 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.379 1.071 . . . . 0.0 112.65 -179.424 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -124.7 128.82 49.4 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.367 1.467 . . . . 0.0 108.384 165.236 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.02 157.43 41.73 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.291 1.037 . . . . 0.0 109.946 173.83 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.474 ' HB3' ' CD1' ' A' ' 82' ' ' LEU . 0.3 OUTLIER -66.61 153.6 42.65 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.339 0.518 . . . . 0.0 109.813 170.968 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.02 -36.18 79.52 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -168.584 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -158.71 158.81 34.42 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 123.378 1.561 . . . . 0.0 113.244 176.641 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -35.21 -39.23 0.11 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 130.25 3.42 . . . . 0.0 112.701 165.724 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -44.29 -66.12 0.43 Allowed 'General case' 0 C--N 1.342 0.275 0 C-N-CA 127.862 2.465 . . . . 0.0 112.647 169.519 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.474 ' CD1' ' HB3' ' A' ' 77' ' ' LEU . 1.2 pp -79.39 -25.39 42.15 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 118.576 -0.726 . . . . 0.0 112.626 -172.502 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.48 -45.77 89.23 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 122.71 0.404 . . . . 0.0 110.428 167.855 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 24.7 ttp85 -62.87 -54.0 45.54 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.618 1.167 . . . . 0.0 111.968 178.063 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.48 -35.97 79.14 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -175.707 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.25 -42.02 66.12 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.567 -0.708 . . . . 0.0 111.009 172.894 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.05 -43.88 98.16 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.824 1.678 . . . . 0.0 114.585 -178.409 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -76.06 -2.02 28.75 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.556 1.142 . . . . 0.0 113.482 174.263 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 34.2 tp 76.08 124.8 0.04 OUTLIER 'General case' 0 C--N 1.345 0.378 0 C-N-CA 130.136 3.374 . . . . 0.0 110.914 168.473 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 46.4 t -75.62 21.69 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 CA-C-O 123.465 1.602 . . . . 0.0 112.233 -169.521 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 84.99 -12.63 0.71 Allowed 'General case' 0 C--O 1.219 -0.534 0 O-C-N 120.038 -1.664 . . . . 0.0 111.467 130.662 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 12.7 p -68.35 46.81 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 C-N-CA 129.75 3.22 . . . . 0.0 111.14 164.672 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 69.71 -42.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 C-N-CA 130.486 3.514 . . . . 0.0 112.806 -169.893 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.1 tt 168.14 104.69 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 130.674 3.59 . . . . 0.0 106.03 -169.486 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.98 82.57 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.122 0 O-C-N 121.285 -0.885 . . . . 0.0 112.147 169.163 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 18.0 m -45.21 163.41 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 130.302 3.441 . . . . 0.0 116.788 -178.482 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -90.62 73.12 6.79 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.311 1.444 . . . . 0.0 109.263 166.444 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . 0.261 0.3 OUTLIER 172.8 138.83 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 128.477 2.711 . . . . 0.0 112.836 168.454 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -88.34 26.56 1.4 Allowed 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 130.526 3.53 . . . . 0.0 113.34 -171.244 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -33.43 134.82 0.32 Allowed Pre-proline 0 N--CA 1.483 1.176 0 C-N-CA 126.529 1.932 . . . . 0.0 112.821 -174.801 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -60.24 149.14 87.08 Favored 'Trans proline' 0 C--N 1.355 0.9 1 C-N-CA 126.12 4.546 . . . . 0.0 118.997 -164.94 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.12 121.6 15.97 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.286 1.434 . . . . 0.0 109.551 170.135 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 9.5 p -105.59 -38.91 4.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 -165.825 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -87.5 -7.91 57.04 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.738 1.154 . . . . 0.0 113.936 177.912 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -127.24 124.41 38.83 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 125.288 1.435 . . . . 0.0 108.289 170.315 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? . . . . . 0 CA--C 1.535 0.387 0 C-N-CA 124.928 1.291 . . . . 0.0 111.241 -168.669 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.456 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -54.29 -42.93 70.61 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.844 0.858 . . . . 0.0 112.065 169.992 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.26 -17.06 63.1 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.451 1.501 . . . . 0.0 112.967 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.43 -55.33 4.21 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.928 0.891 . . . . 0.0 110.216 167.439 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -54.93 -61.72 2.13 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.47 1.508 . . . . 0.0 110.716 -176.136 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.61 -38.63 95.93 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 111.781 -0.528 . . . . 0.0 111.781 -170.68 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 14.2 ttm105 -60.49 -48.51 81.46 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.704 1.602 . . . . 0.0 111.108 176.547 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.16 -29.94 69.78 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 177.51 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.0 mp -88.84 -8.0 55.11 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 113.858 1.058 . . . . 0.0 113.858 175.614 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -88.22 -15.64 35.39 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.637 1.575 . . . . 0.0 114.362 172.803 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -78.0 146.0 70.81 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 126.301 1.84 . . . . 0.0 110.825 174.33 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -59.13 -82.03 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.67 1 C-N-CA 126.474 4.783 . . . . 0.0 112.55 -168.974 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 5.7 m -59.42 -29.58 67.86 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.155 0.982 . . . . 0.0 111.114 176.48 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.407 ' HE ' ' HA ' ' B' ' 54' ' ' HIS . 11.0 ttm180 -66.74 -41.03 88.5 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -171.444 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 5.3 t -57.78 -47.24 83.12 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-O 122.238 1.018 . . . . 0.0 110.152 169.565 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 25' ' ' ARG . . . . . 0.436 ' HB3' HD22 ' B' ' 44' ' ' LEU . 11.2 mmp_? -63.05 -36.43 83.55 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.561 1.689 . . . . 0.0 115.561 175.911 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 4.8 mm -49.64 -41.4 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 120.319 -1.488 . . . . 0.0 111.91 173.283 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 83.0 mt -72.67 -29.62 63.57 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 112.808 0.669 . . . . 0.0 112.808 176.434 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 28' ' ' VAL . . . . . 0.426 HG23 HD22 ' B' ' 86' ' ' LEU . 0.3 OUTLIER -78.19 -25.59 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 O-C-N 120.585 -1.322 . . . . 0.0 112.096 176.46 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.77 -57.61 4.9 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.495 1.518 . . . . 0.0 108.822 168.337 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.411 HD12 HG11 ' B' ' 64' ' ' VAL . 10.4 mt -61.24 -23.38 65.6 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 117.163 2.282 . . . . 0.0 117.163 -176.126 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 31' ' ' LEU . . . . . 0.593 ' HA ' HD11 ' B' ' 77' ' ' LEU . 0.3 OUTLIER -42.5 -32.74 0.58 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 125.951 1.701 . . . . 0.0 112.109 168.427 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -120.05 -30.24 4.73 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 128.278 2.631 . . . . 0.0 112.324 168.563 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.8 21.55 1.58 Allowed Glycine 0 N--CA 1.465 0.633 0 C-N-CA 128.819 3.104 . . . . 0.0 115.39 -164.66 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 34' ' ' VAL . . . . . 0.575 HG12 ' HA ' ' B' ' 76' ' ' ALA . 13.3 m -64.87 29.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 C-N-CA 127.371 2.268 . . . . 0.0 114.613 173.818 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -85.17 -64.16 1.2 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.382 1.073 . . . . 0.0 111.457 -176.753 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 55.4 p90 -165.84 154.71 10.47 Favored Pre-proline 0 CA--C 1.545 0.751 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 -170.007 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -58.45 118.74 5.68 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 123.207 2.605 . . . . 0.0 109.894 175.971 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 94.22 -8.94 72.55 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-O 117.619 -1.656 . . . . 0.0 114.899 -174.64 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.67 -36.73 69.92 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 120.918 2.359 . . . . 0.0 110.545 172.855 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.694 ' H ' HD12 ' B' ' 40' ' ' LEU . 0.4 OUTLIER -61.6 -19.09 61.84 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 126.14 1.776 . . . . 0.0 112.361 -175.688 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.87 -31.27 71.76 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.145 0.578 . . . . 0.0 111.826 176.447 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.37 -43.81 59.9 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.661 0.384 . . . . 0.0 110.824 170.585 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -63.44 -33.41 75.51 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 44' ' ' LEU . . . . . 0.436 HD22 ' HB3' ' B' ' 25' ' ' ARG . 36.1 mt -104.35 -18.37 14.46 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.558 1.143 . . . . 0.0 113.725 -174.761 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.94 -0.72 61.48 Favored Glycine 0 CA--C 1.526 0.747 0 CA-C-O 118.156 -1.358 . . . . 0.0 113.756 -174.216 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 8.3 mp -107.2 143.32 35.59 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.031 1.415 . . . . 0.0 110.834 177.213 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.443 HG23 ' H ' ' B' ' 50' ' ' ASN . 9.8 t -51.35 149.97 3.78 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 126.189 1.796 . . . . 0.0 113.461 -173.295 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -49.12 -22.33 0.93 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.397 1.879 . . . . 0.0 113.458 169.372 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.4 m -67.22 -63.64 1.02 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.59 1.156 . . . . 0.0 112.374 169.516 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 50' ' ' ASN . . . . . 0.443 ' H ' HG23 ' B' ' 47' ' ' THR . 28.4 t-20 -65.04 -36.65 85.03 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.75 -1.219 . . . . 0.0 112.404 178.211 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.3 t -54.58 -48.79 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 122.963 0.505 . . . . 0.0 110.422 168.71 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.9 m -66.61 -38.81 87.76 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 117.809 -1.091 . . . . 0.0 113.926 177.508 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -54.36 -54.52 39.37 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.107 0.867 . . . . 0.0 109.692 174.57 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 54' ' ' HIS . . . . . 0.407 ' HA ' ' HE ' ' B' ' 23' ' ' ARG . 89.1 m-70 -70.9 -25.18 62.66 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.792 -1.193 . . . . 0.0 113.439 -178.872 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 32.0 mt -68.61 -25.52 64.89 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.436 1.471 . . . . 0.0 112.954 167.424 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.0 t -58.99 -55.79 30.65 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 119.983 1.265 . . . . 0.0 112.976 -169.44 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 40.5 t -53.46 -52.64 58.84 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 122.387 1.089 . . . . 0.0 109.476 172.655 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.4 tp -47.63 -38.16 14.14 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 128.293 2.637 . . . . 0.0 113.886 -174.291 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 25.2 mtm-85 -83.99 -32.62 24.88 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 119.684 1.129 . . . . 0.0 113.73 -179.211 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -83.3 -45.88 6.37 Favored Glycine 0 N--CA 1.467 0.755 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 -179.82 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 80.3 m -74.5 5.91 4.26 Favored 'General case' 0 CA--C 1.563 1.46 0 C-N-CA 127.484 2.313 . . . . 0.0 111.628 177.746 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.56 -6.46 83.38 Favored Glycine 0 C--N 1.344 1.01 0 C-N-CA 128.301 2.858 . . . . 0.0 119.078 165.594 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 59.9 mt -66.99 -26.93 67.05 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 119.366 1.583 . . . . 0.0 113.785 -172.713 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.411 HG11 HD12 ' B' ' 30' ' ' LEU . 11.1 m -132.01 161.09 41.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 126.767 2.027 . . . . 0.0 113.238 177.26 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 76.4 t -139.93 146.73 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 128.232 2.613 . . . . 0.0 109.877 -169.202 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -96.37 138.08 34.49 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.994 1.318 . . . . 0.0 111.605 170.493 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 9.5 m -146.88 147.19 30.56 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.097 1.359 . . . . 0.0 108.522 -174.465 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -77.11 138.03 39.28 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 175.778 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -112.17 164.71 12.88 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.385 1.874 . . . . 0.0 111.436 169.181 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.9 14.16 0.3 Allowed Glycine 0 N--CA 1.48 1.627 0 N-CA-C 117.271 1.669 . . . . 0.0 117.271 -168.952 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.92 -0.77 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.95 2.1 . . . . 0.0 113.849 178.907 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -168.79 167.08 11.3 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 126.561 1.945 . . . . 0.0 108.949 -168.225 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 35.2 m -93.74 159.34 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 119.818 1.19 . . . . 0.0 110.605 168.246 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 5.2 ptt180 -121.9 171.4 8.95 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 122.363 1.078 . . . . 0.0 112.508 178.154 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -119.94 112.62 19.41 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.469 -2.049 . . . . 0.0 105.469 165.227 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.575 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -110.14 167.58 10.07 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.599 1.16 . . . . 0.0 110.147 174.458 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.593 HD11 ' HA ' ' B' ' 31' ' ' LEU . 0.0 OUTLIER -85.82 150.9 24.23 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 169.678 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.21 -50.47 69.31 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -168.411 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -153.34 160.35 42.66 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 123.275 1.512 . . . . 0.0 112.921 -178.822 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -35.34 -40.5 0.15 Allowed 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 129.657 3.183 . . . . 0.0 111.671 165.521 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -42.75 -68.22 0.21 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.469 2.308 . . . . 0.0 112.397 169.184 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 2.3 pp -79.04 -22.98 44.61 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -172.418 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.22 -44.51 91.69 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 122.892 0.477 . . . . 0.0 110.606 166.937 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 28.6 ttp85 -64.44 -51.61 62.23 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.132 1.773 . . . . 0.0 112.6 178.835 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.31 -41.61 80.23 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.983 0.81 . . . . 0.0 112.691 -179.857 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.426 HD22 HG23 ' B' ' 28' ' ' VAL . 0.3 OUTLIER -70.6 -41.53 72.17 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 118.79 -0.624 . . . . 0.0 111.038 176.263 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.87 -44.65 95.8 Favored Glycine 0 CA--C 1.533 1.189 0 C-N-CA 125.42 1.486 . . . . 0.0 114.389 179.571 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -76.93 -2.3 33.0 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.82 1.248 . . . . 0.0 113.129 172.982 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 44.7 tp 70.65 112.09 0.05 Allowed 'General case' 0 C--N 1.341 0.224 0 C-N-CA 129.679 3.192 . . . . 0.0 111.992 168.409 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.4 t -69.97 26.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 C-N-CA 127.198 2.199 . . . . 0.0 113.232 -176.167 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 89.02 -14.24 0.35 Allowed 'General case' 0 N--CA 1.468 0.47 0 O-C-N 119.623 -1.923 . . . . 0.0 113.226 119.046 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 11.5 p -63.95 39.69 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 130.306 3.443 . . . . 0.0 113.633 169.321 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 63.41 24.53 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 127.244 2.218 . . . . 0.0 112.823 -175.742 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 98.49 112.48 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 129.928 3.291 . . . . 0.0 107.947 -173.443 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.49 78.53 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.866 0.866 . . . . 0.0 111.057 168.139 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 10.3 m -42.8 155.62 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 130.336 3.455 . . . . 0.0 116.764 -177.64 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 97' ' ' ASP . . . . . 0.423 ' CG ' HH11 ' B' ' 25' ' ' ARG . 19.4 m-20 -85.9 68.44 10.34 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.07 1.348 . . . . 0.0 110.647 167.873 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 174.68 126.29 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 128.706 2.803 . . . . 0.0 111.396 168.936 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -72.72 40.36 0.09 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 130.156 3.382 . . . . 0.0 113.72 178.218 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -36.37 132.85 0.62 Allowed Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 127.165 2.186 . . . . 0.0 111.545 -178.933 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -67.04 155.94 68.56 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 124.074 3.183 . . . . 0.0 115.675 -166.327 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.86 145.85 53.35 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 126.059 1.744 . . . . 0.0 111.797 177.675 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 48.2 t -95.46 -68.79 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.651 1.18 . . . . 0.0 112.55 -175.636 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -85.57 -7.86 58.62 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.813 2.153 . . . . 0.0 116.813 -168.137 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -131.89 139.78 48.87 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.454 1.102 . . . . 0.0 109.53 -178.135 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? . . . . . 0 N--CA 1.468 0.445 0 C-N-CA 123.523 0.729 . . . . 0.0 112.176 -169.697 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 pp -51.66 -39.2 57.76 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.786 1.634 . . . . 0.0 115.201 -170.427 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.84 -58.14 6.98 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 118.755 0.707 . . . . 0.0 111.724 175.639 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -62.28 -30.37 71.09 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 121.415 -0.803 . . . . 0.0 111.993 179.222 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.532 HD21 HD21 ' A' ' 63' ' ' LEU . 3.0 tm? -61.71 -43.41 98.91 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.798 1.639 . . . . 0.0 111.381 170.019 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -59.75 -29.25 66.93 Favored Glycine 0 N--CA 1.474 1.21 0 CA-C-N 119.548 1.067 . . . . 0.0 113.184 175.264 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.19 -27.37 64.45 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.085 0.954 . . . . 0.0 112.116 173.333 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.01 -26.13 62.1 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 120.104 1.32 . . . . 0.0 111.643 172.753 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.4 mp -83.21 -28.61 29.14 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.005 0.522 . . . . 0.0 111.389 172.71 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.7 -10.61 57.34 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 117.021 2.23 . . . . 0.0 117.021 -179.278 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.67 156.83 21.76 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 128.048 2.539 . . . . 0.0 114.098 -173.602 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.53 ' HG2' ' H ' ' A' ' 22' ' ' THR . 58.3 Cg_endo -53.65 -76.65 0.02 OUTLIER 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 124.532 3.488 . . . . 0.0 111.345 169.554 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.53 ' H ' ' HG2' ' A' ' 21' ' ' PRO . 57.9 m -87.37 -28.01 22.45 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 116.145 -1.883 . . . . 0.0 112.36 -172.528 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.3 mtt85 -64.15 -39.55 94.25 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 122.666 2.484 . . . . 0.0 111.589 172.668 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 15.2 t -57.66 -40.57 79.63 Favored 'General case' 0 CA--C 1.552 1.019 0 CA-C-N 121.466 1.939 . . . . 0.0 111.944 170.618 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -60.91 -55.82 28.49 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 121.129 -0.982 . . . . 0.0 112.081 173.688 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.4 mm -52.84 -42.82 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.96 1.704 . . . . 0.0 110.767 176.265 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 49.5 mt -68.21 -43.15 78.65 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.822 0.849 . . . . 0.0 112.869 178.714 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.2 p -68.37 -26.43 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 119.977 1.262 . . . . 0.0 111.806 177.471 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.66 1.67 9.73 Favored 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 127.242 2.217 . . . . 0.0 115.023 170.444 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.454 HD11 HG13 ' A' ' 64' ' ' VAL . 95.2 mt -99.23 -25.36 14.53 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.413 -1.429 . . . . 0.0 114.768 173.439 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.4 mt -59.4 -24.02 63.09 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.629 -1.169 . . . . 0.0 111.873 171.638 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 45.7 p-10 -132.25 -28.16 1.73 Allowed 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 116.036 1.865 . . . . 0.0 116.036 -175.179 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.86 -69.35 1.41 Allowed Glycine 0 C--N 1.343 0.945 0 CA-C-N 119.436 1.017 . . . . 0.0 113.221 -168.874 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 33.4 m 33.42 23.57 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 129.746 3.218 . . . . 0.0 119.14 174.88 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 69.2 m -86.08 -76.47 0.34 Allowed 'General case' 0 C--N 1.331 -0.204 0 O-C-N 121.01 -1.056 . . . . 0.0 109.764 177.608 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -137.04 157.1 75.24 Favored Pre-proline 0 N--CA 1.479 0.977 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -168.606 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -56.47 127.29 25.33 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.17 2.58 . . . . 0.0 110.535 173.327 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.05 -2.74 59.86 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-O 118.218 -1.324 . . . . 0.0 115.443 -178.292 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.79 -25.76 68.39 Favored 'General case' 0 N--CA 1.484 1.225 0 CA-C-N 120.46 2.13 . . . . 0.0 112.689 178.325 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.1 -12.27 3.31 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.507 1.123 . . . . 0.0 111.519 178.117 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.36 -38.56 91.62 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.988 1.315 . . . . 0.0 113.381 173.335 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.79 -37.98 70.33 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.586 0.63 . . . . 0.0 111.091 173.391 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -67.86 -47.73 68.09 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.209 1.004 . . . . 0.0 113.213 -178.987 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.2 mt -86.09 -11.92 51.46 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.539 1.136 . . . . 0.0 113.102 -178.659 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.31 -2.62 13.9 Favored Glycine 0 CA--C 1.537 1.444 0 C-N-CA 124.129 0.871 . . . . 0.0 113.728 -169.58 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.0 mt -81.9 153.52 26.29 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.618 1.167 . . . . 0.0 110.942 -176.712 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 50' ' ' ASN . 4.3 t -61.23 142.38 56.84 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.362 -0.836 . . . . 0.0 110.62 171.499 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.9 ptp180 -56.78 -23.79 45.82 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 118.685 -0.674 . . . . 0.0 112.667 178.366 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.0 m -66.04 -48.03 72.41 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.27 1.028 . . . . 0.0 113.258 170.862 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.407 ' H ' HG23 ' A' ' 47' ' ' THR . 43.6 t-20 -65.71 -41.21 92.58 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.041 1.336 . . . . 0.0 110.672 176.868 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 19.4 t -55.28 -49.9 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 123.654 0.781 . . . . 0.0 111.025 168.977 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 27.2 p -66.43 -36.15 82.1 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 120.31 1.414 . . . . 0.0 114.51 175.496 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -64.4 -45.28 88.3 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.31 1.444 . . . . 0.0 110.643 179.227 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -72.72 -35.35 67.55 Favored 'General case' 0 CA--C 1.558 1.281 0 CA-C-O 117.264 -1.35 . . . . 0.0 113.111 171.282 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.3 mt -63.11 -33.0 74.51 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 121.777 2.08 . . . . 0.0 113.719 173.259 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.3 m -55.42 -52.28 64.11 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.194 0.906 . . . . 0.0 113.405 -169.838 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 50.9 t -63.38 -40.29 96.86 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 122.933 0.493 . . . . 0.0 111.201 172.545 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.8 tp -58.86 -28.26 65.93 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.765 2.026 . . . . 0.0 112.908 -172.348 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 26.9 mtm180 -71.48 -38.9 71.18 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.9 0.88 . . . . 0.0 112.359 171.29 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -78.74 -36.12 29.98 Favored Glycine 0 N--CA 1.468 0.781 0 C-N-CA 125.883 1.706 . . . . 0.0 111.635 -176.721 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 36.3 m -61.86 -12.79 19.37 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 128.149 2.58 . . . . 0.0 112.865 167.28 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 81.87 -10.02 53.97 Favored Glycine 0 C--N 1.342 0.904 0 C-N-CA 126.957 2.218 . . . . 0.0 113.404 -179.033 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.532 HD21 HD21 ' A' ' 14' ' ' LEU . 85.0 mt -63.73 -33.03 74.73 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 127.496 2.318 . . . . 0.0 113.936 -169.902 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.454 HG13 HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -113.22 133.3 59.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.599 1.56 . . . . 0.0 109.101 166.833 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.8 t -121.79 133.06 69.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 124.971 1.308 . . . . 0.0 109.574 172.324 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.03 142.56 50.91 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 114.746 -1.115 . . . . 0.0 111.979 170.121 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.1 m -162.92 158.96 23.09 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.098 1.759 . . . . 0.0 106.944 -174.303 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -91.46 145.61 24.48 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.73 1.15 . . . . 0.0 113.206 178.302 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -111.39 -166.79 1.11 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.284 1.834 . . . . 0.0 109.85 168.79 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -72.02 -8.1 68.32 Favored Glycine 0 CA--C 1.537 1.417 0 O-C-N 120.498 -1.376 . . . . 0.0 116.457 -169.39 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.03 -31.28 0.77 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.326 1.85 . . . . 0.0 113.091 177.667 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.25 -175.79 4.97 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.942 1.246 . . . . 0.0 112.929 -172.642 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 8.1 p -79.81 146.96 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 123.842 0.857 . . . . 0.0 110.792 168.858 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -128.79 162.7 26.83 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 127.657 2.383 . . . . 0.0 111.091 -179.202 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -110.59 120.42 42.35 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.409 1.084 . . . . 0.0 108.919 168.262 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -121.46 168.62 11.49 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.881 1.272 . . . . 0.0 110.461 174.985 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 17.6 mt -58.64 155.44 12.54 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 172.642 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -48.04 -40.7 23.69 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.155 1.782 . . . . 0.0 114.342 -178.457 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -174.52 169.42 3.69 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.578 1.951 . . . . 0.0 110.982 -174.387 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 88.0 p -46.57 -34.75 5.18 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 127.372 2.269 . . . . 0.0 113.605 169.271 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 62.1 m-70 -54.23 -53.47 53.16 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 125.525 1.53 . . . . 0.0 112.221 176.203 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 28.2 mt -73.15 -37.1 66.73 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 118.219 -0.895 . . . . 0.0 110.61 -179.968 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.2 -50.76 64.03 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 118.913 0.779 . . . . 0.0 111.495 179.089 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -75.64 -32.23 60.15 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.49 1.041 . . . . 0.0 113.611 -179.274 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.18 -44.72 83.2 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.764 1.166 . . . . 0.0 112.576 176.298 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.01 -38.43 75.93 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.931 0.892 . . . . 0.0 110.694 174.63 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.16 -35.43 91.96 Favored Glycine 0 CA--C 1.529 0.907 0 O-C-N 121.418 -0.801 . . . . 0.0 112.225 176.884 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -83.15 9.57 10.21 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.865 1.266 . . . . 0.0 114.093 170.148 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.7 tp 66.52 -18.48 0.11 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 130.785 3.634 . . . . 0.0 117.525 164.041 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.27 34.3 m 118.71 20.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.138 1 C-N-CA 134.938 5.295 . . . . 0.0 112.152 178.219 . . . . . . . . 3 2 . 1 . 026 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.441 ' HB3' ' CG ' ' B' ' 81' ' ' HIS . 25.4 mm-40 79.63 -33.43 0.14 Allowed 'General case' 0 CA--C 1.539 0.524 0 O-C-N 120.176 -1.578 . . . . 0.0 114.127 162.945 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.8 p -57.34 16.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 C-N-CA 129.835 3.254 . . . . 0.0 117.572 -175.206 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.4 t 69.54 27.37 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 C-N-CA 125.218 1.407 . . . . 0.0 111.446 169.036 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.6 tp 80.13 96.94 0.06 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 129.53 3.132 . . . . 0.0 111.855 -173.805 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -87.69 114.76 24.61 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 120.887 -1.133 . . . . 0.0 109.045 170.021 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.3 m -141.82 142.99 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 127.528 2.331 . . . . 0.0 108.891 170.397 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.79 127.45 32.27 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.729 1.612 . . . . 0.0 109.688 170.818 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 2.7 m -179.88 -57.96 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 126.867 2.067 . . . . 0.0 109.138 -168.824 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.1 t0 176.19 56.44 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 131.235 3.814 . . . . 0.0 108.065 175.322 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -111.12 -163.2 0.05 OUTLIER Pre-proline 0 CA--C 1.555 1.139 0 C-N-CA 127.912 2.485 . . . . 0.0 110.543 -168.282 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -73.56 -159.57 0.08 OUTLIER 'Trans proline' 0 CA--C 1.55 1.282 0 CA-C-N 122.664 1.987 . . . . 0.0 112.928 177.021 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . 0.449 0.5 OUTLIER 48.9 36.57 8.48 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 130.84 3.656 . . . . 0.0 117.402 -169.451 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.409 HG12 ' H ' ' A' ' 103' ' ' VAL . 1.4 p -57.2 -40.13 71.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 126.997 2.119 . . . . 0.0 112.87 166.148 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.74 166.11 21.61 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.026 0.93 . . . . 0.0 112.103 -173.546 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -72.47 142.34 48.59 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 115.22 1.563 . . . . 0.0 115.22 -169.189 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.589 0 C-N-CA 127.406 2.282 . . . . 0.0 114.355 -172.016 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.603 0 CA-C-O 121.345 0.593 . . . . 0.0 111.429 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 pp -48.19 -36.46 13.69 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 126.589 1.956 . . . . 0.0 114.708 -177.612 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.23 -43.27 95.47 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.61 0.641 . . . . 0.0 111.506 177.299 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 25.6 ttp85 -64.95 -20.26 66.38 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.471 -1.393 . . . . 0.0 112.532 174.885 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.2 -38.22 85.79 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.802 1.637 . . . . 0.0 111.078 169.016 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -60.82 -25.52 63.92 Favored Glycine 0 CA--C 1.533 1.178 0 O-C-N 121.005 -1.059 . . . . 0.0 112.989 174.534 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 29.0 ttt-85 -69.35 -44.66 71.14 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 118.871 1.336 . . . . 0.0 110.364 170.817 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.54 -22.05 66.16 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 118.268 -0.873 . . . . 0.0 112.549 -177.014 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mp -91.34 -19.46 22.91 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.231 0.923 . . . . 0.0 113.308 168.384 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.0 -24.29 38.07 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 174.274 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -55.53 136.63 70.35 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 125.686 1.594 . . . . 0.0 109.597 178.849 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -49.26 -81.34 0.02 OUTLIER 'Trans proline' 0 CA--C 1.535 0.532 1 C-N-CA 126.611 4.874 . . . . 0.0 112.712 -167.695 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 13.4 m -62.86 -27.75 69.55 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 125.226 1.41 . . . . 0.0 111.415 -179.855 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -67.84 -43.5 79.38 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 120.495 1.498 . . . . 0.0 111.244 178.903 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 2.7 t -58.6 -14.1 7.38 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.51 1.05 . . . . 0.0 113.069 168.531 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -93.28 -55.33 3.35 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 120.265 -1.522 . . . . 0.0 112.053 171.641 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mt -38.87 -56.56 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 125.223 1.409 . . . . 0.0 110.464 170.899 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.52 ' HA ' HD12 ' B' ' 30' ' ' LEU . 96.9 mt -62.92 -30.56 71.65 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -170.545 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.6 p -88.12 -10.71 10.77 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 124.546 1.139 . . . . 0.0 112.337 178.012 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.71 -6.42 25.07 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 128.28 2.632 . . . . 0.0 112.907 176.503 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.545 HD11 ' CG1' ' B' ' 64' ' ' VAL . 52.7 mt -77.72 -54.27 6.56 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 119.639 -1.913 . . . . 0.0 110.177 168.84 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -35.31 -48.32 0.46 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 131.614 3.966 . . . . 0.0 114.303 179.551 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -102.8 -21.5 14.03 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.959 2.104 . . . . 0.0 113.224 -179.317 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -83.99 -70.1 1.36 Allowed Glycine 0 C--N 1.336 0.542 0 C-N-CA 125.826 1.679 . . . . 0.0 110.562 -170.726 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 11.0 m 32.46 26.81 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 N-CA-C 117.551 2.426 . . . . 0.0 117.551 -170.9 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 54.1 m -81.36 -89.56 0.07 Allowed 'General case' 0 C--O 1.221 -0.427 0 O-C-N 120.846 -1.159 . . . . 0.0 111.634 -178.661 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 36' ' ' TYR . . . . . 0.455 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 27.6 m-85 -135.16 156.52 78.12 Favored Pre-proline 0 N--CA 1.472 0.653 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -169.166 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -57.24 125.4 18.76 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.266 1.978 . . . . 0.0 109.359 171.554 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.14 -6.83 80.45 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 117.313 -1.826 . . . . 0.0 114.935 -174.091 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 39' ' ' GLN . . . . . 0.455 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 2.5 pp0? -59.36 -38.16 79.73 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 120.764 2.282 . . . . 0.0 111.235 172.273 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 15.0 mt -53.71 -23.05 10.42 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.224 1.41 . . . . 0.0 112.454 179.384 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.88 -28.15 69.3 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 176.966 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.03 -55.26 5.77 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.774 0.83 . . . . 0.0 110.6 171.312 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -49.67 -40.42 39.82 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 177.426 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.4 mt -95.6 -15.3 22.87 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.03 0.932 . . . . 0.0 113.245 -175.999 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.95 -5.13 4.93 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 124.542 1.068 . . . . 0.0 114.188 -170.123 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 87.8 mt -89.58 136.08 33.24 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 125.279 1.431 . . . . 0.0 109.678 -177.903 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.0 t -61.23 150.54 34.28 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.294 -0.879 . . . . 0.0 112.316 -173.631 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -57.5 -32.01 66.59 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -169.863 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.7 m -64.29 -52.34 59.02 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.017 0.927 . . . . 0.0 112.551 173.822 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -64.24 -40.92 97.01 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.8 1.24 . . . . 0.0 111.827 179.127 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 78.6 t -61.34 -44.7 98.94 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 121.505 -0.747 . . . . 0.0 111.143 169.504 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 81.1 p -64.04 -31.51 72.73 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.0 1.273 . . . . 0.0 113.913 176.88 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -57.27 -40.64 78.12 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 122.345 1.069 . . . . 0.0 110.854 174.316 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -73.85 -34.67 64.6 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 116.925 -1.512 . . . . 0.0 114.121 170.135 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 90.7 mt -61.24 -32.83 72.63 Favored 'General case' 0 N--CA 1.483 1.175 0 CA-C-N 121.793 2.088 . . . . 0.0 113.443 173.274 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 70.4 m -52.53 -44.82 66.01 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -174.159 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.1 t -75.73 -36.67 59.87 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.548 0.613 . . . . 0.0 110.788 175.733 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 10.1 tp -62.51 -28.33 69.76 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 127.16 2.184 . . . . 0.0 113.737 -168.148 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 28.2 mtm105 -71.92 -40.72 68.58 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.007 0.523 . . . . 0.0 110.602 171.815 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.82 -39.95 85.32 Favored Glycine 0 C--O 1.222 -0.654 0 CA-C-O 118.439 -1.2 . . . . 0.0 111.147 178.5 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 96.6 m -58.31 -12.91 4.18 Favored 'General case' 0 CA--C 1.565 1.556 0 C-N-CA 127.255 2.222 . . . . 0.0 112.323 168.541 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 82.29 -9.82 56.55 Favored Glycine 0 C--N 1.344 1.02 0 C-N-CA 127.033 2.254 . . . . 0.0 113.412 -179.834 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 19.8 mt -71.08 -31.52 67.92 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.196 1.398 . . . . 0.0 114.643 -167.862 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.545 ' CG1' HD11 ' B' ' 30' ' ' LEU . 0.1 OUTLIER -109.62 139.65 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.688 1.595 . . . . 0.0 111.125 169.874 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 71.6 t -132.66 133.7 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 C-N-CA 125.764 1.626 . . . . 0.0 109.241 -176.272 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.72 135.34 35.5 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.482 0.713 . . . . 0.0 110.126 168.965 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 2.1 m -162.49 163.5 27.47 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.764 1.625 . . . . 0.0 107.046 -171.31 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -91.73 151.77 20.48 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 120.89 -1.131 . . . . 0.0 113.673 178.518 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -119.22 -171.56 2.14 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.513 1.925 . . . . 0.0 108.834 166.396 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -69.99 -10.28 64.72 Favored Glycine 0 CA--C 1.536 1.378 0 N-CA-C 116.932 1.533 . . . . 0.0 116.932 -168.69 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 24.6 mtm180 -138.27 -21.94 1.04 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.153 1.781 . . . . 0.0 113.571 -177.4 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -154.83 -175.39 5.4 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.665 1.575 . . . . 0.0 112.755 -179.478 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 9.2 p -83.34 146.61 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.312 1.045 . . . . 0.0 110.453 169.073 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -134.72 162.48 32.22 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 126.436 1.894 . . . . 0.0 111.566 -170.962 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -106.59 127.0 52.98 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 165.723 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -128.62 172.11 11.51 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.385 1.874 . . . . 0.0 109.924 176.218 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 29.4 mt -76.03 158.96 31.3 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.116 0.566 . . . . 0.0 112.399 177.912 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -46.2 -34.92 4.68 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.712 2.005 . . . . 0.0 116.071 177.955 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 11.6 t70 171.59 158.63 0.09 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 128.922 2.889 . . . . 0.0 110.453 -169.988 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 91.9 p -40.98 -36.14 0.62 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 128.749 2.82 . . . . 0.0 113.501 168.57 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 81' ' ' HIS . . . . . 0.441 ' CG ' ' HB3' ' A' ' 91' ' ' GLN . 5.2 m-70 -49.47 -53.05 25.18 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 125.674 1.59 . . . . 0.0 113.039 173.854 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 14.2 mt -74.22 -40.11 62.66 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.075 0.852 . . . . 0.0 110.43 -179.395 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.01 -45.76 75.14 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.088 0.555 . . . . 0.0 110.99 179.376 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -77.01 -35.6 56.94 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 117.049 -1.453 . . . . 0.0 114.193 176.088 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -69.31 -33.45 73.18 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 121.143 1.792 . . . . 0.0 112.822 178.778 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.44 -44.5 51.46 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.587 0.755 . . . . 0.0 110.683 169.868 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.96 -32.67 73.58 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 123.972 0.796 . . . . 0.0 113.178 -176.022 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -71.68 -8.79 56.34 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.289 1.436 . . . . 0.0 112.548 169.421 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 4.8 tp 66.95 11.01 8.1 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 128.453 2.701 . . . . 0.0 115.338 167.994 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER 75.28 -9.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 C-N-CA 129.973 3.309 . . . . 0.0 111.907 168.093 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 91' ' ' GLN . . . . . 0.486 ' C ' ' H ' ' B' ' 93' ' ' VAL 0.482 5.2 pt20 73.93 12.46 4.31 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 115.306 1.595 . . . . 0.0 115.306 141.726 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.511 HG13 ' HB2' ' B' ' 95' ' ' ALA . 4.9 p -68.38 42.68 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 130.112 3.365 . . . . 0.0 109.368 163.141 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 93' ' ' VAL . . . . . 0.486 ' H ' ' C ' ' B' ' 91' ' ' GLN . 1.5 t 59.22 45.57 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 C-N-CA 127.741 2.416 . . . . 0.0 111.633 178.296 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 32.6 tp 60.26 60.37 2.07 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 122.096 0.951 . . . . 0.0 110.242 -179.92 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.511 ' HB2' HG13 ' B' ' 92' ' ' VAL . . . -54.91 114.68 1.82 Allowed 'General case' 0 CA--C 1.548 0.877 0 O-C-N 121.156 -0.965 . . . . 0.0 110.658 179.682 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 27.4 m -144.32 144.35 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 126.464 1.906 . . . . 0.0 111.43 177.066 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -74.34 108.66 7.27 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.686 1.195 . . . . 0.0 110.348 179.418 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 22.0 m -166.1 -78.34 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.495 1.918 . . . . 0.0 107.132 -169.61 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -156.76 105.87 2.23 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 129.41 3.084 . . . . 0.0 103.832 166.783 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -158.99 -164.4 0.09 OUTLIER Pre-proline 0 CA--C 1.559 1.323 0 C-N-CA 125.626 1.571 . . . . 0.0 108.999 -165.34 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -63.16 -156.53 0.02 OUTLIER 'Trans proline' 0 CA--C 1.555 1.562 0 C-N-CA 124.087 3.191 . . . . 0.0 115.658 173.061 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . 0.4 0.5 OUTLIER 35.19 57.2 0.81 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 128.983 2.913 . . . . 0.0 115.369 -170.094 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.41 HG12 ' H ' ' B' ' 103' ' ' VAL . 0.2 OUTLIER -73.16 -39.52 56.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 C-N-CA 128.854 2.861 . . . . 0.0 114.464 168.443 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.74 -146.02 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -165.856 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 105' ' ' GLU . . . . . 0.459 ' CD ' ' H ' ' B' ' 106' ' ' ARG . 0.4 OUTLIER -66.24 154.73 39.09 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.82 -0.55 . . . . 0.0 109.831 169.415 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' B' B ' 106' ' ' ARG . . . . . 0.459 ' H ' ' CD ' ' B' ' 105' ' ' GLU . 0.7 OUTLIER . . . . . 0 CA--C 1.55 0.961 0 C-N-CA 130.593 3.557 . . . . 0.0 113.869 -169.137 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.959 0 CA-C-O 119.755 -0.164 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -61.59 -32.18 72.28 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 173.408 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.47 -54.23 35.77 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.879 0.871 . . . . 0.0 110.532 178.591 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -34.57 76.78 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.335 0.97 . . . . 0.0 112.586 176.631 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.474 ' HG ' HG11 ' B' ' 92' ' ' VAL . 3.2 tm? -68.77 -56.5 7.84 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.306 0.957 . . . . 0.0 111.066 -179.179 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.86 -29.84 75.91 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-O 119.128 -0.818 . . . . 0.0 111.141 -179.783 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -65.36 -48.4 73.08 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 118.344 1.072 . . . . 0.0 110.649 169.878 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.1 -24.97 67.44 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 119.869 1.213 . . . . 0.0 112.977 -179.647 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 mp -94.14 -4.34 49.39 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 171.477 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -99.68 -15.37 18.55 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 126.489 1.916 . . . . 0.0 114.192 168.511 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.406 ' CG ' HH21 ' A' ' 23' ' ' ARG . 0.7 OUTLIER -62.66 152.18 82.17 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 127.257 2.223 . . . . 0.0 112.671 174.221 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.35 -101.1 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 0.978 1 C-N-CA 127.533 5.489 . . . . 0.0 112.317 -169.681 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -44.92 -35.43 2.84 Favored 'General case' 0 C--O 1.22 -0.494 0 C-N-CA 126.516 1.926 . . . . 0.0 111.346 168.807 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.499 ' HG2' HD13 ' A' ' 58' ' ' LEU . 11.9 ttm-85 -64.41 -50.54 67.22 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 120.277 1.399 . . . . 0.0 113.952 -179.462 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.23 -42.51 99.37 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 120.069 1.304 . . . . 0.0 110.063 174.384 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 18.6 mmt-85 -54.48 -44.05 72.3 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 174.679 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.5 mm -50.22 -54.15 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.236 0.614 . . . . 0.0 109.792 170.772 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 86.7 mt -59.91 -48.11 83.05 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.472 -0.775 . . . . 0.0 112.173 -177.239 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.7 m -65.55 -36.05 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 CA-C-N 118.776 0.716 . . . . 0.0 111.092 -176.716 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.02 -26.7 33.58 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.513 0.561 . . . . 0.0 112.513 -178.773 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.418 ' O ' HG13 ' A' ' 34' ' ' VAL . 19.9 tp -68.79 -37.27 79.17 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 117.182 -1.389 . . . . 0.0 112.051 174.323 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.39 -50.83 12.0 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.182 2.193 . . . . 0.0 112.893 -173.135 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -104.05 8.72 36.6 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 126.454 1.902 . . . . 0.0 112.118 178.695 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -92.98 -73.85 1.25 Allowed Glycine 0 C--N 1.341 0.86 0 C-N-CA 127.365 2.412 . . . . 0.0 111.504 172.256 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.574 HG12 ' HA ' ' A' ' 76' ' ' ALA . 23.7 m 24.54 49.54 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 C-N-CA 128.399 2.68 . . . . 0.0 115.918 -172.792 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 80.3 m -96.61 -66.94 0.87 Allowed 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 125.523 1.529 . . . . 0.0 112.661 177.304 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -146.0 159.02 47.7 Favored Pre-proline 0 N--CA 1.486 1.364 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -168.382 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -55.45 126.27 21.92 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.214 2.609 . . . . 0.0 111.061 173.528 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.56 8.35 62.91 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 117.918 -1.49 . . . . 0.0 115.046 179.966 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.07 -24.74 26.71 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.353 2.076 . . . . 0.0 112.883 177.085 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.3 mt -63.2 -15.87 58.32 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 125.894 1.677 . . . . 0.0 111.643 -176.662 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.27 -29.75 70.04 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 170.308 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.0 -49.04 16.31 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.489 0.586 . . . . 0.0 110.711 169.959 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -59.05 -36.49 75.13 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -179.023 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 17.5 mt -101.45 -14.12 17.66 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.279 1.432 . . . . 0.0 112.468 -175.839 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.4 -1.83 12.19 Favored Glycine 0 CA--C 1.536 1.359 0 CA-C-N 119.416 1.007 . . . . 0.0 114.497 -171.981 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -85.54 150.97 24.29 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.879 1.272 . . . . 0.0 110.738 178.21 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.4 p -64.58 159.38 21.93 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.637 -1.289 . . . . 0.0 111.87 -177.506 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 23.7 ttm180 -53.24 -34.43 57.11 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.27 0.628 . . . . 0.0 111.385 175.186 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.2 m -66.28 -55.47 15.91 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.01 0.823 . . . . 0.0 111.378 172.988 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -57.73 -33.53 68.55 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.944 0.793 . . . . 0.0 112.902 179.323 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.8 t -72.26 -49.46 42.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.905 1.282 . . . . 0.0 112.329 172.54 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 39.5 m -64.52 -30.4 71.43 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.987 0.812 . . . . 0.0 112.297 -178.107 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -50.95 -35.57 34.14 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.252 1.421 . . . . 0.0 113.529 170.529 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -90.06 -29.45 18.36 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 117.534 -1.222 . . . . 0.0 113.997 174.214 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 66.8 mt -66.58 -27.77 67.98 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.142 1.337 . . . . 0.0 112.388 176.047 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.1 t -50.5 -51.2 49.58 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.168 0.587 . . . . 0.0 111.887 173.505 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 15.6 t -68.85 -45.72 70.33 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.79 1.236 . . . . 0.0 111.511 170.415 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.499 HD13 ' HG2' ' A' ' 23' ' ' ARG . 6.7 tp -62.53 -32.64 73.62 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -169.021 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 25.5 mtp-105 -75.8 -37.69 58.92 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.758 0.708 . . . . 0.0 112.535 168.945 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.5 -45.56 84.35 Favored Glycine 0 N--CA 1.469 0.873 0 C-N-CA 124.024 0.821 . . . . 0.0 112.646 -178.484 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.8 m -66.53 -5.59 11.88 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 126.472 1.909 . . . . 0.0 112.336 168.151 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.54 -7.57 57.41 Favored Glycine 0 C--N 1.338 0.675 0 C-N-CA 125.712 1.625 . . . . 0.0 115.315 175.989 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 37.5 mt -65.56 -25.67 67.53 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.934 1.294 . . . . 0.0 113.168 -169.128 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.6 m -119.63 139.29 47.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.14 1.376 . . . . 0.0 112.448 167.249 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 24.6 t -130.08 145.73 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 127.046 2.138 . . . . 0.0 109.681 -177.214 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.61 146.85 28.06 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 175.68 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.4 165.42 28.55 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.42 1.488 . . . . 0.0 110.188 172.544 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -89.55 138.04 31.81 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 118.393 -0.813 . . . . 0.0 109.496 165.259 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -95.76 -32.8 12.54 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.273 0.942 . . . . 0.0 112.166 167.277 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 146.77 -32.95 1.42 Allowed Glycine 0 N--CA 1.477 1.37 0 C-N-CA 125.873 1.702 . . . . 0.0 114.549 169.43 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 49.5 ttm-85 -89.17 -34.13 16.8 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 128.075 2.55 . . . . 0.0 111.652 170.523 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.54 179.86 8.78 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 128.084 2.553 . . . . 0.0 109.797 -172.582 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 15.9 m -85.98 161.43 2.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.456 166.723 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.0 ptt180 -138.38 156.17 47.85 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.044 1.737 . . . . 0.0 109.411 -178.619 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -90.88 148.68 22.31 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 164.395 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.574 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -148.49 164.73 33.29 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 123.682 0.793 . . . . 0.0 109.154 172.816 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -58.87 156.81 10.72 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 122.632 0.373 . . . . 0.0 111.859 169.92 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.73 -30.23 31.34 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -175.023 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.3 t0 174.98 167.36 0.28 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 129.976 3.311 . . . . 0.0 109.426 179.608 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 20.2 m -51.37 -22.94 3.25 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.283 1.833 . . . . 0.0 113.182 169.166 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.43 -58.39 8.21 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.343 1.057 . . . . 0.0 111.748 170.776 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 22.7 mt -65.35 -32.71 74.5 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.408 1.458 . . . . 0.0 110.841 176.034 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.12 -29.05 69.54 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.862 0.755 . . . . 0.0 111.073 -177.046 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -70.46 -53.91 14.44 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.731 1.212 . . . . 0.0 112.532 171.281 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.38 -40.01 96.08 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 120.622 1.555 . . . . 0.0 112.582 -178.858 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.34 -40.52 97.52 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.899 2.08 . . . . 0.0 113.165 169.89 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.85 -45.01 5.56 Favored Glycine 0 N--CA 1.476 1.343 0 C-N-CA 127.236 2.35 . . . . 0.0 114.701 -168.943 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 41.5 tp10 -62.3 -25.6 67.95 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.144 0.972 . . . . 0.0 108.617 165.204 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 20.6 tp 73.4 170.25 0.31 Allowed 'General case' 0 C--N 1.344 0.349 0 C-N-CA 130.162 3.385 . . . . 0.0 109.422 175.261 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.1 m -58.27 -5.39 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 O-C-N 120.24 -1.538 . . . . 0.0 113.573 168.125 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.452 ' C ' ' H ' ' A' ' 93' ' ' VAL . 19.7 mm-40 76.81 -24.87 0.21 Allowed 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 127.038 2.135 . . . . 0.0 111.844 165.409 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 2.3 p -62.89 29.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 128.595 2.758 . . . . 0.0 114.844 172.216 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.452 ' H ' ' C ' ' A' ' 91' ' ' GLN . 2.4 t 79.36 -22.08 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 130.217 3.407 . . . . 0.0 112.935 168.401 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.6 tp 132.16 99.8 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.771 1 C-N-CA 132.928 4.491 . . . . 0.0 107.674 -176.503 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.05 139.02 58.16 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 174.792 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 35.1 t -72.52 146.2 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 C-N-CA 124.658 1.183 . . . . 0.0 113.713 -169.024 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -77.21 51.24 0.82 Allowed 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 126.07 1.748 . . . . 0.0 113.291 173.203 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.6 p -122.19 151.45 40.99 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 125.748 1.619 . . . . 0.0 113.434 -176.025 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -88.35 115.17 25.66 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 165.791 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -140.43 140.14 22.19 Favored Pre-proline 0 CA--C 1.536 0.429 0 C-N-CA 124.121 0.968 . . . . 0.0 109.738 171.114 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -72.55 145.47 42.18 Favored 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 123.728 2.952 . . . . 0.0 113.77 -168.288 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 14.3 t -70.66 70.22 0.45 Allowed 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.376 1.47 . . . . 0.0 111.308 171.08 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 3.3 p -146.8 21.35 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -175.38 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . 70.14 -0.24 2.87 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 169.714 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.552 ' CD ' ' H ' ' A' ' 106' ' ' ARG . 0.0 OUTLIER -153.99 -171.61 3.94 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 127.545 2.338 . . . . 0.0 110.167 174.418 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.552 ' H ' ' CD ' ' A' ' 105' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.772 0 C-N-CA 129.817 3.247 . . . . 0.0 109.235 -168.85 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.827 0 CA-C-O 119.396 -0.335 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -66.32 -41.25 89.92 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 119.758 -1.839 . . . . 0.0 113.504 -170.377 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.61 -23.36 66.8 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 119.645 1.111 . . . . 0.0 113.285 178.841 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 13' ' ' ARG . . . . . 0.472 HH21 ' CB ' ' B' ' 61' ' ' CYS . 3.4 tpt85 -82.25 -58.3 3.01 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.879 1.671 . . . . 0.0 110.759 169.004 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -64.75 -50.86 65.2 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 128.226 2.61 . . . . 0.0 112.655 -173.141 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.9 -39.08 97.59 Favored Glycine 0 CA--C 1.526 0.721 0 O-C-N 121.216 -0.927 . . . . 0.0 111.512 177.384 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.406 ' HA ' ' HB3' ' B' ' 19' ' ' ALA . 65.5 ttt180 -65.57 -34.54 78.47 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.64 0.776 . . . . 0.0 111.812 174.426 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.15 -24.97 65.16 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.473 1.033 . . . . 0.0 112.651 173.43 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.0 mp -101.7 -9.27 21.03 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.862 0.865 . . . . 0.0 113.088 174.571 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 19' ' ' ALA . . . . . 0.406 ' HB3' ' HA ' ' B' ' 16' ' ' ARG . . . -85.19 -19.86 31.08 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.756 1.623 . . . . 0.0 113.242 167.233 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -54.08 151.17 13.24 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 127.381 2.272 . . . . 0.0 113.571 173.055 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -66.92 -100.84 0.0 OUTLIER 'Trans proline' 0 CA--C 1.547 1.161 1 C-N-CA 127.194 5.262 . . . . 0.0 112.663 -171.91 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -47.46 -28.01 1.97 Allowed 'General case' 0 C--N 1.342 0.241 0 C-N-CA 126.467 1.907 . . . . 0.0 112.936 169.973 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.671 HH21 ' CB ' ' B' ' 57' ' ' CYS . 0.2 OUTLIER -68.93 -47.93 64.5 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 119.65 1.113 . . . . 0.0 113.66 177.85 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 43.3 t -60.41 -42.18 95.43 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.866 1.212 . . . . 0.0 110.728 172.757 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 19.3 mmt-85 -58.03 -43.14 86.59 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 174.437 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.1 mt -47.37 -57.7 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 CA-C-N 118.782 0.719 . . . . 0.0 109.185 169.155 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.758 HD22 HD21 ' B' ' 77' ' ' LEU . 63.6 mt -62.22 -44.72 95.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 117.365 -1.303 . . . . 0.0 112.608 -171.167 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.7 m -61.49 -33.3 56.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 CA-C-N 120.391 1.451 . . . . 0.0 111.698 176.34 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.01 -17.22 47.57 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.929 0.891 . . . . 0.0 113.37 177.617 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 tp -72.55 -42.12 65.02 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 117.366 -1.302 . . . . 0.0 111.446 169.115 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.03 -51.09 25.55 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.829 2.052 . . . . 0.0 112.475 -173.229 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -99.51 10.79 40.73 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.546 1.938 . . . . 0.0 112.581 -178.338 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -119.07 -80.44 0.68 Allowed Glycine 0 C--N 1.34 0.796 0 C-N-CA 126.46 1.981 . . . . 0.0 112.821 -173.388 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 9.1 m 35.58 37.68 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 126.559 1.944 . . . . 0.0 115.169 -169.995 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -82.33 -71.94 0.46 Allowed 'General case' 0 C--O 1.223 -0.327 0 O-C-N 120.842 -1.161 . . . . 0.0 112.357 -171.756 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -136.01 -176.18 0.55 Allowed Pre-proline 0 CA--C 1.553 1.096 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -168.547 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -79.51 95.92 1.05 Allowed 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 121.734 1.623 . . . . 0.0 108.964 -174.386 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 80.54 29.59 43.4 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-O 119.177 -0.79 . . . . 0.0 113.92 -177.648 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -60.73 -22.47 64.03 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.317 1.559 . . . . 0.0 112.0 169.889 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 8.1 mt -48.34 -20.87 0.44 Allowed 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 127.368 2.267 . . . . 0.0 113.455 171.018 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.28 -28.89 70.03 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.961 0.801 . . . . 0.0 112.055 176.958 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.01 -50.74 12.45 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.324 0.65 . . . . 0.0 110.55 168.904 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -56.91 -37.5 71.53 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -177.248 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.6 mt -97.58 -13.74 21.43 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.334 1.453 . . . . 0.0 112.28 -177.497 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.19 -6.58 4.0 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.691 1.139 . . . . 0.0 114.532 -171.349 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -84.12 147.65 27.23 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.91 1.355 . . . . 0.0 110.042 -179.532 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.7 p -59.93 155.29 16.9 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 121.677 -0.639 . . . . 0.0 111.311 -177.881 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -53.15 -35.77 60.11 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.099 178.054 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 11.6 m -64.26 -58.63 5.98 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.017 0.927 . . . . 0.0 111.514 172.139 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -55.16 -36.36 65.75 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.444 1.02 . . . . 0.0 113.262 -178.255 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 59.5 t -76.53 -43.4 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.465 0.706 . . . . 0.0 112.346 174.467 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.5 m -62.37 -30.67 71.36 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 119.763 1.165 . . . . 0.0 112.882 178.972 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -56.11 -28.97 59.88 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.879 1.271 . . . . 0.0 113.201 171.603 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 -90.46 -30.5 17.29 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-O 117.507 -1.235 . . . . 0.0 114.036 169.613 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 91.1 mt -64.79 -38.3 90.51 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 120.656 1.571 . . . . 0.0 113.035 177.808 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 1.2 m -60.3 -29.8 69.07 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 179.831 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 57' ' ' CYS . . . . . 0.671 ' CB ' HH21 ' B' ' 23' ' ' ARG . 40.0 t -75.86 -41.05 53.42 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.318 0.963 . . . . 0.0 110.682 169.017 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.453 HD13 ' HG2' ' B' ' 23' ' ' ARG . 5.5 tp -57.79 -38.68 75.93 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 125.54 1.536 . . . . 0.0 112.597 -174.819 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 58.5 mtm-85 -73.03 -35.33 66.74 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 118.47 0.577 . . . . 0.0 112.098 174.458 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.82 -44.16 7.9 Favored Glycine 0 N--CA 1.468 0.774 0 C-N-CA 124.188 0.899 . . . . 0.0 112.855 -170.287 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 61' ' ' CYS . . . . . 0.472 ' CB ' HH21 ' B' ' 13' ' ' ARG . 94.4 m -74.18 16.21 0.26 Allowed 'General case' 0 CA--C 1.57 1.73 0 C-N-CA 125.837 1.655 . . . . 0.0 112.183 169.538 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.36 28.13 72.88 Favored Glycine 0 C--N 1.343 0.938 0 C-N-CA 127.38 2.419 . . . . 0.0 117.383 167.783 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.519 ' O ' HD23 ' B' ' 77' ' ' LEU . 56.1 mt -92.96 -32.64 14.47 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.183 0.992 . . . . 0.0 113.272 -177.782 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -134.56 138.57 49.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 C-N-CA 125.469 1.508 . . . . 0.0 113.598 -175.72 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 97.1 t -126.15 136.19 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 126.956 2.102 . . . . 0.0 108.83 179.856 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -77.64 141.13 39.61 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.782 0.833 . . . . 0.0 112.141 177.346 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -141.85 154.74 45.37 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.9 0.88 . . . . 0.0 108.828 171.817 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -73.83 132.62 42.75 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 167.715 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.53 -31.84 42.15 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.475 0.71 . . . . 0.0 110.887 166.86 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 145.61 -35.78 1.39 Allowed Glycine 0 CA--C 1.533 1.168 0 C-N-CA 126.51 2.005 . . . . 0.0 113.506 173.92 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 56.4 ttm-85 -96.06 -36.08 11.14 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 127.146 2.179 . . . . 0.0 111.886 169.921 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.38 -171.09 3.71 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.484 1.513 . . . . 0.0 110.768 -178.736 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 17.6 m -100.62 146.0 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.569 1.148 . . . . 0.0 111.106 176.459 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.0 ptt180 -116.39 172.26 7.31 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 126.537 1.935 . . . . 0.0 109.764 177.732 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -111.5 110.68 21.22 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 167.898 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -108.43 143.84 36.83 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.502 0.592 . . . . 0.0 109.49 176.06 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.758 HD21 HD22 ' B' ' 27' ' ' LEU . 8.5 mt -52.97 144.17 15.53 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 122.952 0.501 . . . . 0.0 110.864 169.385 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.28 -30.24 70.35 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 113.747 1.018 . . . . 0.0 113.747 -168.136 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -158.03 155.64 29.69 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 122.737 1.256 . . . . 0.0 111.622 167.387 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -39.95 -32.23 0.15 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 129.751 3.221 . . . . 0.0 113.264 167.185 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -52.95 -51.57 60.96 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.608 1.563 . . . . 0.0 112.844 169.532 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 11.8 mt -69.0 -44.35 72.98 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.225 0.921 . . . . 0.0 110.049 -178.881 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.59 -33.56 55.28 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.252 1.021 . . . . 0.0 112.617 173.52 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -69.61 -54.09 15.67 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.7 1.2 . . . . 0.0 113.479 173.28 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.31 -38.4 91.01 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 120.249 1.386 . . . . 0.0 112.672 178.619 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 60.1 tp -60.86 -41.52 96.08 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.099 1.76 . . . . 0.0 112.872 169.222 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.36 -44.91 6.37 Favored Glycine 0 N--CA 1.474 1.18 0 C-N-CA 127.167 2.318 . . . . 0.0 115.198 -169.062 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -63.15 -27.07 69.12 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 118.297 1.048 . . . . 0.0 109.156 166.641 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 30.6 tp 77.18 163.05 0.23 Allowed 'General case' 0 C--N 1.345 0.38 0 C-N-CA 129.971 3.308 . . . . 0.0 109.487 173.313 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 90' ' ' VAL . . . . . 0.489 HG23 HG12 ' B' ' 92' ' ' VAL . 14.9 m -54.21 -5.77 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 O-C-N 120.203 -1.561 . . . . 0.0 114.564 168.05 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 72.13 -20.32 0.26 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.739 2.015 . . . . 0.0 114.218 164.491 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.489 HG12 HG23 ' B' ' 90' ' ' VAL . 9.2 p -65.66 38.98 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 131.045 3.738 . . . . 0.0 114.275 -177.931 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.1 t 70.97 17.42 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 C-N-CA 126.387 1.875 . . . . 0.0 111.897 175.127 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 56.8 tp 73.95 108.17 0.07 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 129.596 3.158 . . . . 0.0 109.371 -168.507 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -69.69 136.15 50.71 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 175.79 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 22.9 t -89.53 147.45 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 125.725 1.61 . . . . 0.0 113.004 -168.47 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -77.32 33.85 0.16 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 127.24 2.216 . . . . 0.0 114.611 174.144 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.5 p -87.1 150.35 24.06 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.362 1.465 . . . . 0.0 110.128 169.347 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -111.74 126.5 55.13 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 167.728 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 54.3 mm-40 -158.89 153.33 20.41 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 127.482 2.313 . . . . 0.0 108.338 -172.762 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -69.39 140.46 44.11 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 122.512 2.142 . . . . 0.0 111.589 178.379 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 44.6 t -67.13 25.13 0.02 OUTLIER 'General case' 0 CA--C 1.572 1.802 0 C-N-CA 128.468 2.707 . . . . 0.0 113.858 177.904 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 4.3 p -97.51 24.69 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 129.058 2.943 . . . . 0.0 114.499 -167.447 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . 80.03 -31.02 0.13 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 127.284 2.234 . . . . 0.0 115.058 169.795 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -134.37 155.87 49.51 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.869 1.268 . . . . 0.0 112.32 176.588 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . 0.282 22.9 ttt180 . . . . . 0 N--CA 1.477 0.92 1 C-N-CA 134.154 4.981 . . . . 0.0 109.511 168.885 . . . . . . . . 2 1 . 1 . 027 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.7 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 pp -62.95 -38.53 91.41 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.451 1.023 . . . . 0.0 112.81 -169.356 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.49 -26.31 67.83 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 174.221 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.6 mmt-85 -79.33 -43.09 24.24 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.33 -0.843 . . . . 0.0 110.911 168.967 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -56.18 -48.12 76.96 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.904 1.682 . . . . 0.0 112.622 -177.07 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.61 -26.59 71.23 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-O 119.539 -0.589 . . . . 0.0 112.56 -177.02 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.5 tmm_? -70.75 -45.44 64.82 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 118.322 1.061 . . . . 0.0 108.688 166.8 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.01 -22.55 66.97 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.019 1.328 . . . . 0.0 113.988 -176.964 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.7 mp -99.9 -3.45 32.4 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.894 1.225 . . . . 0.0 113.125 168.949 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -86.76 1.38 52.41 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.555 1.142 . . . . 0.0 113.165 167.926 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.82 160.78 71.65 Favored Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 127.177 2.191 . . . . 0.0 114.145 -172.003 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -72.4 -121.68 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.125 1 C-N-CA 126.061 4.508 . . . . 0.0 110.139 173.079 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.9 m -56.97 -21.07 27.51 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.014 1.326 . . . . 0.0 113.405 179.946 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.04 -39.64 79.08 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.6 1.546 . . . . 0.0 112.254 173.547 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 5.7 t -71.28 -28.08 63.88 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.661 -1.274 . . . . 0.0 111.483 169.623 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.9 tpp180 -61.68 -40.25 94.31 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 120.742 -1.224 . . . . 0.0 111.769 170.766 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.496 HG23 HD13 ' A' ' 40' ' ' LEU . 1.9 mm -57.17 -43.49 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 124.873 1.269 . . . . 0.0 112.43 171.585 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 71.6 mt -60.11 -47.0 87.72 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 119.129 -0.462 . . . . 0.0 111.74 174.769 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.4 p -76.55 -26.59 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -171.869 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.84 -21.52 37.54 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 173.334 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.3 tp -77.63 -29.43 51.76 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 120.947 1.703 . . . . 0.0 112.117 170.602 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.42 -49.68 17.77 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.84 2.056 . . . . 0.0 112.51 170.129 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -101.31 29.84 4.53 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 128.538 2.735 . . . . 0.0 110.55 174.703 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -128.02 -84.45 0.45 Allowed Glycine 0 CA--C 1.527 0.791 0 C-N-CA 125.6 1.571 . . . . 0.0 113.256 -177.542 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 26.9 m 31.77 31.4 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 118.347 2.721 . . . . 0.0 118.347 -171.172 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 96.3 m -83.3 -87.33 0.1 Allowed 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 125.316 1.446 . . . . 0.0 110.861 175.821 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -136.37 153.23 76.18 Favored Pre-proline 0 N--CA 1.472 0.63 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -169.569 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -56.53 135.02 68.05 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.991 1.794 . . . . 0.0 109.096 171.882 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.72 -5.89 67.87 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 117.874 -1.515 . . . . 0.0 114.854 -174.961 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.88 -28.89 64.6 Favored 'General case' 0 C--N 1.348 0.539 0 CA-C-N 120.499 2.149 . . . . 0.0 112.38 177.284 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.496 HD13 HG23 ' A' ' 26' ' ' ILE . 4.0 mt -69.09 -16.1 63.6 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 124.262 1.025 . . . . 0.0 111.952 -175.762 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.58 -47.54 66.51 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 119.772 1.169 . . . . 0.0 110.36 174.315 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.48 -39.97 85.26 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.849 -0.532 . . . . 0.0 111.789 172.587 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -71.78 -27.85 63.22 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -175.796 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 37.6 mt -95.96 -22.79 17.19 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.316 1.046 . . . . 0.0 112.16 173.749 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.54 9.81 86.72 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.319 0.961 . . . . 0.0 112.003 -167.97 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 80.3 mt -108.26 167.57 9.93 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.954 1.302 . . . . 0.0 112.445 -169.358 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.7 p -69.15 143.26 54.14 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.526 0.679 . . . . 0.0 112.537 -167.882 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -56.71 -31.49 64.56 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.44 1.096 . . . . 0.0 111.157 172.024 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 12.4 m -66.0 -54.43 26.24 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.14 0.976 . . . . 0.0 111.445 171.096 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -70.43 -35.46 73.41 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.464 1.029 . . . . 0.0 112.239 -175.531 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.405 HG22 HD11 ' A' ' 26' ' ' ILE . 6.3 t -61.78 -34.69 63.61 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 O-C-N 119.57 -1.956 . . . . 0.0 111.865 169.779 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 56.0 m -67.53 -41.93 83.57 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 120.134 1.334 . . . . 0.0 112.523 172.753 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -50.7 -45.98 58.63 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.66 0.784 . . . . 0.0 110.735 171.973 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -68.93 -33.9 74.5 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 -179.189 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 23.8 mt -88.89 -7.32 56.31 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.807 1.243 . . . . 0.0 113.988 -178.172 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.7 t -67.05 -51.18 57.82 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 120.194 1.361 . . . . 0.0 110.886 177.217 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 5.2 t -73.8 -39.84 63.83 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 122.893 0.477 . . . . 0.0 111.76 179.767 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.3 tp -55.25 -38.19 68.21 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.778 2.031 . . . . 0.0 113.556 -174.036 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.7 mtm180 -78.51 -23.11 46.49 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.46 1.104 . . . . 0.0 112.178 -179.741 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -80.49 -55.51 3.41 Favored Glycine 0 C--N 1.342 0.908 0 C-N-CA 125.861 1.696 . . . . 0.0 110.78 172.766 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 66.6 m -51.08 -16.12 0.42 Allowed 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 127.413 2.285 . . . . 0.0 113.164 173.184 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.4 ' O ' ' HB2' ' A' ' 78' ' ' ALA . . . 79.35 -3.24 67.92 Favored Glycine 0 C--N 1.338 0.677 0 C-N-CA 125.91 1.719 . . . . 0.0 113.716 179.468 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 34.5 mt -57.17 -26.57 60.83 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 118.495 1.148 . . . . 0.0 112.323 -179.044 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 6.1 m -133.21 156.88 42.49 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.102 0 C-N-CA 126.488 1.915 . . . . 0.0 111.384 169.204 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.5 m -148.92 151.5 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 126.043 1.737 . . . . 0.0 111.349 -171.907 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -88.4 140.27 29.63 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.355 1.462 . . . . 0.0 112.416 176.94 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 90.2 m -160.84 158.83 29.04 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.774 1.63 . . . . 0.0 107.777 -179.892 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -84.97 138.15 32.66 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 121.57 1.986 . . . . 0.0 112.011 169.6 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.0 -10.2 57.26 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 169.866 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 131.29 -22.5 4.43 Favored Glycine 0 N--CA 1.474 1.205 0 C-N-CA 125.96 1.743 . . . . 0.0 114.751 174.697 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.94 5.71 0.3 Allowed 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.056 2.142 . . . . 0.0 113.886 -179.909 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -152.67 157.64 41.23 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 128.62 2.768 . . . . 0.0 108.043 168.641 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 5.6 p -79.78 145.85 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 168.642 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.9 ptt85 -124.7 148.2 48.16 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 125.535 1.534 . . . . 0.0 109.837 -177.494 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -100.42 135.08 42.41 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 105.443 -2.058 . . . . 0.0 105.443 164.902 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -145.87 158.3 43.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 118.19 -0.909 . . . . 0.0 111.541 -176.003 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 tp -56.53 154.86 8.0 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.064 0.945 . . . . 0.0 112.688 176.342 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 62' ' ' GLY . . . -59.14 -11.08 3.27 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 117.83 2.53 . . . . 0.0 117.83 -175.898 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.0 t70 152.1 161.62 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 131.165 3.786 . . . . 0.0 109.549 -177.371 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -41.33 -22.51 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 129.372 3.069 . . . . 0.0 112.099 163.579 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -64.12 0.96 Allowed 'General case' 0 C--N 1.349 0.563 0 C-N-CA 126.621 1.968 . . . . 0.0 111.485 175.21 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 25.3 mt -56.27 -43.77 79.09 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.701 1.137 . . . . 0.0 108.741 173.928 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.53 -44.65 69.35 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.512 1.125 . . . . 0.0 112.148 -172.884 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -79.67 -15.09 58.22 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 115.706 1.743 . . . . 0.0 115.706 -175.887 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -92.78 -48.45 6.56 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.695 1.134 . . . . 0.0 110.956 170.278 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.5 tp -49.62 -45.83 48.62 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.641 1.976 . . . . 0.0 110.824 169.679 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.81 -19.33 79.31 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 126.796 2.141 . . . . 0.0 116.433 -170.925 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -101.54 -0.88 34.21 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 118.928 1.364 . . . . 0.0 113.047 170.208 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.6 tp 93.7 23.57 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 129.19 2.996 . . . . 0.0 113.68 169.219 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.285 3.9 t 71.34 37.98 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 125.47 1.508 . . . . 0.0 110.04 169.436 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 86.61 -21.98 0.18 Allowed 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.309 -0.869 . . . . 0.0 112.329 130.021 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.9 p -72.66 39.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 129.428 3.091 . . . . 0.0 112.566 171.94 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.6 m 52.44 10.61 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 128.627 2.771 . . . . 0.0 116.425 -179.903 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.8 tt 100.35 101.37 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 130.857 3.663 . . . . 0.0 108.829 -169.719 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -103.1 155.66 18.24 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.258 0.623 . . . . 0.0 111.035 170.255 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 31.3 m -98.24 150.25 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -171.681 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 59.7 p30 -99.57 -4.07 31.92 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 -179.713 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -75.71 40.0 0.18 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 127.708 2.403 . . . . 0.0 115.701 -167.015 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 45.8 t0 62.88 69.56 0.59 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.812 2.045 . . . . 0.0 110.081 170.66 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.97 164.57 33.23 Favored Pre-proline 0 CA--C 1.549 0.925 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.531 -169.879 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -83.21 172.75 10.41 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 124.292 3.328 . . . . 0.0 111.819 177.663 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 31.0 p -62.0 -52.8 62.54 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 123.073 1.416 . . . . 0.0 107.26 165.532 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 2.6 p 171.47 -50.25 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.421 1 C-N-CA 133.032 4.533 . . . . 0.0 109.922 167.116 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.19 -29.0 64.63 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -169.916 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -81.01 140.13 35.35 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.146 0.978 . . . . 0.0 110.653 173.978 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 39.3 ttt85 . . . . . 0 N--CA 1.472 0.636 0 O-C-N 121.523 -0.736 . . . . 0.0 112.233 170.657 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.485 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 pp -60.23 -34.82 74.22 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.63 1.105 . . . . 0.0 113.433 -167.514 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.67 -27.85 68.97 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 118.624 0.647 . . . . 0.0 112.49 175.548 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 1.3 mmt-85 -77.16 -26.36 52.92 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 116.854 -1.546 . . . . 0.0 113.413 176.979 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.71 -63.97 1.03 Allowed 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.785 1.175 . . . . 0.0 109.5 170.928 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.27 -37.71 95.31 Favored Glycine 0 N--CA 1.471 0.972 0 CA-C-N 118.22 0.464 . . . . 0.0 112.704 -172.764 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -46.58 88.98 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.698 0.799 . . . . 0.0 111.292 173.799 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.55 -14.72 61.7 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 118.239 -0.886 . . . . 0.0 112.893 -179.625 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 10.6 mp -93.39 -24.21 18.15 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.169 0.895 . . . . 0.0 112.607 170.624 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.18 -16.64 57.71 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.894 1.678 . . . . 0.0 113.776 169.443 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -59.36 130.64 87.5 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 126.423 1.889 . . . . 0.0 109.511 176.643 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -48.92 -72.3 0.05 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.554 1 C-N-CA 125.869 4.379 . . . . 0.0 111.918 -168.59 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 70.8 m -91.56 -15.43 28.69 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 117.914 -1.041 . . . . 0.0 112.082 -173.739 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 48.4 mtt180 -66.1 -33.97 76.99 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 121.415 1.916 . . . . 0.0 110.779 167.997 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 42.4 t -56.75 -46.03 81.64 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 120.024 1.284 . . . . 0.0 111.15 167.309 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -60.88 -46.71 89.55 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.56 0.744 . . . . 0.0 111.866 176.539 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.6 mm -57.85 -49.93 79.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.953 1.301 . . . . 0.0 112.06 174.706 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 85.8 mt -62.11 -45.34 93.89 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.092 0.957 . . . . 0.0 111.496 -178.767 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 5.7 p -74.81 -32.5 28.37 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 CA-C-N 118.868 0.758 . . . . 0.0 112.979 -179.501 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.95 -28.83 64.77 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.494 -0.754 . . . . 0.0 111.875 173.857 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.7 tp -65.3 -36.27 83.54 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-N 119.973 1.26 . . . . 0.0 113.507 175.509 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.96 -40.57 30.93 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.999 2.52 . . . . 0.0 113.077 171.414 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -98.24 9.14 43.68 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 127.023 2.129 . . . . 0.0 112.307 179.499 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -126.0 -82.61 0.46 Allowed Glycine 0 CA--C 1.527 0.815 0 C-N-CA 124.746 1.165 . . . . 0.0 115.147 -169.725 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 34.6 m 36.93 32.13 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 127.884 2.474 . . . . 0.0 116.707 -168.57 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 68.2 m -79.75 -90.65 0.05 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.662 0.785 . . . . 0.0 111.019 179.716 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -136.72 154.65 76.64 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -169.174 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -55.89 125.69 19.94 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.316 2.011 . . . . 0.0 109.696 175.55 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 90.03 -7.27 81.96 Favored Glycine 0 CA--C 1.533 1.178 0 CA-C-O 117.6 -1.667 . . . . 0.0 115.348 -174.409 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -27.05 63.17 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.666 2.233 . . . . 0.0 112.137 178.938 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 2.1 mp -71.35 -18.88 62.36 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-O 117.913 -1.042 . . . . 0.0 113.075 -177.653 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.09 -40.9 97.24 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.88 1.218 . . . . 0.0 111.206 172.443 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.04 -44.13 66.43 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.652 -0.655 . . . . 0.0 111.714 170.122 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.96 -29.23 70.65 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -177.714 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 45.9 mt -103.76 -14.06 16.21 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.336 1.454 . . . . 0.0 113.824 179.18 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.98 -0.51 45.59 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 119.004 0.82 . . . . 0.0 113.797 -169.153 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 43.3 mt -92.37 157.96 16.33 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.757 1.279 . . . . 0.0 111.653 -171.38 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 13.3 p -62.25 147.43 48.02 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.134 0.492 . . . . 0.0 110.91 -174.594 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 ptp180 -57.94 -33.6 68.98 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 122.148 -0.345 . . . . 0.0 111.834 175.883 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 15.9 m -65.68 -49.29 69.11 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.649 0.779 . . . . 0.0 111.532 171.345 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -66.07 -43.03 88.57 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 118.897 0.771 . . . . 0.0 111.246 -178.612 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 4.2 t -59.88 -32.04 48.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 O-C-N 119.303 -2.123 . . . . 0.0 112.55 170.371 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 54.8 m -67.66 -39.93 84.5 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.922 1.237 . . . . 0.0 113.204 172.468 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -50.15 -46.79 54.3 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.976 0.911 . . . . 0.0 110.715 171.215 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -67.18 -45.42 77.0 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 118.523 -0.751 . . . . 0.0 112.162 -179.311 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 32.2 mt -73.49 -22.55 60.11 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.963 1.098 . . . . 0.0 113.963 -177.828 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -56.49 -53.11 61.27 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.137 1.335 . . . . 0.0 113.685 -176.758 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 2.3 t -70.64 -40.17 73.24 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 118.654 0.661 . . . . 0.0 110.727 177.507 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 2.0 tp -56.23 -38.39 70.99 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 127.796 2.439 . . . . 0.0 114.743 -173.32 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 46.9 mtm105 -78.76 -16.05 57.68 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.276 1.03 . . . . 0.0 112.757 177.43 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -85.4 -54.39 2.84 Favored Glycine 0 C--N 1.341 0.847 0 C-N-CA 125.82 1.676 . . . . 0.0 111.025 169.715 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 99.4 m -50.94 -16.26 0.41 Allowed 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 127.549 2.34 . . . . 0.0 113.296 175.162 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.11 -4.18 59.19 Favored Glycine 0 C--N 1.338 0.684 0 C-N-CA 125.99 1.757 . . . . 0.0 113.526 -178.394 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 68.3 mt -56.11 -28.65 58.65 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.633 1.217 . . . . 0.0 112.286 178.707 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 8.1 m -132.22 155.64 41.68 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 C-N-CA 126.025 1.73 . . . . 0.0 111.451 169.642 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 1.7 m -147.63 151.63 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.73 1.612 . . . . 0.0 111.443 -170.213 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -94.13 140.25 29.98 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.442 1.497 . . . . 0.0 111.544 178.006 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.432 HG22 ' N ' ' B' ' 68' ' ' TYR . 47.7 m -163.15 171.97 15.54 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.547 1.539 . . . . 0.0 108.375 -174.442 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.432 ' N ' HG22 ' B' ' 67' ' ' THR . 6.5 m-85 -88.15 145.04 26.13 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 121.04 1.746 . . . . 0.0 111.878 167.807 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.19 -44.71 13.68 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.461 -0.774 . . . . 0.0 111.328 170.533 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.25 -25.55 0.03 OUTLIER Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.553 1.549 . . . . 0.0 114.266 171.368 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.76 -29.73 0.78 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.042 1.737 . . . . 0.0 112.751 176.952 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -117.38 166.55 12.18 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.326 2.25 . . . . 0.0 110.255 176.982 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 8.7 p -79.78 147.93 6.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.641 172.255 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 14.0 ptt85 -130.65 160.93 32.77 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 127.983 2.513 . . . . 0.0 109.646 -177.306 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 21.2 m-30 -104.59 146.56 28.73 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 161.924 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -148.72 157.97 43.82 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 124.376 1.07 . . . . 0.0 110.299 178.807 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 58.3 mt -62.56 155.28 26.34 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.604 0.638 . . . . 0.0 111.529 172.279 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -50.49 -21.5 1.52 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 128.155 2.582 . . . . 0.0 117.3 -176.128 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 8.3 t70 167.4 168.2 0.03 OUTLIER 'General case' 0 C--O 1.24 0.558 0 C-N-CA 130.669 3.588 . . . . 0.0 108.282 177.167 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -42.02 -20.25 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.782 2.433 . . . . 0.0 111.778 162.087 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -63.18 1.3 Allowed 'General case' 0 C--N 1.346 0.415 0 C-N-CA 127.885 2.474 . . . . 0.0 111.742 175.5 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 34.1 mt -65.1 -35.86 82.46 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.384 0.993 . . . . 0.0 109.683 176.25 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.65 -41.72 82.05 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 177.238 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -81.76 -21.59 37.73 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -176.678 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -85.84 -44.31 12.55 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.024 0.829 . . . . 0.0 111.567 171.204 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.74 -39.93 88.13 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 122.762 0.425 . . . . 0.0 111.042 175.564 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.15 -18.96 58.75 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.686 1.612 . . . . 0.0 115.638 -176.698 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.6 -2.23 25.38 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 169.877 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 17.6 tp 106.17 2.26 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 130.596 3.559 . . . . 0.0 114.476 167.542 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . 0.306 2.9 t 80.58 40.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 125.939 1.696 . . . . 0.0 110.068 -177.871 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 86.81 -26.41 0.09 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.367 -0.833 . . . . 0.0 113.049 127.046 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 13.7 p -68.58 31.1 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.918 1 C-N-CA 131.787 4.035 . . . . 0.0 113.595 175.955 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 31.1 m 47.08 25.62 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 127.334 2.254 . . . . 0.0 115.84 -177.107 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt 97.74 98.78 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 130.502 3.521 . . . . 0.0 110.506 -179.348 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -102.25 144.13 31.15 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.872 -0.517 . . . . 0.0 110.691 169.567 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 33.4 m -90.6 156.65 3.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 C-N-CA 124.272 1.029 . . . . 0.0 113.375 -173.327 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -102.19 -8.14 21.59 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 178.005 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.77 44.07 0.16 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 128.169 2.588 . . . . 0.0 116.333 -166.142 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 43.8 t0 56.46 64.87 1.56 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 127.465 2.306 . . . . 0.0 110.048 168.971 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.9 167.91 16.77 Favored Pre-proline 0 CA--C 1.556 1.207 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.388 -177.814 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -80.42 173.84 11.94 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.685 2.924 . . . . 0.0 112.118 -179.198 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 30.0 p -58.93 -50.11 75.29 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 166.501 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 4.8 p 168.37 -47.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.384 1 C-N-CA 132.498 4.319 . . . . 0.0 109.9 167.629 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.26 -34.61 68.36 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.82 1.248 . . . . 0.0 113.675 -170.185 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -76.26 150.43 37.0 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.588 1.155 . . . . 0.0 110.563 174.238 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 43.4 ttt85 . . . . . 0 N--CA 1.472 0.648 0 O-C-N 121.261 -0.9 . . . . 0.0 112.568 173.425 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.247 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 pp -57.8 -37.27 73.44 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.859 0.754 . . . . 0.0 111.588 179.345 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.29 -11.2 60.61 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.167 0.987 . . . . 0.0 113.27 -179.176 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.0 mmp_? -108.5 -25.62 10.84 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.731 -1.231 . . . . 0.0 113.354 171.215 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -53.82 -45.78 70.95 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.408 1.083 . . . . 0.0 109.464 169.267 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.03 -36.6 93.24 Favored Glycine 0 CA--C 1.535 1.287 0 CA-C-O 119.349 -0.695 . . . . 0.0 113.365 175.148 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -45.65 92.09 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 118.975 1.388 . . . . 0.0 110.311 177.602 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.46 98.09 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.565 1.146 . . . . 0.0 111.94 176.756 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.6 mt -78.61 -15.11 58.91 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 117.918 -1.039 . . . . 0.0 113.271 177.612 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.86 -26.8 25.46 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 169.74 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -47.83 143.37 6.24 Favored Pre-proline 0 CA--C 1.543 0.689 0 C-N-CA 126.069 1.747 . . . . 0.0 113.571 -173.865 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -61.15 -74.62 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.607 1 C-N-CA 125.604 4.202 . . . . 0.0 111.956 -169.762 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 46.7 m -59.1 -37.94 78.35 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 121.834 -0.541 . . . . 0.0 110.429 172.092 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.55 -32.38 68.04 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -169.019 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.7 t -64.88 -46.89 79.89 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 121.369 1.895 . . . . 0.0 108.273 167.28 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 32.9 ttm-85 -62.55 -15.83 52.87 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.157 1.383 . . . . 0.0 114.661 175.28 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.3 mt -71.71 -55.93 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 CA-C-N 121.46 1.937 . . . . 0.0 108.886 167.571 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.02 -33.24 70.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 117.889 -1.053 . . . . 0.0 113.685 -172.269 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.4 m -60.48 -27.25 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 CA-C-N 119.658 1.117 . . . . 0.0 112.072 173.974 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -104.17 8.05 36.24 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.616 1.966 . . . . 0.0 112.398 -179.038 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.465 HD22 ' HA ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -104.94 -22.12 13.19 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.016 1.726 . . . . 0.0 113.061 172.013 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.14 -59.14 5.75 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.411 1.885 . . . . 0.0 107.007 166.298 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -96.77 35.52 1.52 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 128.213 2.605 . . . . 0.0 112.202 173.716 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -110.61 -98.89 2.51 Favored Glycine 0 N--CA 1.472 1.049 0 O-C-N 120.889 -1.132 . . . . 0.0 113.721 -172.152 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.4 m 43.35 14.67 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 N-CA-C 120.268 3.433 . . . . 0.0 120.268 173.07 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 72.6 m -80.7 -89.88 0.06 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.347 0.976 . . . . 0.0 111.058 175.699 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.461 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 0.5 OUTLIER -133.02 158.14 76.6 Favored Pre-proline 0 CA--C 1.55 0.977 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -168.077 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -59.57 131.22 39.15 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.438 2.759 . . . . 0.0 110.717 177.867 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.09 -2.47 18.6 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-O 117.783 -1.565 . . . . 0.0 115.079 -179.072 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.461 ' HG2' ' H ' ' A' ' 36' ' ' TYR . 2.6 pp0? -60.21 -30.32 69.3 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 120.468 2.134 . . . . 0.0 111.71 -178.637 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 mt -46.87 -26.95 1.08 Allowed 'General case' 0 C--O 1.219 -0.535 0 C-N-CA 126.141 1.777 . . . . 0.0 112.992 174.555 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.74 -39.71 71.53 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 175.096 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.68 -42.77 57.83 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.139 0.881 . . . . 0.0 111.467 172.361 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -31.2 70.38 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 125.689 1.596 . . . . 0.0 113.698 -178.502 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 25.7 mt -103.18 -13.98 16.56 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.814 2.046 . . . . 0.0 113.521 178.854 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.33 3.92 67.35 Favored Glycine 0 CA--C 1.538 1.512 0 C-N-CA 125.164 1.364 . . . . 0.0 114.569 -171.084 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.5 mt -93.04 169.06 10.71 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.758 1.223 . . . . 0.0 112.142 -171.258 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.491 HG23 ' H ' ' A' ' 50' ' ' ASN . 1.3 t -70.65 141.72 51.65 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 120.915 -1.116 . . . . 0.0 110.857 169.339 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -62.78 -11.67 19.3 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.06 0.944 . . . . 0.0 112.949 169.695 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 41.0 t -71.0 -58.44 3.57 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.555 1.142 . . . . 0.0 111.157 167.811 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.491 ' H ' HG23 ' A' ' 47' ' ' THR . 41.6 t-20 -55.08 -49.33 71.93 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.851 1.66 . . . . 0.0 110.811 173.394 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 5.0 t -60.08 -44.59 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-O 117.91 -1.043 . . . . 0.0 112.302 175.326 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 60.0 m -69.76 -35.66 75.12 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 121.335 1.88 . . . . 0.0 113.705 -179.686 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -50.54 -46.58 57.54 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.536 0.734 . . . . 0.0 110.887 172.14 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -82.2 -13.04 57.71 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 175.82 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 92.3 mt -78.78 -26.72 44.46 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 122.117 2.235 . . . . 0.0 110.906 168.637 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.0 m -45.51 -55.93 5.65 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.662 1.119 . . . . 0.0 113.08 172.917 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 1.7 t -93.2 4.64 53.66 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 179.388 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.7 tp -83.72 -40.68 18.56 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.871 -1.143 . . . . 0.0 108.657 167.159 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.2 mtm105 -76.86 -28.76 55.56 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.618 1.567 . . . . 0.0 110.585 173.552 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.71 -64.25 3.55 Favored Glycine 0 C--N 1.345 1.05 0 C-N-CA 125.431 1.491 . . . . 0.0 110.909 174.744 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 49.5 m -65.89 5.72 0.45 Allowed 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 125.7 1.6 . . . . 0.0 114.6 176.202 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.62 -2.4 31.59 Favored Glycine 0 N--CA 1.471 0.974 0 C-N-CA 126.03 1.776 . . . . 0.0 114.973 176.031 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 72.1 mt -59.85 -25.67 65.22 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.718 1.259 . . . . 0.0 113.51 -175.689 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.7 m -123.83 140.77 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.755 1.622 . . . . 0.0 111.815 169.002 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 51.6 t -118.61 138.64 48.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 127.18 2.192 . . . . 0.0 110.025 -175.988 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.49 143.05 40.7 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.605 1.162 . . . . 0.0 111.254 172.574 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.8 m -164.72 150.04 9.89 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 120.256 -1.528 . . . . 0.0 109.644 -176.788 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -84.16 126.34 33.02 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.166 1.348 . . . . 0.0 110.061 165.557 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.282 0.0 OUTLIER -74.34 -41.47 61.03 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.477 0.581 . . . . 0.0 111.844 174.817 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 162.08 -30.36 0.3 Allowed Glycine 0 CA--C 1.531 1.073 0 C-N-CA 125.476 1.512 . . . . 0.0 114.116 169.724 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -112.58 -17.82 12.53 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 127.055 2.142 . . . . 0.0 112.61 172.116 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -151.21 164.27 36.95 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.81 2.444 . . . . 0.0 110.415 -171.913 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 4.2 p -82.55 152.89 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 123.559 0.743 . . . . 0.0 110.51 168.833 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.2 ptt180 -136.96 162.34 33.54 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 126.316 1.846 . . . . 0.0 111.3 -172.755 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -116.68 123.46 47.3 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.142 0.977 . . . . 0.0 108.466 166.463 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -125.3 149.11 48.38 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 117.011 -1.471 . . . . 0.0 110.989 -178.531 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.7 mp -61.0 151.28 31.03 Favored 'General case' 0 C--N 1.348 0.508 0 C-N-CA 118.697 -1.201 . . . . 0.0 108.562 170.291 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.04 -28.78 69.31 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 114.534 -1.212 . . . . 0.0 113.924 -168.912 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -171.7 161.66 6.09 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.644 2.378 . . . . 0.0 111.169 169.604 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.1 m -34.99 -32.73 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 131.024 3.729 . . . . 0.0 113.434 165.505 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -59.8 -56.0 27.3 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.895 1.678 . . . . 0.0 111.078 175.471 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -39.49 89.99 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 120.462 1.483 . . . . 0.0 110.977 176.827 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.7 -37.49 73.58 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-O 119.023 -0.513 . . . . 0.0 112.299 176.779 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -67.17 -45.79 75.96 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 119.433 1.015 . . . . 0.0 113.173 176.929 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.82 -42.94 80.74 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.44 1.018 . . . . 0.0 110.423 -177.229 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -61.83 -28.64 69.63 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 170.854 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.6 -30.18 76.86 Favored Glycine 0 CA--C 1.538 1.528 0 O-C-N 121.0 -1.062 . . . . 0.0 113.917 169.585 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -101.43 22.62 12.3 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 119.089 1.445 . . . . 0.0 111.698 166.551 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 19.4 tp 63.9 -40.88 0.23 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 131.005 3.722 . . . . 0.0 114.254 -171.694 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -170.8 -61.84 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 128.975 2.91 . . . . 0.0 108.481 -172.431 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 174.06 -35.06 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 126.347 1.859 . . . . 0.0 111.126 -173.371 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.1 p -73.48 26.33 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -171.39 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 62.87 25.27 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 125.107 1.363 . . . . 0.0 111.985 172.811 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.5 mp 90.95 95.44 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 131.573 3.949 . . . . 0.0 112.457 175.573 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.93 152.93 44.77 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 166.278 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.407 HG12 ' H ' ' A' ' 98' ' ' THR . 3.4 t -79.33 139.29 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.612 1.565 . . . . 0.0 112.504 -167.718 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -71.29 4.2 3.07 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 125.48 1.512 . . . . 0.0 114.514 174.55 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.407 ' H ' HG12 ' A' ' 96' ' ' VAL . 26.0 p -72.14 111.62 7.52 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 120.88 -1.138 . . . . 0.0 108.218 168.872 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -76.16 113.11 13.33 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 174.35 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -129.97 154.61 81.22 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-O 117.606 -1.188 . . . . 0.0 107.817 179.773 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -67.37 -18.93 49.99 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.505 2.137 . . . . 0.0 114.19 179.365 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . 0.394 1.8 t 136.06 -165.63 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.773 1 C-N-CA 134.117 4.967 . . . . 0.0 112.373 167.221 . . . . . . . . 3 2 . 1 . 029 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 42.0 t -110.62 -47.36 6.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 111.586 -2.552 . . . . 0.0 110.707 -165.156 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -134.31 32.28 3.41 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.139 1.376 . . . . 0.0 111.382 166.481 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -141.94 173.71 11.26 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.226 1.41 . . . . 0.0 108.478 169.245 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.4 ptt180 . . . . . 0 CA--C 1.528 0.097 0 C-N-CA 123.868 0.867 . . . . 0.0 112.02 -179.816 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.519 0 CA-C-O 119.342 -0.361 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 pp -59.76 -40.78 89.32 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.586 1.085 . . . . 0.0 113.009 -175.326 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.97 -14.29 62.64 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.213 1.005 . . . . 0.0 112.975 175.905 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 15.7 mmp_? -93.14 -33.56 13.99 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 120.764 -1.21 . . . . 0.0 112.22 169.473 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -57.3 -55.44 34.79 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.527 1.058 . . . . 0.0 109.317 169.725 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.56 -33.83 88.27 Favored Glycine 0 CA--C 1.53 0.996 0 CA-C-N 118.715 0.689 . . . . 0.0 112.311 -178.447 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -46.99 87.53 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 118.347 1.074 . . . . 0.0 110.207 171.33 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.67 -15.83 63.17 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.42 1.488 . . . . 0.0 113.506 -178.177 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.3 mp -102.71 -12.73 17.44 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.972 0.909 . . . . 0.0 112.586 169.272 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.45 -7.93 59.65 Favored 'General case' 0 CA--C 1.554 1.134 0 N-CA-C 116.985 2.217 . . . . 0.0 116.985 174.573 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -73.0 161.72 78.04 Favored Pre-proline 0 CA--C 1.543 0.707 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -168.822 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -58.82 -70.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.868 1 C-N-CA 125.455 4.103 . . . . 0.0 111.518 168.465 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 24.6 m -75.68 -43.03 49.47 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 117.902 -1.047 . . . . 0.0 111.939 -179.506 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.426 ' HD2' HD13 ' B' ' 58' ' ' LEU . 0.3 OUTLIER -64.29 -40.27 95.61 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 121.006 1.73 . . . . 0.0 115.211 -169.643 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 14.6 t -60.85 -45.06 96.0 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 120.153 1.342 . . . . 0.0 110.351 170.867 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 33.0 ttm-85 -62.49 -23.67 67.05 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.464 1.106 . . . . 0.0 113.556 175.364 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 mt -67.99 -57.13 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 120.156 1.344 . . . . 0.0 107.837 166.928 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 61.8 mt -55.6 -41.83 73.99 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 117.715 -1.136 . . . . 0.0 112.743 -174.367 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.1 m -61.35 -30.72 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-N 119.896 1.225 . . . . 0.0 112.65 176.652 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -95.62 -3.81 45.6 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.302 1.441 . . . . 0.0 112.525 -176.291 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.418 HD22 ' HA ' ' B' ' 30' ' ' LEU . 0.1 OUTLIER -90.67 -23.01 20.88 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 175.945 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.14 -61.21 2.37 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 128.806 2.842 . . . . 0.0 110.167 170.574 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -91.66 7.83 39.71 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 126.593 1.957 . . . . 0.0 113.078 175.655 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.87 -85.9 1.17 Allowed Glycine 0 N--CA 1.47 0.909 0 C-N-CA 125.02 1.295 . . . . 0.0 114.179 -168.376 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 20.9 m 39.14 15.83 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 N-CA-C 120.95 3.685 . . . . 0.0 120.95 179.793 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 69.6 m -79.39 -91.45 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.465 1.03 . . . . 0.0 111.791 -178.12 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 36' ' ' TYR . . . . . 0.513 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 1.8 m-85 -137.88 161.56 59.27 Favored Pre-proline 0 CA--C 1.555 1.161 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -168.216 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -55.61 132.41 51.95 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 123.285 2.657 . . . . 0.0 110.396 174.943 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.05 -6.57 26.92 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 117.686 -1.619 . . . . 0.0 114.827 -179.341 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 39' ' ' GLN . . . . . 0.513 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 2.6 pp0? -56.67 -36.14 69.23 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.686 1.743 . . . . 0.0 111.292 -179.689 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 8.7 mt -50.17 -32.84 17.24 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 125.103 1.361 . . . . 0.0 112.235 176.42 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.8 -53.16 58.85 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.496 0.589 . . . . 0.0 111.334 -177.751 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.5 -39.07 88.5 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.078 0.551 . . . . 0.0 112.083 175.797 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -63.23 -27.23 69.21 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.835 1.654 . . . . 0.0 113.708 179.175 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 18.0 mt -99.15 -21.48 16.12 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 126.144 1.778 . . . . 0.0 112.818 175.385 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.7 10.84 83.73 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 124.957 1.265 . . . . 0.0 113.737 -170.411 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 69.6 mt -105.87 168.87 8.83 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.381 1.473 . . . . 0.0 112.53 -170.727 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.53 HG23 ' H ' ' B' ' 50' ' ' ASN . 3.3 t -71.96 138.34 47.97 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 120.798 -1.188 . . . . 0.0 111.748 170.276 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 23.2 ptt180 -59.72 -17.39 34.35 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.165 1.386 . . . . 0.0 112.587 169.628 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 39.2 t -66.79 -58.13 5.66 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 119.91 1.232 . . . . 0.0 112.142 168.882 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 50' ' ' ASN . . . . . 0.53 ' H ' HG23 ' B' ' 47' ' ' THR . 35.0 t-20 -56.84 -51.71 67.95 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.501 1.521 . . . . 0.0 110.548 173.285 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 94.0 t -62.01 -37.65 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-O 118.305 -0.855 . . . . 0.0 112.02 -178.647 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 24.5 m -74.91 -35.49 62.22 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 120.89 1.677 . . . . 0.0 113.857 175.648 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -50.88 -45.28 59.95 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.127 0.876 . . . . 0.0 111.64 170.628 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -75.64 -19.82 58.92 Favored 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 174.673 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 28.5 mt -80.02 -20.68 44.79 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.501 1.5 . . . . 0.0 113.192 171.586 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 43.4 m -44.09 -55.86 4.44 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 120.161 1.346 . . . . 0.0 112.323 172.416 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.8 t -93.44 -10.79 33.88 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 179.28 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.426 HD13 ' HD2' ' B' ' 23' ' ' ARG . 6.4 tp -69.34 -34.62 74.9 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.446 -1.408 . . . . 0.0 109.621 168.645 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.4 ' HG2' HG23 ' B' ' 64' ' ' VAL . 74.7 mtm180 -80.77 -22.26 40.3 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.798 1.239 . . . . 0.0 112.683 169.72 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -69.79 -65.44 2.56 Favored Glycine 0 N--CA 1.472 1.092 0 C-N-CA 125.21 1.386 . . . . 0.0 111.571 175.7 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 56.3 m -67.23 5.12 0.77 Allowed 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 125.796 1.639 . . . . 0.0 114.338 175.23 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.07 6.53 79.64 Favored Glycine 0 C--N 1.343 0.961 0 O-C-N 120.85 -1.157 . . . . 0.0 114.188 172.57 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.404 HD12 HD12 ' B' ' 58' ' ' LEU . 98.4 mt -62.12 -31.41 71.86 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.748 1.219 . . . . 0.0 112.929 179.605 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.4 HG23 ' HG2' ' B' ' 59' ' ' ARG . 1.6 m -125.18 136.02 62.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 126.214 1.805 . . . . 0.0 112.333 170.99 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 47.3 t -119.11 137.98 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 127.357 2.263 . . . . 0.0 111.35 -171.242 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.22 142.75 34.36 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.831 1.252 . . . . 0.0 112.613 173.463 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.9 m -167.4 142.49 3.93 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 117.034 -1.46 . . . . 0.0 111.768 -173.993 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -74.72 121.03 21.07 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 121.31 1.868 . . . . 0.0 109.276 165.658 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.305 0.0 OUTLIER -68.24 -55.72 11.22 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 118.234 -0.888 . . . . 0.0 109.858 175.185 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -173.55 -32.7 0.03 OUTLIER Glycine 0 CA--C 1.535 1.287 0 C-N-CA 125.769 1.652 . . . . 0.0 113.984 169.171 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 29.2 tpt180 -114.0 -19.45 11.41 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.601 2.36 . . . . 0.0 113.413 176.729 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -149.55 164.9 33.8 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 128.468 2.707 . . . . 0.0 109.926 -170.821 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 4.2 p -79.32 147.15 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 121.22 -0.925 . . . . 0.0 109.845 168.672 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -128.68 160.96 30.83 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 127.043 2.137 . . . . 0.0 110.674 -176.18 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -111.39 121.4 45.13 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 106.873 -1.529 . . . . 0.0 106.873 167.069 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -123.42 154.65 38.75 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 117.156 -1.402 . . . . 0.0 111.243 174.741 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 mp -66.87 152.8 44.94 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 117.771 -1.572 . . . . 0.0 106.886 166.602 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.8 -24.05 67.56 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -170.401 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -173.66 161.34 3.91 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.931 1.692 . . . . 0.0 112.157 171.197 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -36.92 -34.55 0.08 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 130.504 3.521 . . . . 0.0 113.523 166.251 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 22.1 t60 -62.82 -52.44 63.14 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.707 1.203 . . . . 0.0 110.425 177.854 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -41.65 93.64 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 120.471 1.487 . . . . 0.0 111.076 175.206 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.26 -35.04 69.25 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 178.104 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 3.2 ptm85 -74.21 -39.1 63.36 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 177.566 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.15 -44.41 84.22 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.452 1.024 . . . . 0.0 110.058 176.144 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -54.33 -42.27 70.01 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.248 0.619 . . . . 0.0 111.597 169.76 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -60.83 -19.84 56.3 Favored Glycine 0 CA--C 1.541 1.683 0 C-N-CA 124.858 1.218 . . . . 0.0 115.184 177.037 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . 0.253 9.7 pt-20 -121.14 25.49 9.53 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.343 1.571 . . . . 0.0 112.626 165.961 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 58.0 tp 66.54 -49.3 0.45 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 131.229 3.812 . . . . 0.0 113.058 -173.363 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 33.5 t -153.48 -51.76 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 C-N-CA 128.649 2.78 . . . . 0.0 107.87 169.502 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 175.54 -22.06 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.992 1.317 . . . . 0.0 114.452 -160.619 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 8.4 p -74.49 26.64 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 O-C-N 120.247 -1.533 . . . . 0.0 113.508 -178.283 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 61.18 28.05 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.919 0 C-N-CA 124.346 1.058 . . . . 0.0 111.319 176.137 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.8 mp 75.13 111.35 0.07 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 130.247 3.419 . . . . 0.0 113.435 -171.902 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -76.31 169.47 18.16 Favored 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 163.307 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 16.0 t -82.24 141.1 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 O-C-N 120.832 -1.167 . . . . 0.0 112.814 -168.793 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -75.18 61.11 1.11 Allowed 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.565 1.146 . . . . 0.0 112.254 167.968 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 18.1 p -127.0 135.85 51.42 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 125.952 1.701 . . . . 0.0 107.75 168.39 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -87.86 116.98 26.4 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 170.105 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -144.33 160.59 48.04 Favored Pre-proline 0 CA--C 1.544 0.736 0 C-N-CA 125.425 1.49 . . . . 0.0 108.514 -172.912 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -78.25 40.53 0.9 Allowed 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.91 3.74 . . . . 0.0 113.781 175.516 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 1.8 t 58.5 -146.23 0.53 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.625 1.97 . . . . 0.0 113.082 -178.145 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 21.9 t -122.8 -45.35 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.921 1.288 . . . . 0.0 112.729 -168.13 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -132.69 40.99 3.22 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.908 1.283 . . . . 0.0 111.053 168.981 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.95 -170.1 2.1 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 128.225 2.61 . . . . 0.0 107.472 171.572 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . 0.311 31.5 ptt180 . . . . . 0 N--CA 1.485 1.296 0 C-N-CA 128.135 2.574 . . . . 0.0 115.644 168.195 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.441 ' HB1' ' HB2' ' A' ' 13' ' ' ARG . . . . . . . . 0 CA--C 1.536 0.416 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.0 tp -56.41 -34.16 66.49 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 120.606 -1.309 . . . . 0.0 112.188 173.663 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -49.05 -39.09 26.14 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.17 1.788 . . . . 0.0 112.354 169.888 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.441 ' HB2' ' HB1' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -63.93 -14.76 56.16 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 126.109 1.764 . . . . 0.0 112.845 -176.862 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -72.01 -58.01 3.8 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.782 0.833 . . . . 0.0 108.954 167.006 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -57.65 -32.46 65.28 Favored Glycine 0 C--N 1.337 0.622 0 CA-C-O 118.681 -1.066 . . . . 0.0 112.263 -169.789 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.42 -22.26 65.54 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.044 1.422 . . . . 0.0 111.552 177.267 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -80.78 -17.14 51.87 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.324 -1.485 . . . . 0.0 113.699 172.325 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.7 mp -103.34 -18.14 14.98 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.527 0.731 . . . . 0.0 112.224 172.425 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' B' ' 12' ' ' ALA . . . -65.77 15.63 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 129.366 3.066 . . . . 0.0 116.355 177.071 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.97 145.38 30.39 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 126.554 1.942 . . . . 0.0 109.418 -177.168 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -62.48 -84.96 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.68 1 C-N-CA 126.059 4.506 . . . . 0.0 112.309 -169.298 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 85.8 m -44.45 -40.72 5.73 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 126.203 1.801 . . . . 0.0 111.282 170.857 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.8 ttp180 -74.6 -32.65 62.42 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 116.249 1.944 . . . . 0.0 116.249 -168.667 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 50.5 t -63.37 -39.79 95.49 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 120.377 1.444 . . . . 0.0 109.616 168.287 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 39.2 mtt180 -65.17 -40.1 93.83 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.429 1.092 . . . . 0.0 111.459 176.63 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 8.7 mt -47.6 -56.45 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-N 119.623 1.101 . . . . 0.0 110.981 167.541 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 74.6 mt -60.04 -44.65 94.51 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.263 -1.335 . . . . 0.0 112.695 -178.222 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -66.09 -31.38 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 120.18 1.355 . . . . 0.0 113.251 174.456 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.78 7.34 21.01 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.789 2.035 . . . . 0.0 114.433 173.611 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.553 HD22 ' HA ' ' A' ' 76' ' ' ALA . 7.1 mt -101.44 -28.91 12.31 Favored 'General case' 0 N--CA 1.435 -1.177 0 C-N-CA 126.917 2.087 . . . . 0.0 113.054 167.374 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 mt -62.41 -42.14 99.21 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 124.435 1.085 . . . . 0.0 109.169 168.588 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -124.59 86.96 2.64 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.9 2.08 . . . . 0.0 110.91 169.91 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -171.34 -86.21 0.06 OUTLIER Glycine 0 N--CA 1.474 1.216 0 C-N-CA 127.263 2.363 . . . . 0.0 113.227 174.415 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 18.5 m 37.36 38.31 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 127.485 2.314 . . . . 0.0 116.79 -179.267 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.409 ' HB2' ' HG2' ' A' ' 39' ' ' GLN . 9.4 m -83.76 -79.53 0.2 Allowed 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 126.374 1.87 . . . . 0.0 110.568 -176.729 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -147.83 145.34 20.86 Favored Pre-proline 0 N--CA 1.475 0.784 0 C-N-CA 125.696 1.598 . . . . 0.0 110.209 -172.226 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.97 -10.34 22.55 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.023 2.482 . . . . 0.0 116.676 -169.138 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.65 -2.39 40.28 Favored Glycine 0 CA--C 1.539 1.562 0 CA-C-N 119.885 1.22 . . . . 0.0 114.871 169.219 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.43 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -60.46 -29.4 69.02 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.034 1.334 . . . . 0.0 113.292 -171.959 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 29.4 mt -49.97 -28.28 6.6 Favored 'General case' 0 C--O 1.218 -0.588 0 C-N-CA 125.878 1.671 . . . . 0.0 111.808 179.602 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -75.07 -32.95 61.61 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -173.616 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.89 -36.57 28.01 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.153 0.501 . . . . 0.0 110.697 169.037 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.43 ' CD2' HE22 ' A' ' 39' ' ' GLN . 11.3 t60 -73.39 -31.59 63.98 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 -174.131 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.8 mt -96.09 -19.43 19.42 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.692 1.597 . . . . 0.0 112.676 172.66 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.07 -5.12 20.53 Favored Glycine 0 CA--C 1.536 1.386 0 CA-C-O 118.832 -0.982 . . . . 0.0 113.594 -168.471 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -73.71 133.71 43.4 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.608 1.563 . . . . 0.0 109.891 175.578 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.4 t -60.83 146.02 47.81 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.646 1.112 . . . . 0.0 111.511 -177.283 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.428 ' CD ' ' H ' ' A' ' 48' ' ' ARG . 0.0 OUTLIER -55.0 -29.72 57.94 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 -174.659 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.2 m -63.86 -48.76 75.45 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.059 0.845 . . . . 0.0 112.374 170.408 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -64.37 -46.27 84.13 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.901 1.68 . . . . 0.0 110.968 178.039 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 1.2 t -56.66 -44.57 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 124.17 0.988 . . . . 0.0 111.905 170.181 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 97.2 p -67.62 -38.38 83.83 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.725 1.148 . . . . 0.0 113.971 179.423 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -56.94 -52.19 66.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.748 1.219 . . . . 0.0 109.839 174.976 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -72.15 -27.59 62.69 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 120.825 -1.172 . . . . 0.0 113.983 177.464 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 34.6 mt -67.85 -33.13 74.17 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 121.473 1.942 . . . . 0.0 112.566 169.59 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.7 m -59.51 -34.59 72.8 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.404 0.682 . . . . 0.0 112.006 -177.939 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.462 ' SG ' ' HB2' ' B' ' 104' ' ' ALA . 34.1 t -75.87 -43.07 47.33 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.673 -0.642 . . . . 0.0 111.912 173.624 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.3 tp -71.32 -39.4 71.43 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.589 1.556 . . . . 0.0 112.848 -169.243 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -74.09 -7.86 54.05 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.605 1.162 . . . . 0.0 111.766 173.186 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -100.05 -40.39 3.08 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.749 1.642 . . . . 0.0 113.452 172.997 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.3 m -75.35 1.11 14.64 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.043 1.737 . . . . 0.0 112.688 170.661 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.24 2.92 80.78 Favored Glycine 0 N--CA 1.467 0.709 0 C-N-CA 127.42 2.438 . . . . 0.0 116.494 166.778 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 76.5 mt -71.43 -20.04 62.16 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.623 1.712 . . . . 0.0 113.893 -175.001 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.454 HG12 ' CD1' ' A' ' 30' ' ' LEU . 6.3 m -126.97 140.35 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.226 1.411 . . . . 0.0 113.791 -178.559 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.1 t -141.33 142.24 29.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.974 -170.821 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.14 148.02 23.24 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.357 1.463 . . . . 0.0 113.582 171.833 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -135.49 178.6 6.91 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.124 1.769 . . . . 0.0 106.964 167.923 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -96.11 128.79 43.34 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 166.368 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -19.43 60.06 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.25 1.02 . . . . 0.0 112.492 168.948 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 128.16 -40.95 1.65 Allowed Glycine 0 N--CA 1.471 1.002 0 C-N-CA 125.526 1.536 . . . . 0.0 112.381 172.85 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -91.94 -38.1 12.47 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.599 1.959 . . . . 0.0 110.733 171.819 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.23 -175.84 4.59 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.945 2.098 . . . . 0.0 110.693 177.793 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.6 151.42 5.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 C-N-CA 123.481 0.712 . . . . 0.0 109.838 168.013 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -120.91 -173.31 2.57 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 126.918 2.087 . . . . 0.0 108.861 167.234 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.521 ' CE2' HD21 ' A' ' 30' ' ' LEU . 0.8 OUTLIER -145.07 161.29 39.81 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.65 1.18 . . . . 0.0 108.122 -179.393 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.553 ' HA ' HD22 ' A' ' 30' ' ' LEU . . . -166.9 159.49 13.54 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 120.669 1.577 . . . . 0.0 112.887 -168.957 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -60.7 137.11 58.22 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 165.668 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.32 -23.38 66.73 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.785 1.402 . . . . 0.0 114.785 -173.8 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -159.23 161.72 36.09 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.267 1.027 . . . . 0.0 113.17 168.722 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 54.6 p -42.91 -35.33 1.17 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.572 1.949 . . . . 0.0 112.76 166.877 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -48.81 77.68 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.581 1.552 . . . . 0.0 112.764 177.661 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.7 mt -69.65 -47.24 64.03 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.75 1.159 . . . . 0.0 109.003 179.226 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.03 -16.82 3.12 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.853 1.661 . . . . 0.0 114.552 172.437 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -79.23 -67.05 0.79 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.821 1.248 . . . . 0.0 109.996 176.373 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.72 -32.49 72.72 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 178.941 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 tp -68.17 -32.61 72.98 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.766 1.627 . . . . 0.0 111.441 169.662 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.17 -36.52 9.87 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 127.273 2.368 . . . . 0.0 115.632 -172.02 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.83 -9.76 58.86 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 119.75 1.775 . . . . 0.0 112.853 169.17 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.2 tt 67.87 142.31 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 127.002 2.121 . . . . 0.0 108.031 -170.906 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 33.9 m -69.71 19.41 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 O-C-N 120.328 -1.483 . . . . 0.0 114.091 -175.107 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 47.3 mm-40 77.08 -13.88 0.9 Allowed 'General case' 0 N--CA 1.447 -0.598 0 O-C-N 120.685 -1.26 . . . . 0.0 113.707 156.519 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.2 p -68.38 35.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 126.966 2.106 . . . . 0.0 115.605 -177.105 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.3 t 69.07 4.76 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 125.941 1.696 . . . . 0.0 112.529 173.055 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.8 mp 97.34 105.49 0.01 OUTLIER 'General case' 0 C--N 1.348 0.521 0 C-N-CA 131.302 3.841 . . . . 0.0 110.259 -170.447 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.76 66.05 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 126.962 2.105 . . . . 0.0 114.459 176.462 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.1 m -52.49 138.19 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 O-C-N 121.568 -0.707 . . . . 0.0 110.412 168.563 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -59.35 -30.99 68.79 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.396 0.678 . . . . 0.0 112.44 -168.449 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.1 m 70.61 151.46 0.1 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 128.315 2.646 . . . . 0.0 111.633 178.524 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -87.36 1.34 53.6 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.859 1.664 . . . . 0.0 114.151 175.261 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.2 146.91 35.77 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 115.073 1.509 . . . . 0.0 115.073 -166.998 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -94.48 17.96 0.86 Allowed 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 124.029 3.153 . . . . 0.0 114.438 -178.325 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.5 t -71.19 173.15 8.04 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 124.65 2.167 . . . . 0.0 113.893 -177.871 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 97.4 t -69.26 -22.39 25.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 126.179 1.791 . . . . 0.0 111.288 -178.883 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -83.84 2.42 38.37 Favored 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 -178.888 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.4 pm0 -151.54 -148.07 0.25 Allowed 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.821 1.648 . . . . 0.0 112.923 -179.422 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 66.1 mtp180 . . . . . 0 N--CA 1.477 0.88 0 C-N-CA 131.241 3.816 . . . . 0.0 113.921 169.184 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.22 0 CA-C-O 122.192 0.996 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.458 HD22 ' H ' ' B' ' 11' ' ' LEU . 0.8 OUTLIER -60.44 -11.25 6.31 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.526 168.769 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 12' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' A' ' 19' ' ' ALA . . . -51.51 -45.88 63.03 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.009 0.924 . . . . 0.0 111.533 167.701 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -30.24 67.14 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.226 1.81 . . . . 0.0 111.934 175.442 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -81.39 -46.71 14.24 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.056 -1.027 . . . . 0.0 111.358 172.619 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.59 -32.3 68.82 Favored Glycine 0 C--O 1.219 -0.83 0 C-N-CA 124.493 1.044 . . . . 0.0 111.803 -178.165 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.6 -32.28 72.05 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.001 1.401 . . . . 0.0 111.171 173.739 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -80.63 -20.58 42.84 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 176.189 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.5 mp -101.78 -23.04 14.25 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 118.951 0.796 . . . . 0.0 112.761 175.198 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -83.64 37.76 0.6 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.372 1.469 . . . . 0.0 114.877 178.132 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.94 142.39 24.53 Favored Pre-proline 0 CA--C 1.55 0.947 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 168.181 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -59.0 -85.38 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.785 1 C-N-CA 125.793 4.329 . . . . 0.0 112.676 -167.482 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 58.9 m -49.58 -33.93 16.38 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 126.357 1.863 . . . . 0.0 112.507 170.09 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 23' ' ' ARG . . . . . 0.509 ' HG2' HD13 ' B' ' 58' ' ' LEU . 18.2 ttp180 -72.08 -38.87 69.33 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -170.824 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 37.1 t -56.93 -39.95 75.46 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.249 0.931 . . . . 0.0 110.369 168.709 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 16.1 mtt-85 -64.59 -38.92 92.65 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-O 118.485 -0.769 . . . . 0.0 113.061 175.161 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 26' ' ' ILE . . . . . 0.416 HG13 ' HA ' ' B' ' 23' ' ' ARG . 3.0 mt -52.09 -49.61 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 CA-C-N 120.069 1.304 . . . . 0.0 111.835 169.426 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 92.6 mt -65.4 -47.12 77.4 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.939 -178.242 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.24 -33.85 65.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 118.911 0.778 . . . . 0.0 112.562 178.099 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.1 -9.25 59.07 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.84 1.256 . . . . 0.0 113.419 174.265 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.557 HD21 ' CD2' ' B' ' 75' ' ' TYR . 5.6 mt -82.9 -37.96 23.52 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 117.361 -1.304 . . . . 0.0 112.353 167.079 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.2 mt -55.82 -46.22 78.14 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 125.195 1.56 . . . . 0.0 110.754 175.498 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -107.03 46.41 0.93 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 129.037 2.935 . . . . 0.0 110.453 177.762 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -150.9 -84.29 0.05 OUTLIER Glycine 0 N--CA 1.47 0.952 0 N-CA-C 116.996 1.559 . . . . 0.0 116.996 -176.261 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 34.9 m 49.57 -12.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 C-N-CA 129.175 2.99 . . . . 0.0 118.849 -168.348 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 51.9 m -37.01 -82.23 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 127.016 2.126 . . . . 0.0 116.368 -167.368 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 36' ' ' TYR . . . . . 0.459 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 7.3 m-85 -149.64 143.88 17.23 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 126.364 1.865 . . . . 0.0 109.809 -174.656 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -65.7 -7.18 15.69 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 124.07 3.18 . . . . 0.0 116.88 -168.686 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.9 -14.3 21.42 Favored Glycine 0 CA--C 1.536 1.366 0 CA-C-N 120.078 1.308 . . . . 0.0 115.161 171.053 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 39' ' ' GLN . . . . . 0.459 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 0.9 OUTLIER -69.92 -19.85 63.38 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.146 1.535 . . . . 0.0 115.146 -169.072 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 20.7 mt -44.51 -32.28 1.36 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.019 1.328 . . . . 0.0 112.333 175.928 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.16 -40.41 77.2 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -178.078 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.72 -43.38 37.68 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.141 0.496 . . . . 0.0 110.92 174.747 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -64.78 -24.09 67.45 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.79 1.236 . . . . 0.0 113.792 -177.011 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 20.4 mt -109.39 -18.12 13.63 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.224 1.809 . . . . 0.0 113.799 179.043 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.48 -9.59 54.35 Favored Glycine 0 CA--C 1.536 1.346 0 CA-C-O 118.383 -1.232 . . . . 0.0 114.487 -169.941 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.04 131.94 45.11 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.889 2.076 . . . . 0.0 111.786 177.541 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 6.1 t -59.81 140.49 56.53 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 119.985 -1.697 . . . . 0.0 109.242 168.935 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 48' ' ' ARG . . . . . 0.44 ' HD3' ' H ' ' B' ' 48' ' ' ARG . 0.0 OUTLIER -59.58 -21.0 59.7 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -174.497 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 5.7 m -64.44 -48.55 74.9 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.946 1.248 . . . . 0.0 111.272 169.488 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -70.46 -38.9 74.53 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.538 -0.726 . . . . 0.0 111.23 176.248 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -62.15 -35.87 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 O-C-N 120.877 -1.139 . . . . 0.0 111.978 172.352 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 96.2 p -67.91 -30.22 69.49 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 120.038 1.29 . . . . 0.0 114.404 175.661 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 55.5 t-20 -60.3 -59.87 4.72 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.678 0.791 . . . . 0.0 110.589 178.94 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -67.94 -19.37 64.97 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 176.511 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 40.0 mt -73.78 -29.24 62.08 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 121.377 1.899 . . . . 0.0 112.493 169.493 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 45.4 m -61.88 -29.18 70.02 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.429 0.559 . . . . 0.0 111.807 175.942 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.4 t -80.37 -50.72 9.76 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 118.881 0.764 . . . . 0.0 111.388 169.163 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.509 HD13 ' HG2' ' B' ' 23' ' ' ARG . 6.7 tp -58.12 -41.05 82.8 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.099 0.96 . . . . 0.0 113.016 -172.642 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.498 ' HG2' HG23 ' B' ' 64' ' ' VAL . 82.8 mtt180 -82.34 -6.42 59.25 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.545 1.538 . . . . 0.0 113.167 179.353 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -97.74 -43.96 2.78 Favored Glycine 0 N--CA 1.472 1.04 0 C-N-CA 124.758 1.171 . . . . 0.0 111.666 172.086 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 80.8 m -75.87 9.03 2.6 Favored 'General case' 0 CA--C 1.557 1.212 0 C-N-CA 127.463 2.305 . . . . 0.0 113.849 177.329 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.19 11.34 81.9 Favored Glycine 0 N--CA 1.471 1.022 0 C-N-CA 128.242 2.829 . . . . 0.0 117.216 167.493 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 95.5 mt -80.82 -21.88 40.47 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 118.799 1.3 . . . . 0.0 114.105 -173.846 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.498 HG23 ' HG2' ' B' ' 59' ' ' ARG . 5.2 m -137.63 149.51 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 125.303 1.441 . . . . 0.0 113.915 -174.601 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 77.3 t -145.01 147.17 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -176.996 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.72 147.98 28.96 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 127.737 2.415 . . . . 0.0 112.065 169.8 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -136.78 170.61 15.8 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.379 1.872 . . . . 0.0 107.395 175.658 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 68' ' ' TYR . . . . . 0.416 ' HA ' ' HA ' ' B' ' 73' ' ' VAL . 0.4 OUTLIER -81.41 133.0 35.35 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 162.929 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.52 -9.1 58.64 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 119.279 0.945 . . . . 0.0 112.842 167.985 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 126.29 -15.55 6.81 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 126.224 1.869 . . . . 0.0 113.754 173.452 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.48 -40.57 0.51 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.042 2.137 . . . . 0.0 110.616 -172.887 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -127.64 177.45 6.78 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 128.468 2.707 . . . . 0.0 108.063 167.738 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 73' ' ' VAL . . . . . 0.416 ' HA ' ' HA ' ' B' ' 68' ' ' TYR . 2.3 m -86.48 143.55 11.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 123.152 0.581 . . . . 0.0 109.609 165.731 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 12.3 ptt180 -106.17 -176.44 3.08 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 127.127 2.171 . . . . 0.0 108.64 172.202 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.557 ' CD2' HD21 ' B' ' 30' ' ' LEU 0.254 0.2 OUTLIER -143.76 171.54 14.07 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 124.709 1.204 . . . . 0.0 109.696 171.618 . . . . . . . . 4 4 . 1 . 030 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.513 ' HA ' HD22 ' B' ' 30' ' ' LEU . . . -174.27 159.36 3.12 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.622 1.569 . . . . 0.0 111.687 -169.38 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -60.51 142.22 55.54 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 164.864 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.43 -23.26 65.7 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -174.841 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -157.56 159.36 37.04 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 168.366 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 56.6 p -44.25 -34.93 2.06 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 113.683 -1.598 . . . . 0.0 112.002 165.295 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.93 -45.65 93.85 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.582 1.553 . . . . 0.0 111.915 -179.489 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 9.0 mt -69.06 -45.64 69.88 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.447 1.021 . . . . 0.0 109.53 174.684 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.63 -20.73 50.22 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.965 1.306 . . . . 0.0 113.797 178.008 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -75.11 -66.52 0.75 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.591 1.556 . . . . 0.0 110.404 177.518 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.33 -36.26 79.65 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.022 0.828 . . . . 0.0 113.208 178.632 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 49.8 tp -61.89 -38.07 86.97 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.724 1.21 . . . . 0.0 111.13 169.494 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -78.97 -42.69 11.98 Favored Glycine 0 C--N 1.341 0.815 0 C-N-CA 127.509 2.481 . . . . 0.0 114.968 -171.754 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.22 -12.02 60.98 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.142 1.471 . . . . 0.0 112.484 168.843 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 89' ' ' LEU . . . . . 0.416 HD23 ' H ' ' B' ' 91' ' ' GLN . 9.7 tt 72.22 142.41 0.06 Allowed 'General case' 0 C--N 1.342 0.279 0 C-N-CA 127.554 2.341 . . . . 0.0 108.849 175.539 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 33.7 m -60.4 12.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 116.819 2.155 . . . . 0.0 116.819 -173.489 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 91' ' ' GLN . . . . . 0.416 ' H ' HD23 ' B' ' 89' ' ' LEU . 26.0 mm-40 78.43 -18.79 0.48 Allowed 'General case' 0 CA--C 1.535 0.367 0 O-C-N 120.347 -1.47 . . . . 0.0 114.281 155.865 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 2.8 p -66.8 32.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 126.795 2.038 . . . . 0.0 115.132 177.517 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 61.77 10.95 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 C-N-CA 125.645 1.578 . . . . 0.0 113.509 -179.686 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 10.1 mp 86.04 115.67 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 131.35 3.86 . . . . 0.0 109.709 -168.58 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -72.05 146.18 47.77 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-O 121.475 0.655 . . . . 0.0 110.688 167.172 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 96' ' ' VAL . . . . . 0.401 ' C ' ' HB3' ' A' ' 10' ' ' ALA . 31.9 m -126.58 164.5 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 127.884 2.474 . . . . 0.0 109.138 -173.787 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -64.04 -29.4 70.55 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 122.96 0.504 . . . . 0.0 111.888 -171.084 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 86.1 153.77 0.07 Allowed 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 130.752 3.621 . . . . 0.0 112.718 169.302 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 -91.81 -12.33 34.06 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 126.051 1.741 . . . . 0.0 113.154 169.447 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 14.5 mp0 -123.52 122.37 26.61 Favored Pre-proline 0 CA--C 1.542 0.654 0 CA-C-O 117.82 -1.086 . . . . 0.0 110.149 169.561 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -80.82 151.58 18.98 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 124.272 3.315 . . . . 0.0 111.584 169.071 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 44.2 t -147.15 177.7 8.97 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 124.485 2.088 . . . . 0.0 112.168 -179.489 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 23.0 t -75.72 -20.37 15.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 C-N-CA 126.838 2.055 . . . . 0.0 110.223 175.936 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 104' ' ' ALA . . . . . 0.462 ' HB2' ' SG ' ' A' ' 57' ' ' CYS . . . -68.93 5.59 1.1 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.769 1.627 . . . . 0.0 114.207 168.189 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -165.84 -138.3 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.567 1.147 . . . . 0.0 113.472 -169.879 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 52.8 mtp180 . . . . . 0 CA--C 1.554 1.097 1 C-N-CA 133.919 4.887 . . . . 0.0 111.185 -175.302 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.44 -6.39 55.17 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -175.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.6 mmp_? -90.47 -50.57 5.87 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.704 1.202 . . . . 0.0 108.96 167.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -44.01 -71.86 0.07 Allowed 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 127.87 2.468 . . . . 0.0 109.981 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -83.09 -8.19 85.95 Favored Glycine 0 CA--C 1.526 0.744 0 C-N-CA 119.112 -1.518 . . . . 0.0 115.259 -168.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.36 -45.66 53.68 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.482 1.641 . . . . 0.0 108.245 168.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.24 -23.4 57.52 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 118.084 -0.96 . . . . 0.0 112.804 174.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 18' ' ' LEU . 4.8 tp -80.71 -34.89 34.21 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.508 1.049 . . . . 0.0 112.249 179.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -104.7 71.3 0.97 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 122.256 1.027 . . . . 0.0 110.463 169.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.488 ' CG ' ' HE ' ' A' ' 23' ' ' ARG . 4.0 t70 -132.59 143.17 47.6 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.93 1.292 . . . . 0.0 110.284 171.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -41.06 -68.21 0.1 Allowed 'Trans proline' 0 C--N 1.356 0.969 1 C-N-CA 127.012 5.141 . . . . 0.0 113.75 -173.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.23 -32.86 29.53 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 116.896 -1.525 . . . . 0.0 110.801 -175.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.488 ' HE ' ' CG ' ' A' ' 20' ' ' ASP . 16.7 mtm180 -67.72 -41.48 83.46 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 116.256 -1.831 . . . . 0.0 113.893 -177.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 38.7 t -55.52 -42.72 74.92 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 121.658 2.026 . . . . 0.0 110.545 170.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.89 -45.18 94.87 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.156 0.982 . . . . 0.0 113.184 175.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.6 mt -53.69 -56.55 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 124.395 1.078 . . . . 0.0 110.366 171.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 90.1 mt -61.66 -40.76 96.07 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.835 0.854 . . . . 0.0 111.713 -169.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.6 p -73.99 -30.3 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 175.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.21 -23.89 47.29 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.053 0.941 . . . . 0.0 113.522 174.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.438 ' O ' HG13 ' A' ' 34' ' ' VAL . 4.4 tp -63.35 -44.26 95.34 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 121.09 -1.006 . . . . 0.0 110.987 173.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -47.86 -49.06 30.64 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 128.396 2.678 . . . . 0.0 112.226 177.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -93.6 14.6 18.42 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 127.444 2.298 . . . . 0.0 112.619 -179.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -134.95 -85.82 0.22 Allowed Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.568 1.556 . . . . 0.0 114.442 -175.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.556 HG12 ' HA ' ' A' ' 76' ' ' ALA . 27.8 m 41.38 30.28 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 126.771 2.029 . . . . 0.0 115.388 -168.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 2.3 m -80.39 -86.53 0.08 Allowed 'General case' 0 C--O 1.224 -0.266 0 O-C-N 121.822 -0.549 . . . . 0.0 110.654 -178.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -135.43 161.97 60.09 Favored Pre-proline 0 CA--C 1.538 0.5 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -169.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -54.07 124.15 15.24 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.377 2.718 . . . . 0.0 110.476 174.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.37 3.3 88.58 Favored Glycine 0 CA--C 1.528 0.882 0 CA-C-O 117.25 -1.861 . . . . 0.0 114.815 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.49 -30.58 70.7 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 121.012 2.406 . . . . 0.0 111.276 169.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.5 mt -53.7 -20.13 5.02 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 124.984 1.314 . . . . 0.0 112.674 172.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.29 -34.78 75.77 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.825 0.739 . . . . 0.0 111.319 176.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.43 -45.64 53.26 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.065 0.546 . . . . 0.0 111.159 175.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -60.17 -32.41 71.04 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 177.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 35.7 mt -103.3 -20.16 14.21 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -174.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.71 7.07 68.55 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.027 0.823 . . . . 0.0 113.905 -169.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.6 mt -108.69 150.48 27.5 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.945 1.298 . . . . 0.0 110.959 -174.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.0 p -60.87 145.74 49.03 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.315 0.578 . . . . 0.0 111.667 -169.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 40.5 ptt180 -59.54 -32.88 70.73 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 -177.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.4 m -64.6 -54.82 26.01 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.553 0.741 . . . . 0.0 111.29 169.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 55.9 t-20 -55.75 -54.1 48.58 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.794 1.238 . . . . 0.0 111.177 -178.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 97.4 t -58.38 -40.11 76.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 O-C-N 121.457 -0.777 . . . . 0.0 111.8 176.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 47.2 m -71.4 -28.65 64.16 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 114.217 1.191 . . . . 0.0 114.217 -177.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -49.27 -46.91 46.93 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.004 1.322 . . . . 0.0 111.59 173.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 3.9 m80 -65.28 -27.05 68.36 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 60.3 mt -67.52 -31.03 70.86 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 118.833 0.742 . . . . 0.0 111.118 176.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 68.7 m -62.94 -8.07 6.45 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 174.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.434 ' CB ' HH11 ' A' ' 23' ' ' ARG . 43.2 t -99.16 -46.76 5.45 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 118.942 0.792 . . . . 0.0 111.514 164.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.4 tp -58.26 -36.08 72.71 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.178 2.591 . . . . 0.0 113.515 -168.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 80.2 mtm-85 -68.18 -41.71 81.04 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.626 0.771 . . . . 0.0 110.867 175.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -73.19 -36.66 55.89 Favored Glycine 0 N--CA 1.472 1.05 0 C-N-CA 124.094 0.854 . . . . 0.0 111.498 -177.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 27.4 m -67.26 -2.89 6.58 Favored 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 125.889 1.676 . . . . 0.0 113.398 168.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.22 -4.92 65.02 Favored Glycine 0 N--CA 1.47 0.929 0 C-N-CA 127.06 2.267 . . . . 0.0 114.829 174.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 73.5 mt -73.88 -20.71 60.33 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -169.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.6 m -134.21 144.99 33.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 C-N-CA 125.194 1.398 . . . . 0.0 111.941 177.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.4 t -127.23 138.43 54.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 125.161 1.384 . . . . 0.0 109.72 176.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.51 136.08 33.29 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.822 0.849 . . . . 0.0 111.003 173.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.98 179.79 5.38 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.938 2.095 . . . . 0.0 108.133 -175.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -119.26 147.83 43.82 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.945 1.698 . . . . 0.0 108.371 165.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.27 1.3 pp20? -119.66 -148.93 0.42 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.694 1.198 . . . . 0.0 111.578 176.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -70.38 -18.36 75.16 Favored Glycine 0 CA--C 1.535 1.341 0 CA-C-N 121.52 1.964 . . . . 0.0 115.251 -175.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.5 mmt180 -148.68 -17.82 0.32 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.538 1.681 . . . . 0.0 115.538 -177.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.55 -179.83 7.15 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 122.221 2.282 . . . . 0.0 112.335 -178.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 29.7 m -84.31 149.17 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.403 1.081 . . . . 0.0 111.253 172.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.1 ptt180 -126.67 170.93 11.6 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.782 1.233 . . . . 0.0 110.299 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -127.3 125.28 40.57 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.743 1.217 . . . . 0.0 109.611 169.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.556 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -128.73 153.81 46.99 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.547 1.539 . . . . 0.0 111.638 -177.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 82.8 mt -58.4 151.69 19.38 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 122.83 0.452 . . . . 0.0 109.858 170.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -49.03 -41.87 36.32 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.006 1.322 . . . . 0.0 114.031 -172.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -170.57 166.43 8.22 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 127.412 2.285 . . . . 0.0 109.135 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.1 m -36.24 -37.98 0.13 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 129.687 3.195 . . . . 0.0 112.297 165.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -44.19 -60.1 2.05 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 127.343 2.257 . . . . 0.0 113.394 171.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 13.4 mt -76.51 -34.98 58.58 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.255 0.934 . . . . 0.0 110.607 -177.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.17 -32.38 72.12 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 118.826 0.739 . . . . 0.0 112.733 176.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -77.47 -59.54 2.74 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.0 0.92 . . . . 0.0 110.941 176.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.85 -34.56 76.19 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tt -66.51 -46.44 76.23 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.238 -0.914 . . . . 0.0 108.858 168.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.02 -11.0 69.53 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 127.165 2.317 . . . . 0.0 117.078 -176.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -71.08 -40.03 71.81 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-N 121.728 2.764 . . . . 0.0 108.079 165.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 46.4 tp 90.91 112.62 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 131.628 3.971 . . . . 0.0 106.827 -167.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.5 m -39.31 -3.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 130.404 3.482 . . . . 0.0 117.925 169.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 78.57 -28.79 0.15 Allowed 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 128.696 2.798 . . . . 0.0 112.814 164.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 8.0 p -59.18 35.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 C-N-CA 129.484 3.114 . . . . 0.0 115.697 173.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.0 t 73.84 5.06 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.891 0 C-N-CA 128.436 2.694 . . . . 0.0 112.025 169.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 85.1 104.52 0.05 OUTLIER 'General case' 0 C--N 1.346 0.439 0 C-N-CA 130.578 3.551 . . . . 0.0 106.226 -169.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.99 122.37 14.14 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.644 -0.66 . . . . 0.0 110.947 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.4 t -129.86 157.5 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 126.699 2.0 . . . . 0.0 106.688 168.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -54.52 123.6 13.58 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.724 0.809 . . . . 0.0 110.455 168.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -151.11 145.26 25.34 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.601 1.56 . . . . 0.0 108.728 -169.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -85.91 67.2 9.94 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.303 1.441 . . . . 0.0 110.529 -171.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -120.8 136.69 25.67 Favored Pre-proline 0 CA--C 1.551 1.012 0 O-C-N 121.195 -0.94 . . . . 0.0 111.171 176.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -85.63 -166.59 0.34 Allowed 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 124.755 3.637 . . . . 0.0 114.877 -166.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 8.6 t . . . . . 0 CA--C 1.551 1.008 0 C-N-CA 126.32 1.848 . . . . 0.0 112.307 173.3 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.0 tt . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.14 1.5 18.06 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.219 1.562 . . . . 0.0 115.219 -177.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -107.08 -54.02 2.53 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.795 2.038 . . . . 0.0 110.138 168.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -43.3 -56.67 3.39 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 127.513 2.325 . . . . 0.0 110.41 174.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.66 -35.08 62.58 Favored Glycine 0 C--N 1.339 0.706 0 C-N-CA 120.357 -0.925 . . . . 0.0 113.64 -172.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.31 -38.01 71.75 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.363 1.082 . . . . 0.0 109.912 -179.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.51 -32.53 58.35 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 117.192 -1.385 . . . . 0.0 113.221 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.8 mp -81.14 -37.07 29.43 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 120.886 1.676 . . . . 0.0 112.435 178.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -90.95 70.55 6.42 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.532 1.06 . . . . 0.0 111.858 173.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -146.06 141.29 16.41 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 125.702 1.601 . . . . 0.0 110.49 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -45.43 -62.56 0.43 Allowed 'Trans proline' 0 C--N 1.357 0.979 1 C-N-CA 126.574 4.849 . . . . 0.0 113.053 -173.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 1.2 p -84.01 -38.83 20.41 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-O 116.813 -1.565 . . . . 0.0 110.714 -175.06 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 25.1 mtm180 -67.51 -36.35 80.87 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 121.195 1.816 . . . . 0.0 114.02 -175.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 43.5 t -56.34 -47.44 78.81 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 121.073 1.761 . . . . 0.0 109.784 169.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.1 -36.31 81.34 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.054 1.341 . . . . 0.0 113.249 177.264 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 3.2 mt -60.41 -61.93 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.109 0.964 . . . . 0.0 109.565 171.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 90.8 mt -56.95 -43.58 81.69 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 124.318 1.012 . . . . 0.0 111.168 -169.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 6.3 p -69.51 -31.52 49.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.34 -16.65 48.49 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.163 0.892 . . . . 0.0 113.27 175.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 3.5 tp -71.8 -37.72 70.35 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.223 -0.923 . . . . 0.0 112.288 172.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -45.8 -47.97 15.65 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.254 2.222 . . . . 0.0 111.65 170.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -100.17 22.39 11.49 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 127.23 2.212 . . . . 0.0 112.704 176.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -128.81 -95.1 0.8 Allowed Glycine 0 N--CA 1.476 1.305 0 C-N-CA 126.0 1.762 . . . . 0.0 114.67 -173.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . 0.612 HG12 ' HA ' ' B' ' 76' ' ' ALA . 32.9 m 39.16 35.39 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 128.095 2.558 . . . . 0.0 116.64 -169.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 88.9 m -82.18 -106.8 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 122.91 0.484 . . . . 0.0 111.07 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -125.54 165.57 25.88 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 -169.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -55.47 124.25 15.82 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 122.557 2.171 . . . . 0.0 110.684 177.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.15 -1.34 88.85 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 117.82 -1.545 . . . . 0.0 115.267 -175.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -26.09 64.55 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 121.054 2.427 . . . . 0.0 113.663 177.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 10.3 mt -64.94 -18.61 65.39 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 123.752 0.821 . . . . 0.0 111.735 177.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.7 -36.98 72.7 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.86 0.754 . . . . 0.0 112.188 174.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.82 -41.43 68.21 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.838 0.745 . . . . 0.0 111.234 174.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -64.26 -33.21 75.3 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 177.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 38.5 mt -104.7 -21.15 13.43 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -172.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.29 -1.48 42.16 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 124.959 1.266 . . . . 0.0 113.944 -169.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 86.8 mt -93.73 153.25 18.43 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.28 1.432 . . . . 0.0 110.552 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 29.9 p -63.75 150.65 44.07 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 121.214 -0.929 . . . . 0.0 111.924 -169.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 40.9 ptt180 -59.43 -24.77 63.78 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 175.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 4.4 m -68.51 -59.8 2.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.52 1.528 . . . . 0.0 110.463 168.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -48.51 -56.76 7.44 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.359 1.864 . . . . 0.0 111.363 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 24.5 t -67.07 -35.31 74.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 O-C-N 121.085 -1.009 . . . . 0.0 112.732 -174.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 52.8 m -68.74 -28.83 67.17 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 34.5 t-20 -51.14 -51.41 53.85 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.855 1.262 . . . . 0.0 111.222 172.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -68.07 -28.43 67.35 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.963 -1.086 . . . . 0.0 113.086 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 92.9 mt -65.04 -30.21 71.17 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.646 -0.659 . . . . 0.0 111.236 173.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 66.3 m -67.63 -7.13 24.04 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 53.3 t -95.71 -44.18 7.56 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.672 0.789 . . . . 0.0 110.544 164.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 7.7 tp -64.14 -37.83 88.85 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 127.621 2.368 . . . . 0.0 113.179 -168.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 75.9 mtm-85 -70.93 -22.43 62.24 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.13 0.572 . . . . 0.0 112.001 174.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -86.55 -37.95 8.5 Favored Glycine 0 N--CA 1.473 1.164 0 C-N-CA 124.86 1.219 . . . . 0.0 111.423 178.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 48.2 m -68.26 -4.21 13.44 Favored 'General case' 0 CA--C 1.56 1.348 0 C-N-CA 125.906 1.683 . . . . 0.0 112.032 168.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.23 -22.75 6.77 Favored Glycine 0 N--CA 1.47 0.955 0 C-N-CA 128.479 2.942 . . . . 0.0 114.868 177.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 89.8 mt -52.59 -22.16 4.68 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 129.285 3.034 . . . . 0.0 116.235 -168.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.95 138.42 54.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 125.02 1.328 . . . . 0.0 109.648 172.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 41.4 t -114.27 122.56 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 125.073 1.349 . . . . 0.0 108.812 178.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -88.41 119.29 28.71 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.609 1.164 . . . . 0.0 109.7 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.446 ' HB ' ' HG2' ' B' ' 74' ' ' ARG . 0.2 OUTLIER -123.7 -177.17 3.66 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 127.059 2.144 . . . . 0.0 109.711 -167.686 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -123.08 142.59 50.71 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.699 2.0 . . . . 0.0 108.784 166.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -113.25 -149.37 0.45 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.442 1.497 . . . . 0.0 111.813 176.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -71.21 -19.92 77.71 Favored Glycine 0 CA--C 1.535 1.342 0 O-C-N 119.801 -1.812 . . . . 0.0 114.81 -173.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 36.8 mmt180 -144.81 -18.6 0.52 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.547 1.539 . . . . 0.0 115.087 -177.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.47 -179.17 7.0 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 121.704 2.047 . . . . 0.0 113.174 -175.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 18.6 m -87.25 150.94 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 124.553 1.141 . . . . 0.0 111.345 177.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . 0.446 ' HG2' ' HB ' ' B' ' 67' ' ' THR . 15.1 ptt180 -135.85 169.75 17.08 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.995 0.918 . . . . 0.0 110.761 -174.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 40.0 m-85 -123.64 113.89 19.27 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 168.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . 0.612 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -109.29 156.06 20.41 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.727 1.211 . . . . 0.0 111.161 177.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 82.8 mt -59.17 150.02 26.56 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.754 0.707 . . . . 0.0 109.499 169.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -51.57 -35.55 41.64 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.393 1.077 . . . . 0.0 113.818 -171.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -173.31 168.69 4.61 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.882 2.473 . . . . 0.0 109.176 175.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -34.07 -35.6 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 129.655 3.182 . . . . 0.0 112.307 164.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -37.64 -67.41 0.19 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 127.703 2.401 . . . . 0.0 113.518 169.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 16.6 mt -77.24 -35.61 55.26 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 118.975 -0.536 . . . . 0.0 109.766 -174.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.92 -30.79 66.2 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.8 -60.05 2.3 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.362 -0.836 . . . . 0.0 111.112 175.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.91 -29.17 70.03 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -176.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.63 -32.21 47.3 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 120.78 -1.2 . . . . 0.0 111.433 169.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.27 -18.76 79.86 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 126.525 2.012 . . . . 0.0 115.367 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.58 -32.73 64.28 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 120.688 2.244 . . . . 0.0 108.99 165.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 39.7 tp 77.28 127.09 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 130.652 3.581 . . . . 0.0 108.388 -169.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . 0.424 HG23 HG12 ' B' ' 92' ' ' VAL . 12.8 m -44.03 -7.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 127.993 2.517 . . . . 0.0 116.734 169.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 73.63 -21.1 0.27 Allowed 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 127.215 2.206 . . . . 0.0 114.054 165.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.424 HG12 HG23 ' B' ' 90' ' ' VAL . 5.9 p -60.48 41.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 129.881 3.272 . . . . 0.0 114.792 171.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER 67.64 -0.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 C-N-CA 128.708 2.803 . . . . 0.0 113.633 177.461 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.0 tt 89.49 105.7 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 130.394 3.478 . . . . 0.0 105.431 -168.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.688 0 C-N-CA 122.794 0.438 . . . . 0.0 111.063 -178.911 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? . . . . . 0 CA--C 1.537 0.468 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.47 -39.76 80.82 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 118.818 0.735 . . . . 0.0 111.734 167.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.2 mtp180 -60.02 -32.13 70.6 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 121.029 -1.044 . . . . 0.0 112.317 174.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.39 -43.6 98.43 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.281 1.032 . . . . 0.0 111.578 177.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -74.53 -33.98 54.98 Favored Glycine 0 N--CA 1.474 1.179 0 CA-C-N 118.59 0.632 . . . . 0.0 112.695 176.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 16.3 mtp180 -55.24 -49.66 71.44 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.304 1.042 . . . . 0.0 109.721 170.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.76 -28.39 63.61 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 mp -85.92 -20.28 29.24 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.252 0.933 . . . . 0.0 113.325 -177.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -96.88 16.92 17.97 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.28 165.17 9.27 Favored Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 125.931 1.692 . . . . 0.0 112.05 168.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -69.34 -115.57 0.0 OUTLIER 'Trans proline' 0 CA--C 1.554 1.502 1 C-N-CA 126.314 4.676 . . . . 0.0 111.519 172.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -37.5 -35.7 0.14 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 128.626 2.771 . . . . 0.0 115.245 169.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.536 HH12 ' CB ' ' A' ' 57' ' ' CYS . 6.4 ttm-85 -64.12 -38.45 91.12 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 120.008 1.277 . . . . 0.0 112.974 178.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.9 t -58.35 -43.61 88.43 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.501 1.046 . . . . 0.0 109.855 174.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -38.05 89.69 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 173.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 6.2 mm -57.95 -47.83 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 125.433 1.493 . . . . 0.0 111.337 171.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.3 mt -65.49 -43.61 89.63 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.52 -0.738 . . . . 0.0 112.075 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.4 p -71.81 -24.17 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 CA-C-N 119.076 0.853 . . . . 0.0 112.243 175.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.0 -38.03 79.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.439 0.696 . . . . 0.0 111.214 171.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.492 HD23 ' HA ' ' A' ' 30' ' ' LEU . 25.4 mt -71.99 -33.5 68.16 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -178.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -39.55 -50.96 2.23 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.322 2.249 . . . . 0.0 112.94 170.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -97.7 -20.36 17.65 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.575 1.15 . . . . 0.0 113.107 173.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.95 15.93 54.84 Favored Glycine 0 N--CA 1.469 0.897 0 C-N-CA 126.661 2.077 . . . . 0.0 116.552 -165.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 1.8 m -50.47 74.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 127.251 2.22 . . . . 0.0 115.575 171.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 9.0 t -144.44 -54.22 0.33 Allowed 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.474 1.657 . . . . 0.0 115.474 -174.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 12.3 p90 -158.24 157.08 28.83 Favored Pre-proline 0 N--CA 1.481 1.1 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 177.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -53.94 127.89 27.46 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.943 2.429 . . . . 0.0 108.737 168.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.93 -3.08 62.26 Favored Glycine 0 CA--C 1.53 1.021 0 CA-C-O 117.484 -1.731 . . . . 0.0 115.006 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.87 -34.38 62.92 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 120.595 2.198 . . . . 0.0 110.902 169.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.695 HD12 ' H ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -62.16 -17.79 59.0 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 127.147 2.179 . . . . 0.0 112.204 -178.441 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.07 -43.99 97.06 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.028 0.531 . . . . 0.0 111.002 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.05 -38.69 75.88 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.806 -0.559 . . . . 0.0 111.957 173.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -73.49 -15.6 61.31 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 -177.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 30.0 mt -110.53 -24.84 10.33 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.435 1.494 . . . . 0.0 113.842 174.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.56 6.89 88.85 Favored Glycine 0 CA--C 1.533 1.197 0 CA-C-N 119.554 1.07 . . . . 0.0 112.514 -168.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.8 mt -110.93 148.94 31.4 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.355 1.062 . . . . 0.0 111.693 -170.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.48 HG23 ' H ' ' A' ' 50' ' ' ASN . 3.4 t -58.31 149.71 23.8 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.795 0.838 . . . . 0.0 112.839 -172.057 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.7 mtm-85 -48.43 -37.14 16.37 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.977 1.711 . . . . 0.0 111.632 172.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.6 m -60.79 -60.01 4.48 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.281 1.032 . . . . 0.0 111.376 175.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.48 ' H ' HG23 ' A' ' 47' ' ' THR . 7.9 m-20 -67.97 -34.37 76.43 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.603 -0.685 . . . . 0.0 111.011 -175.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.9 t -57.21 -52.78 52.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 123.448 0.699 . . . . 0.0 111.191 169.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 13.1 p -72.67 -26.79 61.76 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -177.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -49.63 -48.38 49.2 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.355 1.074 . . . . 0.0 111.438 174.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -78.8 -18.21 54.46 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 177.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 56.9 mt -70.72 -21.46 62.54 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 120.995 1.725 . . . . 0.0 112.042 172.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.0 t -63.21 -53.29 55.43 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.534 1.061 . . . . 0.0 110.908 176.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.536 ' CB ' HH12 ' A' ' 23' ' ' ARG . 48.9 t -78.94 12.81 1.99 Allowed 'General case' 0 CA--C 1.561 1.367 0 C-N-CA 125.557 1.543 . . . . 0.0 112.611 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -106.96 -52.22 2.8 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 126.821 2.048 . . . . 0.0 111.216 175.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 44.7 mtm105 -81.78 -25.76 34.99 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.692 0.797 . . . . 0.0 112.422 -170.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.64 -31.11 9.01 Favored Glycine 0 N--CA 1.474 1.233 0 C-N-CA 124.034 0.826 . . . . 0.0 113.715 178.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 41.5 m -82.39 -5.92 58.94 Favored 'General case' 0 CA--C 1.567 1.618 0 C-N-CA 126.065 1.746 . . . . 0.0 113.596 173.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.75 -3.68 83.25 Favored Glycine 0 N--CA 1.478 1.456 0 C-N-CA 126.831 2.158 . . . . 0.0 116.891 170.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.7 mt -56.62 -22.31 33.19 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.997 1.719 . . . . 0.0 114.195 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.9 m -143.97 149.68 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 C-N-CA 126.689 1.996 . . . . 0.0 111.842 177.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 97.7 t -115.61 143.13 26.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 126.464 1.905 . . . . 0.0 109.276 176.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -99.2 123.25 43.34 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.975 0.91 . . . . 0.0 111.953 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -124.36 162.54 23.62 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.645 1.178 . . . . 0.0 109.348 -178.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -91.86 126.55 36.99 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 164.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.258 0.0 OUTLIER -90.85 4.03 52.87 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -179.544 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 109.25 -15.79 32.77 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 125.124 1.345 . . . . 0.0 113.32 175.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.58 -45.08 2.2 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 128.197 2.599 . . . . 0.0 111.602 172.162 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -139.69 169.11 18.33 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.312 2.245 . . . . 0.0 110.917 -168.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 7.1 p -83.24 145.16 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 O-C-N 121.328 -0.857 . . . . 0.0 109.877 167.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.1 ptt180 -134.54 172.91 12.26 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.457 1.103 . . . . 0.0 111.829 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -122.77 124.62 43.75 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.483 1.113 . . . . 0.0 110.651 173.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -123.63 143.18 50.39 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.122 1.369 . . . . 0.0 110.768 -177.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.2 tp -52.14 143.73 13.71 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.589 1.156 . . . . 0.0 111.492 177.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -45.79 -38.87 7.62 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 115.907 1.817 . . . . 0.0 115.907 -173.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -176.41 168.32 2.75 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.515 1.926 . . . . 0.0 109.803 -175.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.3 p -41.94 -31.54 0.35 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.852 2.061 . . . . 0.0 112.174 164.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -46.81 -67.04 0.32 Allowed 'General case' 0 C--N 1.345 0.37 0 C-N-CA 127.249 2.22 . . . . 0.0 113.566 169.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 13.8 mt -68.09 -34.71 76.91 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 119.527 1.058 . . . . 0.0 109.813 178.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.29 -32.29 73.87 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.819 0.736 . . . . 0.0 112.357 -172.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.2 -58.84 3.03 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.911 0.884 . . . . 0.0 112.31 170.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.75 -28.41 69.86 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.958 1.254 . . . . 0.0 113.59 -174.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.99 -33.13 21.17 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.906 0.882 . . . . 0.0 112.611 172.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.05 -31.86 75.83 Favored Glycine 0 CA--C 1.539 1.583 0 C-N-CA 125.064 1.316 . . . . 0.0 113.155 175.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -62.67 -23.36 67.07 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.467 1.907 . . . . 0.0 111.299 166.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 46.2 tp 81.67 128.26 0.05 OUTLIER 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 130.305 3.442 . . . . 0.0 107.047 -174.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 76.3 t -65.06 5.81 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 125.433 1.493 . . . . 0.0 114.544 -169.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.42 ' C ' ' H ' ' A' ' 93' ' ' VAL . 2.5 tp-100 88.07 -26.86 0.07 Allowed 'General case' 0 C--O 1.217 -0.619 0 O-C-N 120.12 -1.612 . . . . 0.0 111.191 132.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.3 p -63.97 35.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 130.327 3.451 . . . . 0.0 112.666 167.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.42 ' H ' ' C ' ' A' ' 91' ' ' GLN . 0.2 OUTLIER 59.18 8.36 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 C-N-CA 128.007 2.523 . . . . 0.0 114.047 176.653 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 96.63 111.24 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 131.141 3.776 . . . . 0.0 106.791 -166.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.51 96.57 0.17 Allowed 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.925 -0.485 . . . . 0.0 110.895 175.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.0 t -52.98 147.44 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 167.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.17 34.58 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 129.526 3.13 . . . . 0.0 113.665 -175.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.2 p -100.34 129.03 46.28 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 126.153 1.781 . . . . 0.0 111.421 -176.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -127.35 153.83 45.72 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.379 166.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -170.63 163.03 5.84 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 126.569 1.948 . . . . 0.0 108.904 -167.032 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -64.76 155.11 69.17 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.187 1.925 . . . . 0.0 110.15 169.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.542 0.644 0 CA-C-O 122.179 0.99 . . . . 0.0 113.43 -172.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mm? . . . . . 0 CA--C 1.534 0.36 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.24 -31.74 72.34 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 120.27 1.396 . . . . 0.0 112.511 168.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -61.43 -32.75 72.73 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.374 -0.829 . . . . 0.0 111.835 173.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -50.78 -57.84 7.4 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.85 1.26 . . . . 0.0 109.498 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.3 -34.03 88.84 Favored Glycine 0 CA--C 1.53 1.03 0 O-C-N 121.803 -0.561 . . . . 0.0 112.827 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 17.5 mtp180 -69.6 -11.52 60.9 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.035 1.334 . . . . 0.0 114.16 173.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.53 -8.11 14.67 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.756 1.622 . . . . 0.0 113.763 170.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -96.79 -29.98 13.44 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 119.909 1.231 . . . . 0.0 113.197 175.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -88.53 36.42 0.79 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.47 1.108 . . . . 0.0 112.604 173.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . 0.554 ' CG ' ' HE ' ' B' ' 23' ' ' ARG . 0.1 OUTLIER -78.6 167.04 38.44 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 128.217 2.607 . . . . 0.0 112.46 172.882 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -69.12 -115.63 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.358 1 C-N-CA 126.686 4.924 . . . . 0.0 111.767 169.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -42.17 -33.67 0.64 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 128.314 2.645 . . . . 0.0 114.412 176.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.581 HH12 ' CB ' ' B' ' 57' ' ' CYS . 6.9 ttm-85 -59.92 -32.14 70.49 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 117.957 -1.021 . . . . 0.0 112.91 178.237 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 1.6 m -53.37 -56.64 15.08 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.403 1.002 . . . . 0.0 109.716 169.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -35.57 80.78 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 117.799 -1.096 . . . . 0.0 112.189 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 5.2 mm -53.74 -50.96 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 CA-C-N 120.778 1.626 . . . . 0.0 112.279 170.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 42.6 mt -69.21 -40.84 77.74 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.555 -0.736 . . . . 0.0 112.062 -174.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 12.5 p -74.38 -25.25 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-N 118.995 0.816 . . . . 0.0 112.276 175.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.3 -27.92 68.95 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.1 -1.0 . . . . 0.0 111.996 170.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.506 ' O ' HG13 ' B' ' 34' ' ' VAL . 4.9 mp -67.82 -51.08 52.75 Favored 'General case' 0 C--O 1.226 -0.16 0 CA-C-O 117.176 -1.392 . . . . 0.0 111.598 168.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 4.7 mt -44.48 -46.03 9.5 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.767 1.227 . . . . 0.0 112.022 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -81.07 3.52 23.0 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 126.932 2.093 . . . . 0.0 113.998 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -153.12 -63.31 0.01 OUTLIER Glycine 0 N--CA 1.478 1.452 0 N-CA-C 118.049 1.98 . . . . 0.0 118.049 -167.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . 0.506 HG13 ' O ' ' B' ' 30' ' ' LEU . 16.0 m 33.42 40.37 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 127.854 2.462 . . . . 0.0 115.915 -169.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 3.6 t -96.74 -60.84 1.51 Allowed 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 -169.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -158.97 159.22 29.43 Favored Pre-proline 0 N--CA 1.479 1.008 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 -174.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -60.09 124.54 15.46 Favored 'Trans proline' 0 C--N 1.356 0.93 0 C-N-CA 123.112 2.542 . . . . 0.0 110.368 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.28 -4.62 85.3 Favored Glycine 0 CA--C 1.527 0.832 0 CA-C-O 117.423 -1.765 . . . . 0.0 114.331 -175.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . 0.551 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -55.94 -36.05 67.33 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 120.002 1.901 . . . . 0.0 109.776 169.322 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.668 ' H ' HD12 ' B' ' 40' ' ' LEU . 0.3 OUTLIER -60.94 -18.92 59.7 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 125.916 1.686 . . . . 0.0 112.574 179.799 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.99 -58.29 5.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 118.397 0.544 . . . . 0.0 110.222 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.34 -33.08 74.74 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 122.669 0.387 . . . . 0.0 111.286 176.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . 0.551 ' CD2' HE22 ' B' ' 39' ' ' GLN . 0.6 OUTLIER -71.94 -13.28 61.59 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 179.77 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 33.5 mt -117.85 -23.66 7.44 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.969 1.707 . . . . 0.0 113.721 177.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.7 12.04 84.03 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 124.633 1.111 . . . . 0.0 111.808 -167.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 94.8 mt -124.82 132.48 53.33 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 118.599 1.199 . . . . 0.0 112.209 -169.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 8.7 t -48.87 145.96 3.55 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.134 1.774 . . . . 0.0 115.448 -169.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 38.8 mtm-85 -49.68 -34.96 20.01 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.726 2.01 . . . . 0.0 112.508 177.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 5.9 m -61.72 -59.33 5.33 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.588 0.755 . . . . 0.0 110.989 174.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -64.59 -37.24 86.87 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.029 0.932 . . . . 0.0 111.534 -178.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.1 t -55.76 -49.93 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 C-N-CA 123.611 0.764 . . . . 0.0 111.177 169.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 15.4 p -76.38 -25.42 54.56 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 -176.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -51.3 -49.14 61.86 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.461 1.104 . . . . 0.0 110.969 170.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 60.3 m-70 -75.79 -22.4 56.42 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 173.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 91.6 mt -67.71 -23.07 65.24 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 121.008 1.731 . . . . 0.0 112.221 171.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.8 t -62.41 -53.55 53.2 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.718 1.144 . . . . 0.0 111.336 178.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . 0.581 ' CB ' HH12 ' B' ' 23' ' ' ARG 0.265 42.2 t -82.79 15.47 2.65 Favored 'General case' 0 CA--C 1.559 1.32 0 CA-C-O 122.417 1.104 . . . . 0.0 111.705 -178.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . 0.486 ' CD1' ' HD3' ' B' ' 23' ' ' ARG . 1.3 tp -105.28 -51.18 3.07 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 127.638 2.375 . . . . 0.0 111.708 173.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 29.9 mtm105 -89.63 -8.33 52.76 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.597 1.159 . . . . 0.0 112.656 -170.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -106.35 -29.84 4.64 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.356 1.455 . . . . 0.0 113.291 172.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 97.8 m -87.11 8.99 21.31 Favored 'General case' 0 CA--C 1.563 1.475 0 C-N-CA 126.067 1.747 . . . . 0.0 113.293 171.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.37 -13.84 14.45 Favored Glycine 0 N--CA 1.476 1.334 0 C-N-CA 126.825 2.155 . . . . 0.0 117.017 170.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 91.5 mt -48.79 -26.14 2.22 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.479 1.912 . . . . 0.0 114.88 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 4.0 m -136.99 150.64 26.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 126.186 1.794 . . . . 0.0 111.688 173.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 90.2 t -118.76 148.59 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 126.659 1.984 . . . . 0.0 108.661 170.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.92 135.12 51.92 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.784 1.234 . . . . 0.0 112.406 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.4 p -120.35 -178.49 3.7 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.811 1.244 . . . . 0.0 110.836 176.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -97.63 135.01 40.05 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 104.866 -2.272 . . . . 0.0 104.866 160.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.57 -11.94 23.11 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 115.146 1.535 . . . . 0.0 115.146 177.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 117.55 -34.15 4.65 Favored Glycine 0 N--CA 1.474 1.176 0 C-N-CA 124.85 1.214 . . . . 0.0 112.874 176.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -96.75 -35.39 11.0 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 125.85 1.66 . . . . 0.0 111.454 169.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -155.05 -141.74 0.1 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 128.046 2.538 . . . . 0.0 110.382 -177.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 15.2 m -133.65 152.9 35.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 127.152 2.181 . . . . 0.0 108.583 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 7.2 ptt85 -135.04 173.83 11.28 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.077 0.853 . . . . 0.0 111.751 -173.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -121.71 141.96 50.64 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.531 1.132 . . . . 0.0 109.063 168.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . 0.502 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -142.42 145.06 33.4 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.851 1.261 . . . . 0.0 109.003 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 tp -51.91 147.26 7.24 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.41 1.084 . . . . 0.0 111.05 175.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -49.57 -43.01 45.86 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 115.0 1.481 . . . . 0.0 115.0 -175.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -168.36 163.44 12.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.934 1.694 . . . . 0.0 110.61 -174.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 97.3 p -40.81 -33.92 0.34 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.624 2.37 . . . . 0.0 113.468 167.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -58.98 -54.95 41.38 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.344 1.058 . . . . 0.0 113.817 175.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 20.2 mt -66.37 -31.35 72.07 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.465 1.029 . . . . 0.0 109.746 177.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.22 -32.22 73.72 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 118.512 0.596 . . . . 0.0 109.512 178.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 2.8 mmt85 -71.57 -57.09 4.71 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.709 1.204 . . . . 0.0 111.123 168.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.45 -32.56 62.87 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.942 1.246 . . . . 0.0 114.036 -177.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -87.97 -37.47 16.36 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 172.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -81.42 -42.93 8.87 Favored Glycine 0 CA--C 1.539 1.533 0 C-N-CA 124.767 1.175 . . . . 0.0 113.984 -171.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -71.06 -35.88 72.09 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.8 1.24 . . . . 0.0 108.29 166.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 21.6 tp 93.76 144.34 0.02 OUTLIER 'General case' 0 C--N 1.342 0.268 0 C-N-CA 130.736 3.614 . . . . 0.0 111.434 168.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 1.5 m -53.2 -14.91 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 126.162 1.785 . . . . 0.0 113.897 171.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 65.42 -13.18 0.13 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 127.026 2.131 . . . . 0.0 114.011 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 1.3 p -58.02 24.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 130.635 3.574 . . . . 0.0 117.423 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.3 t 65.63 13.96 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 126.949 2.1 . . . . 0.0 111.358 171.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 78.75 116.15 0.06 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.604 2.362 . . . . 0.0 108.123 -167.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.552 1.051 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 169.737 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 mm? . . . . . 0 CA--C 1.539 0.552 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.46 -36.78 52.55 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.799 1.181 . . . . 0.0 111.722 174.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -62.89 -28.19 69.88 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.136 1.374 . . . . 0.0 112.562 177.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -47.85 -57.54 5.52 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.877 1.671 . . . . 0.0 109.337 168.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -76.85 -14.72 82.29 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-O 119.065 -0.853 . . . . 0.0 113.722 -178.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 76.6 mmt-85 -66.97 -62.59 1.36 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 166.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.13 -38.2 85.55 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.603 1.961 . . . . 0.0 114.905 -173.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.2 mp -79.66 -14.16 58.98 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 119.571 1.078 . . . . 0.0 112.538 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -118.88 24.26 10.95 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.452 1.101 . . . . 0.0 112.064 170.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -90.17 148.66 39.81 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 104.91 -2.255 . . . . 0.0 104.91 165.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -54.56 -99.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 0.979 1 C-N-CA 126.788 4.992 . . . . 0.0 113.777 -166.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.4 p -46.76 -36.88 7.74 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 126.155 1.782 . . . . 0.0 112.157 169.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -65.45 -36.87 85.21 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.179 0.899 . . . . 0.0 111.466 -174.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 52.4 t -67.38 -45.14 77.13 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.157 -0.964 . . . . 0.0 110.65 166.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.91 -43.08 69.41 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 121.743 -0.598 . . . . 0.0 112.535 178.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.6 mm -55.58 -50.42 66.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.617 1.567 . . . . 0.0 111.59 171.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 85.4 mt -61.47 -40.71 95.52 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.157 0.889 . . . . 0.0 112.015 -177.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 7.3 p -80.72 -32.6 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.1 -28.19 61.24 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.743 0.817 . . . . 0.0 112.522 173.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.44 ' O ' HG13 ' A' ' 34' ' ' VAL . 17.7 tp -66.33 -39.49 89.27 Favored 'General case' 0 N--CA 1.437 -1.088 0 CA-C-O 116.644 -1.646 . . . . 0.0 111.601 169.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -47.33 -62.43 1.43 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.703 2.001 . . . . 0.0 110.1 175.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -83.3 26.24 0.66 Allowed 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.595 1.958 . . . . 0.0 113.04 174.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.25 -87.25 0.31 Allowed Glycine 0 C--N 1.337 0.63 0 C-N-CA 125.783 1.659 . . . . 0.0 112.738 -177.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.521 HG12 ' HA ' ' A' ' 76' ' ' ALA . 30.7 m 39.66 41.3 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 127.455 2.302 . . . . 0.0 114.575 -170.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -90.68 -68.16 0.8 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -177.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 24.1 p90 -159.25 157.76 27.74 Favored Pre-proline 0 N--CA 1.475 0.781 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -170.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -56.74 128.85 31.65 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.451 2.1 . . . . 0.0 109.276 171.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.74 -0.61 81.47 Favored Glycine 0 CA--C 1.534 1.226 0 CA-C-O 117.738 -1.59 . . . . 0.0 114.818 -175.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.514 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -59.1 -37.89 78.23 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 120.631 2.215 . . . . 0.0 110.898 170.865 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.5 mt -60.84 -17.8 52.0 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.564 1.145 . . . . 0.0 112.126 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.33 -31.84 73.1 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 118.698 0.681 . . . . 0.0 111.316 174.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.14 -50.43 19.45 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.429 0.692 . . . . 0.0 111.042 173.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.514 ' CD2' HE22 ' A' ' 39' ' ' GLN . 12.1 m-70 -57.78 -37.39 73.61 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 178.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.7 mt -98.29 -23.22 15.74 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.772 0.829 . . . . 0.0 113.196 -174.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.14 6.49 74.46 Favored Glycine 0 CA--C 1.534 1.273 0 CA-C-N 119.568 1.077 . . . . 0.0 113.919 -170.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.9 mp -96.93 155.44 16.78 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 118.143 0.971 . . . . 0.0 111.442 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.601 HG23 ' H ' ' A' ' 50' ' ' ASN . 1.4 t -58.21 144.7 39.86 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.971 0.508 . . . . 0.0 111.698 -179.287 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 29.9 mtt85 -55.24 -24.24 26.76 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.084 1.354 . . . . 0.0 111.947 171.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.9 m -65.33 -62.92 1.25 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.096 1.358 . . . . 0.0 111.275 170.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.601 ' H ' HG23 ' A' ' 47' ' ' THR . 3.7 m120 -66.12 -36.9 84.36 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.386 -0.821 . . . . 0.0 111.234 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.41 -31.8 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 O-C-N 120.327 -1.483 . . . . 0.0 113.045 169.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.3 m -75.47 -37.33 60.34 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.327 1.421 . . . . 0.0 113.209 171.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -54.58 -49.22 70.91 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.521 0.728 . . . . 0.0 110.154 172.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 16.7 m80 -64.27 -20.91 66.38 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 65.2 mt -88.98 -18.83 26.61 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 117.033 -1.461 . . . . 0.0 114.443 174.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 55.3 m -53.47 -58.0 8.68 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 121.988 2.176 . . . . 0.0 112.114 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 40.5 t -66.01 -45.13 82.64 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 122.853 1.311 . . . . 0.0 110.344 -176.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.84 -41.33 57.69 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 127.916 2.487 . . . . 0.0 113.356 -178.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.7 mtm180 -84.33 -21.04 31.11 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -177.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -95.7 -45.08 3.0 Favored Glycine 0 N--CA 1.473 1.145 0 CA-C-N 119.275 0.943 . . . . 0.0 113.879 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 51.7 m -66.04 -13.91 60.77 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 124.987 1.315 . . . . 0.0 111.831 174.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 97.45 14.36 41.53 Favored Glycine 0 C--N 1.346 1.1 0 C-N-CA 127.427 2.442 . . . . 0.0 115.848 167.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.9 mt -71.11 -28.62 64.44 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.772 1.286 . . . . 0.0 113.562 179.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 3.5 m -140.81 159.11 23.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 126.007 1.723 . . . . 0.0 111.901 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 2.9 t -140.85 160.59 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 125.487 1.515 . . . . 0.0 110.137 -172.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -86.08 146.45 26.61 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.842 1.257 . . . . 0.0 112.344 169.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -140.73 174.63 10.33 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.715 1.606 . . . . 0.0 107.396 169.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -111.32 127.47 55.65 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.153 0.981 . . . . 0.0 111.948 169.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -80.66 14.75 1.97 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.858 0.863 . . . . 0.0 110.984 165.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 80.52 -56.34 4.7 Favored Glycine 0 C--N 1.343 0.937 0 C-N-CA 126.415 1.959 . . . . 0.0 112.067 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -76.05 -18.73 59.1 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.173 1.789 . . . . 0.0 112.568 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -164.08 167.3 20.45 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.8 2.04 . . . . 0.0 109.763 -173.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 34.3 m -87.04 154.98 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 O-C-N 121.725 -0.609 . . . . 0.0 110.078 167.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.4 ' HD2' ' HB ' ' A' ' 34' ' ' VAL . 20.4 ptt180 -132.67 169.43 16.67 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 125.321 1.448 . . . . 0.0 109.169 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -108.15 162.03 14.44 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 164.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.521 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -152.47 151.14 30.4 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.81 1.644 . . . . 0.0 110.214 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.2 tp -64.03 148.08 50.6 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.059 0.944 . . . . 0.0 109.249 169.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -76.75 -8.0 56.45 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 117.641 2.46 . . . . 0.0 117.641 -169.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -179.54 164.38 1.28 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 127.644 2.377 . . . . 0.0 111.883 172.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 26.4 t -47.65 -28.87 2.59 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.235 2.214 . . . . 0.0 112.448 166.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -49.14 -65.07 0.63 Allowed 'General case' 0 C--N 1.341 0.223 0 C-N-CA 125.51 1.524 . . . . 0.0 112.082 169.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.9 mt -68.29 -34.22 75.76 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 118.976 0.807 . . . . 0.0 110.138 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.98 -43.81 91.38 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 119.21 0.914 . . . . 0.0 111.207 -174.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.93 -31.69 40.07 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-O 117.906 -1.045 . . . . 0.0 112.574 179.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.94 -42.86 59.94 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 120.457 1.48 . . . . 0.0 112.518 176.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.18 -43.06 74.96 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.364 -0.835 . . . . 0.0 110.102 174.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.91 -30.47 65.72 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 125.855 1.693 . . . . 0.0 113.394 -174.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -62.79 -25.61 68.31 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 125.029 1.332 . . . . 0.0 111.499 166.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.499 ' C ' ' H ' ' A' ' 91' ' ' GLN . 27.8 tp 77.55 148.39 0.1 Allowed 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 129.139 2.975 . . . . 0.0 107.877 -167.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 4.3 m -57.1 5.09 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 120.396 -1.44 . . . . 0.0 113.969 165.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.499 ' H ' ' C ' ' A' ' 89' ' ' LEU . 28.7 mm-40 71.9 -43.28 0.56 Allowed 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 130.66 3.584 . . . . 0.0 111.026 -175.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -55.47 103.21 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 125.939 1.696 . . . . 0.0 112.937 -171.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.4 t 61.82 -31.03 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 C-N-CA 130.606 3.562 . . . . 0.0 117.651 168.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 tm? 109.38 93.03 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.509 1 C-N-CA 132.278 4.231 . . . . 0.0 101.858 -163.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.492 ' H ' HD11 ' A' ' 89' ' ' LEU . . . -62.61 82.57 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 -169.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.7 t -63.11 149.58 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 126.835 2.054 . . . . 0.0 111.889 169.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -59.45 -6.82 1.15 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 128.88 2.872 . . . . 0.0 115.403 175.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 17.7 p -75.97 113.38 13.41 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.426 1.091 . . . . 0.0 112.294 -175.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -75.44 69.5 2.22 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.864 1.266 . . . . 0.0 110.353 168.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.94 145.34 72.37 Favored Pre-proline 0 CA--C 1.55 0.949 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.478 173.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -63.83 136.1 51.58 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 123.111 2.54 . . . . 0.0 113.47 -168.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.0 t . . . . . 0 CA--C 1.555 1.138 0 C-N-CA 127.347 2.259 . . . . 0.0 111.106 -178.965 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mm? . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 116.011 1.856 . . . . 0.0 116.011 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.13 -52.38 14.42 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.48 1.036 . . . . 0.0 111.568 173.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -53.85 -35.17 61.2 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.405 1.482 . . . . 0.0 113.188 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.499 ' CD2' HD22 ' B' ' 63' ' ' LEU . 2.5 tm? -50.28 -56.36 11.54 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 127.597 2.359 . . . . 0.0 110.347 169.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.62 -19.61 78.0 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-O 118.858 -0.968 . . . . 0.0 113.781 177.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 57.8 mmt-85 -66.75 -49.4 66.07 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.447 1.623 . . . . 0.0 108.624 168.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.96 -37.22 72.78 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.955 1.702 . . . . 0.0 113.971 -178.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 7.0 mp -72.52 -14.84 61.74 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.382 0.992 . . . . 0.0 113.156 176.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -121.84 29.45 7.11 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.107 0.963 . . . . 0.0 112.681 170.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -90.87 153.2 45.17 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 165.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -54.8 -94.36 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.781 1 C-N-CA 126.224 4.616 . . . . 0.0 113.38 -168.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 16.5 p -51.7 -31.01 24.35 Favored 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 126.492 1.917 . . . . 0.0 112.625 170.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.87 -42.18 77.37 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.553 1.069 . . . . 0.0 111.726 -176.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 39.0 t -61.93 -42.72 99.43 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 119.003 0.819 . . . . 0.0 109.988 167.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -46.52 81.82 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 118.21 -0.9 . . . . 0.0 113.116 175.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.4 mm -55.81 -51.77 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 CA-C-N 120.487 1.494 . . . . 0.0 110.091 173.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 79.6 mt -59.68 -42.67 93.44 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 118.635 -0.698 . . . . 0.0 112.408 -177.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 7.1 p -80.45 -30.23 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 118.874 0.761 . . . . 0.0 112.731 -178.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.39 -35.95 68.57 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.586 -0.696 . . . . 0.0 112.215 173.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 20.0 tp -61.76 -37.97 86.27 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 117.068 -1.444 . . . . 0.0 112.5 177.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -44.24 -53.77 6.32 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 128.365 2.666 . . . . 0.0 112.28 -177.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -88.26 -15.47 35.73 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.732 1.613 . . . . 0.0 112.447 179.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.39 -77.54 1.26 Allowed Glycine 0 C--N 1.338 0.682 0 C-N-CA 124.901 1.239 . . . . 0.0 112.281 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . 0.425 HG12 ' HA ' ' B' ' 76' ' ' ALA . 29.4 m 37.45 41.21 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 126.582 1.953 . . . . 0.0 114.509 -169.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -87.67 -72.78 0.51 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 121.727 -0.608 . . . . 0.0 112.046 -173.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 49.4 p90 -155.82 157.49 31.43 Favored Pre-proline 0 CA--C 1.538 0.506 0 CA-C-O 118.761 -0.638 . . . . 0.0 112.571 -170.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -60.49 125.04 16.34 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.576 2.184 . . . . 0.0 109.703 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.95 -1.54 88.81 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-O 117.564 -1.687 . . . . 0.0 114.763 -174.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . 0.437 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -56.81 -36.27 69.73 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.336 2.068 . . . . 0.0 111.015 169.751 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mt -61.51 -18.49 59.34 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.218 1.007 . . . . 0.0 112.133 -177.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.35 -34.36 75.15 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 118.596 0.635 . . . . 0.0 111.026 175.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.77 -38.66 32.69 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.133 0.973 . . . . 0.0 112.741 175.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . 0.437 ' CD2' HE22 ' B' ' 39' ' ' GLN . 4.0 m-70 -62.18 -34.7 76.93 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 172.265 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 26.2 mt -103.55 -23.08 13.53 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -173.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.54 8.29 85.9 Favored Glycine 0 CA--C 1.533 1.216 0 CA-C-N 119.194 0.907 . . . . 0.0 114.015 -170.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 9.3 mp -104.64 155.73 18.6 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 118.404 1.102 . . . . 0.0 112.395 -177.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.536 HG23 ' H ' ' B' ' 50' ' ' ASN . 1.6 t -59.47 145.68 43.03 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.11 0.964 . . . . 0.0 112.282 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 29.5 mtm180 -57.19 -24.08 52.0 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.14 1.376 . . . . 0.0 112.469 169.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.9 m -59.76 -59.29 5.66 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.587 1.155 . . . . 0.0 109.856 169.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . 0.536 ' H ' HG23 ' B' ' 47' ' ' THR . 2.7 m120 -72.67 -42.51 64.21 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.969 0.908 . . . . 0.0 110.831 -177.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.5 t -53.79 -40.53 44.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 120.565 1.53 . . . . 0.0 111.924 171.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 50.5 m -68.66 -39.52 80.6 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 120.078 1.308 . . . . 0.0 113.441 175.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -57.99 -48.55 79.68 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.932 0.893 . . . . 0.0 111.259 172.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 19.4 m170 -60.63 -38.49 84.95 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 118.034 -0.984 . . . . 0.0 112.097 173.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 42.7 mt -70.89 -21.22 62.42 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.11 1.364 . . . . 0.0 114.115 174.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . 0.487 ' HA ' HH21 ' B' ' 59' ' ' ARG . 0.2 OUTLIER -61.14 -59.35 5.48 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 121.476 1.944 . . . . 0.0 112.711 -172.282 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -73.21 -26.35 61.11 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 122.121 0.962 . . . . 0.0 111.487 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.22 -48.17 71.36 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.62 1.568 . . . . 0.0 111.216 169.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.487 HH21 ' HA ' ' B' ' 56' ' ' SER . 76.5 mtm180 -82.81 -21.54 34.47 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.537 1.135 . . . . 0.0 112.48 178.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -78.29 -60.45 2.68 Favored Glycine 0 N--CA 1.469 0.891 0 CA-C-N 119.381 0.991 . . . . 0.0 113.234 177.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 20.8 m -67.89 -7.94 32.41 Favored 'General case' 0 CA--C 1.564 1.495 0 C-N-CA 125.236 1.414 . . . . 0.0 114.106 -178.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.87 7.99 54.72 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 127.008 2.242 . . . . 0.0 115.87 171.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.499 HD22 ' CD2' ' B' ' 14' ' ' LEU . 1.7 mt -66.5 -26.38 67.14 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.77 1.628 . . . . 0.0 112.98 -176.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 3.0 m -142.38 159.75 19.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 127.417 2.287 . . . . 0.0 110.723 174.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 4.8 t -133.91 167.04 27.22 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 C-N-CA 126.185 1.794 . . . . 0.0 109.449 176.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.33 130.43 50.6 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.652 1.581 . . . . 0.0 111.84 171.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.478 HG22 ' H ' ' B' ' 68' ' ' TYR . 1.3 m -120.64 -178.23 3.66 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.637 1.575 . . . . 0.0 108.223 178.177 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.478 ' H ' HG22 ' B' ' 67' ' ' THR . 29.7 m-85 -116.21 131.46 56.94 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.332 1.053 . . . . 0.0 112.005 169.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.52 10.29 18.23 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.579 0.752 . . . . 0.0 110.484 165.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.9 -56.45 4.94 Favored Glycine 0 C--N 1.344 0.984 0 C-N-CA 125.956 1.741 . . . . 0.0 112.182 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -70.49 -19.98 62.89 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.645 1.578 . . . . 0.0 112.553 174.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -165.2 168.47 17.05 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.121 2.168 . . . . 0.0 109.621 -174.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 32.9 m -88.3 156.73 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 O-C-N 121.489 -0.757 . . . . 0.0 110.226 167.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . 0.439 ' HG2' ' HB ' ' B' ' 67' ' ' THR . 24.2 ptt180 -132.92 173.13 11.72 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.503 1.121 . . . . 0.0 109.034 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -111.59 160.53 17.12 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 164.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . 0.425 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -156.16 152.87 28.42 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.649 1.58 . . . . 0.0 110.295 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 tp -63.25 158.39 20.28 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.417 1.487 . . . . 0.0 112.594 176.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.67 -29.88 60.09 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 116.958 2.207 . . . . 0.0 116.958 -175.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 10.0 t70 168.63 166.37 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 129.425 3.09 . . . . 0.0 109.4 -169.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 45.2 t -46.11 -33.21 3.36 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.435 1.894 . . . . 0.0 112.121 166.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -45.76 -64.66 0.68 Allowed 'General case' 0 C--N 1.343 0.287 0 C-N-CA 125.208 1.403 . . . . 0.0 112.878 171.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 14.5 mt -68.07 -31.91 71.87 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.416 1.007 . . . . 0.0 110.848 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.27 -45.23 94.2 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.416 1.007 . . . . 0.0 110.286 -176.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.95 -40.24 28.49 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.569 0.748 . . . . 0.0 112.765 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.2 -33.58 71.88 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.797 1.18 . . . . 0.0 113.733 179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.13 -42.34 47.17 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.47 -0.769 . . . . 0.0 110.193 170.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.05 -39.06 54.8 Favored Glycine 0 CA--C 1.538 1.519 0 C-N-CA 125.6 1.571 . . . . 0.0 114.222 -169.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.84 -31.67 59.45 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 119.116 1.458 . . . . 0.0 109.662 166.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 19.3 tp 82.14 160.8 0.14 Allowed 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 128.98 2.912 . . . . 0.0 111.296 169.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . 0.511 HG23 HG12 ' B' ' 92' ' ' VAL . 15.9 m -57.07 8.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 127.21 2.204 . . . . 0.0 114.648 169.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 71.56 -20.39 0.24 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.461 1.905 . . . . 0.0 114.895 171.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.511 HG12 HG23 ' B' ' 90' ' ' VAL . 2.5 p -54.56 29.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 C-N-CA 131.393 3.877 . . . . 0.0 118.301 -176.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.2 t 69.26 15.72 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 125.533 1.533 . . . . 0.0 111.379 171.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 2.1 tm? 101.63 107.3 0.01 OUTLIER 'General case' 0 C--N 1.35 0.601 0 C-N-CA 130.583 3.553 . . . . 0.0 109.055 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.873 0 O-C-N 120.94 -1.1 . . . . 0.0 110.998 168.352 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.5 mm? . . . . . 0 N--CA 1.467 0.401 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.59 -32.04 49.34 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 120.293 1.406 . . . . 0.0 112.91 172.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.0 mmt85 -66.94 -18.36 65.34 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 120.312 -1.492 . . . . 0.0 113.017 177.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.554 HD21 HD21 ' A' ' 63' ' ' LEU . 3.1 tm? -70.28 -39.22 75.02 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.6 1.16 . . . . 0.0 110.807 172.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.08 -40.83 99.7 Favored Glycine 0 C--N 1.341 0.86 0 N-CA-C 111.099 -0.8 . . . . 0.0 111.099 171.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -57.25 -46.03 83.4 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.212 1.006 . . . . 0.0 109.674 171.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.73 -19.63 65.1 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 116.916 -1.516 . . . . 0.0 113.578 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 mp -98.4 -16.35 19.31 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 171.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.86 -34.17 51.81 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.633 1.973 . . . . 0.0 114.3 169.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -50.85 136.37 26.74 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 125.098 1.359 . . . . 0.0 111.203 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -60.01 -77.34 0.02 OUTLIER 'Trans proline' 0 CA--C 1.537 0.647 1 C-N-CA 125.47 4.113 . . . . 0.0 113.23 -169.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.443 ' HB ' ' CD2' ' A' ' 54' ' ' HIS . 24.6 m -53.98 -36.7 63.18 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 117.59 -1.195 . . . . 0.0 110.408 174.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.32 -43.0 82.7 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.915 1.234 . . . . 0.0 113.336 -175.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 11.8 t -54.43 -44.63 72.62 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.601 1.16 . . . . 0.0 110.276 168.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -43.68 93.98 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-O 117.857 -1.068 . . . . 0.0 112.444 175.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -54.44 -50.45 57.68 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 C-N-CA 125.948 1.699 . . . . 0.0 111.061 174.528 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 14.9 mt -52.57 -39.39 61.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 118.671 -0.68 . . . . 0.0 112.573 -176.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.08 -20.26 26.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 118.807 0.731 . . . . 0.0 112.559 -177.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.39 -6.93 59.43 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 174.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -105.91 -13.26 15.55 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 169.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.47 -48.35 64.72 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 127.394 2.277 . . . . 0.0 108.773 165.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -135.86 96.06 3.35 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.514 2.726 . . . . 0.0 107.932 175.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 159.59 -95.8 0.14 Allowed Glycine 0 N--CA 1.468 0.78 0 C-N-CA 124.824 1.202 . . . . 0.0 111.105 176.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.0 m 51.4 33.13 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 178.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 2.4 m -80.55 -65.58 0.99 Allowed 'General case' 0 C--O 1.222 -0.364 0 O-C-N 121.199 -0.938 . . . . 0.0 111.284 178.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -150.96 157.5 35.41 Favored Pre-proline 0 N--CA 1.47 0.533 0 CA-C-O 117.731 -1.128 . . . . 0.0 111.069 -172.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -59.07 -18.1 41.76 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 122.892 2.395 . . . . 0.0 114.166 169.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -86.91 -12.27 68.83 Favored Glycine 0 CA--C 1.536 1.403 0 CA-C-O 118.494 -1.17 . . . . 0.0 115.252 170.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.87 -36.67 56.6 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.884 1.842 . . . . 0.0 112.051 -170.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.686 HD12 ' H ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -66.71 -19.4 65.75 Favored 'General case' 0 C--O 1.217 -0.616 0 C-N-CA 123.14 0.576 . . . . 0.0 110.919 -174.546 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.8 -36.75 79.82 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.387 -0.82 . . . . 0.0 112.734 -177.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -75.0 -47.76 27.53 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 122.794 0.437 . . . . 0.0 110.926 170.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -57.68 -35.72 70.97 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.766 1.226 . . . . 0.0 113.919 -176.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.434 HD12 HG22 ' A' ' 51' ' ' VAL . 65.7 mt -94.53 -15.27 24.29 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 127.598 2.359 . . . . 0.0 112.324 -178.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.33 10.96 54.88 Favored Glycine 0 CA--C 1.53 1.023 0 C-N-CA 124.291 0.948 . . . . 0.0 112.976 -170.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.4 mt -117.22 149.99 39.49 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 124.107 0.963 . . . . 0.0 111.427 -169.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 12.7 p -61.75 147.31 46.61 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.833 -0.542 . . . . 0.0 110.115 -172.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -59.15 -20.33 52.77 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 177.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.0 m -73.94 -46.53 43.64 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.138 0.975 . . . . 0.0 112.085 169.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -65.09 -44.2 89.62 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.364 1.065 . . . . 0.0 111.889 175.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.434 HG22 HD12 ' A' ' 44' ' ' LEU . 23.2 t -61.53 -40.87 87.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.725 1.21 . . . . 0.0 111.391 173.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 70.7 m -64.04 -41.35 97.44 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.921 1.237 . . . . 0.0 112.717 172.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -55.11 -48.93 72.93 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 123.491 0.716 . . . . 0.0 111.48 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . 0.443 ' CD2' ' HB ' ' A' ' 22' ' ' THR 0.272 11.2 m-70 -80.4 -22.98 40.71 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.811 1.412 . . . . 0.0 114.811 176.45 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 31.4 mt -65.16 -30.5 71.42 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.773 1.624 . . . . 0.0 110.619 166.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.6 t -50.76 -59.81 3.71 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.568 1.076 . . . . 0.0 112.857 -173.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 9.0 t -78.29 -11.02 59.91 Favored 'General case' 0 CA--C 1.554 1.112 0 O-C-N 121.476 -0.765 . . . . 0.0 112.227 174.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.9 tp -68.15 -36.28 79.42 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 122.065 2.211 . . . . 0.0 109.882 168.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.0 mtp180 -81.34 -12.77 58.92 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.37 1.868 . . . . 0.0 111.131 173.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -88.48 -60.84 1.5 Allowed Glycine 0 C--N 1.34 0.8 0 C-N-CA 125.044 1.307 . . . . 0.0 111.006 176.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 96.1 m -59.2 8.13 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 128.361 2.664 . . . . 0.0 115.022 171.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.23 -3.55 14.67 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 126.202 1.858 . . . . 0.0 115.743 177.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.554 HD21 HD21 ' A' ' 14' ' ' LEU . 75.4 mt -59.65 -29.53 68.1 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 126.398 1.879 . . . . 0.0 114.555 -174.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.38 137.25 58.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 125.16 1.384 . . . . 0.0 111.95 173.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.6 t -118.06 139.86 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 C-N-CA 125.849 1.66 . . . . 0.0 109.298 174.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -89.01 149.58 23.19 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.556 1.142 . . . . 0.0 113.461 177.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 m -171.16 157.79 5.25 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 126.442 1.897 . . . . 0.0 108.05 -176.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -73.1 143.79 47.24 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 118.903 0.774 . . . . 0.0 112.529 171.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.438 ' CD ' ' H ' ' A' ' 70' ' ' GLY 0.289 2.2 pp20? -84.75 -124.42 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 117.034 -1.46 . . . . 0.0 107.654 165.264 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.438 ' H ' ' CD ' ' A' ' 69' ' ' GLU . . . -77.29 -28.82 57.35 Favored Glycine 0 CA--C 1.537 1.416 0 CA-C-N 121.919 2.145 . . . . 0.0 114.286 171.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.49 -29.02 0.07 Allowed 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 119.15 1.475 . . . . 0.0 114.818 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -81.99 168.86 17.41 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 125.711 1.605 . . . . 0.0 111.011 169.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 26.7 m -98.84 146.78 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 123.272 0.629 . . . . 0.0 110.181 169.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -129.83 168.64 16.28 Favored 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 125.432 1.493 . . . . 0.0 111.626 -171.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -121.6 129.0 52.54 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 124.97 1.308 . . . . 0.0 109.215 170.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -143.05 153.44 42.95 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 125.333 1.453 . . . . 0.0 111.398 -173.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 68.7 mt -64.42 147.24 53.09 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -177.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.35 -28.71 61.26 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -172.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -163.8 159.54 21.36 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 123.148 1.451 . . . . 0.0 112.931 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 96.0 p -43.42 -36.34 1.91 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 128.646 2.778 . . . . 0.0 113.815 167.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -50.78 -52.68 38.5 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 125.201 1.4 . . . . 0.0 112.59 172.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.9 mt -71.43 -53.4 14.12 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.31 -36.52 61.33 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.661 1.185 . . . . 0.0 113.0 -177.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -74.92 -57.42 3.92 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 117.726 -1.131 . . . . 0.0 111.974 -177.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.7 -27.33 68.84 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.466 1.03 . . . . 0.0 112.869 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 60.1 tp -69.35 -41.15 76.98 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.565 1.146 . . . . 0.0 111.469 169.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -78.47 -38.36 25.05 Favored Glycine 0 N--CA 1.469 0.88 0 C-N-CA 126.692 2.091 . . . . 0.0 115.129 -172.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -82.94 -16.6 46.74 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 118.637 1.219 . . . . 0.0 113.014 171.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 43.5 tp 67.95 140.94 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 128.841 2.856 . . . . 0.0 112.241 178.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 34.7 m -63.64 22.19 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.434 1.893 . . . . 0.0 114.656 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 81.08 -26.91 0.14 Allowed 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 125.98 1.712 . . . . 0.0 112.949 158.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.406 ' CG2' HD12 ' B' ' 11' ' ' LEU . 4.1 p -54.44 23.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 C-N-CA 131.57 3.948 . . . . 0.0 118.135 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 68.56 11.69 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 O-C-N 120.379 -1.45 . . . . 0.0 112.459 167.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.1 tt 84.94 100.93 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 129.389 3.076 . . . . 0.0 109.369 -172.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.93 108.13 0.98 Allowed 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 -175.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -66.89 150.42 11.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 125.125 1.37 . . . . 0.0 113.843 169.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -87.41 146.22 25.96 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.423 1.889 . . . . 0.0 108.621 165.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -173.01 136.29 0.65 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.557 1.943 . . . . 0.0 109.164 -177.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.0 p30 -67.48 -31.12 71.05 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 129.783 3.233 . . . . 0.0 112.115 169.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.09 168.26 2.3 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 128.501 2.721 . . . . 0.0 113.378 172.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -68.49 158.73 56.42 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 123.017 2.478 . . . . 0.0 112.848 -172.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 31.4 p . . . . . 0 CA--C 1.542 0.661 0 CA-C-O 123.418 1.58 . . . . 0.0 106.793 165.827 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.406 HD12 ' CG2' ' A' ' 92' ' ' VAL . 4.0 mm? . . . . . 0 CA--C 1.539 0.535 0 N-CA-C 114.487 1.291 . . . . 0.0 114.487 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.91 -39.46 62.78 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 120.975 1.716 . . . . 0.0 110.027 167.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 67.8 mtt180 -72.25 -13.35 61.5 Favored 'General case' 0 CA--C 1.55 0.976 0 O-C-N 120.334 -1.479 . . . . 0.0 113.58 178.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -69.59 -41.85 75.21 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 120.14 1.336 . . . . 0.0 109.751 169.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -60.37 -38.54 94.87 Favored Glycine 0 N--CA 1.47 0.958 0 O-C-N 120.911 -1.118 . . . . 0.0 111.91 172.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -58.09 -38.86 77.23 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.711 -0.876 . . . . 0.0 110.659 172.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.12 -12.93 61.07 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 117.86 -1.067 . . . . 0.0 113.77 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 12.4 mt -93.7 -25.71 17.33 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.205 0.911 . . . . 0.0 112.258 169.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.67 -20.54 49.98 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.641 1.976 . . . . 0.0 114.638 168.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . 0.474 ' CG ' ' HE ' ' B' ' 23' ' ' ARG . 9.7 t70 -56.92 130.09 78.71 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 127.287 2.235 . . . . 0.0 109.371 178.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -49.03 -83.0 0.02 OUTLIER 'Trans proline' 0 C--O 1.237 0.452 1 C-N-CA 126.925 5.083 . . . . 0.0 114.003 -165.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.435 ' HB ' ' CG ' ' B' ' 54' ' ' HIS . 59.8 m -59.6 -32.63 70.57 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 116.652 -1.642 . . . . 0.0 110.89 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.474 ' HE ' ' CG ' ' B' ' 20' ' ' ASP . 23.7 mtm180 -62.27 -42.41 99.31 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 121.136 1.789 . . . . 0.0 114.441 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 6.7 t -52.47 -47.84 66.25 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.689 0.757 . . . . 0.0 110.413 173.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.57 -42.47 82.51 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.488 1.115 . . . . 0.0 112.849 175.016 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -53.21 -52.12 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 C-N-CA 126.585 1.954 . . . . 0.0 110.263 176.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 25.4 mt -54.73 -37.34 65.77 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 123.556 0.742 . . . . 0.0 112.167 -172.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -64.03 -22.15 30.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 118.928 0.785 . . . . 0.0 112.821 178.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.14 -5.11 59.19 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.031 1.332 . . . . 0.0 114.286 173.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -106.8 -19.57 13.6 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 124.867 1.267 . . . . 0.0 113.562 170.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.24 -48.06 77.25 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 127.191 2.197 . . . . 0.0 108.953 164.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -135.12 93.56 3.01 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 128.324 2.649 . . . . 0.0 108.462 175.096 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . 161.86 -92.73 0.11 Allowed Glycine 0 N--CA 1.468 0.773 0 C-N-CA 124.552 1.073 . . . . 0.0 112.145 173.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 4.0 m 51.4 35.86 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 2.7 m -81.8 -66.88 0.83 Allowed 'General case' 0 C--O 1.223 -0.336 0 O-C-N 121.185 -0.947 . . . . 0.0 111.694 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -147.98 157.17 43.71 Favored Pre-proline 0 CA--C 1.537 0.465 0 CA-C-O 117.738 -1.125 . . . . 0.0 110.685 -174.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -59.1 -14.25 22.77 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 123.299 2.666 . . . . 0.0 114.599 171.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -93.89 -14.3 52.61 Favored Glycine 0 CA--C 1.535 1.336 0 CA-C-O 118.242 -1.31 . . . . 0.0 115.465 170.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.65 -34.13 73.57 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.262 2.031 . . . . 0.0 112.108 -170.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.653 ' H ' HD12 ' B' ' 40' ' ' LEU . 0.2 OUTLIER -66.81 -19.01 65.66 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 123.75 0.82 . . . . 0.0 110.511 -172.984 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.52 -37.32 80.78 Favored 'General case' 0 CA--C 1.547 0.833 0 O-C-N 120.891 -1.131 . . . . 0.0 112.174 -177.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.04 -46.83 27.3 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.168 0.587 . . . . 0.0 111.361 171.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -58.72 -32.31 69.08 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -176.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.406 HD12 HG22 ' B' ' 51' ' ' VAL . 69.2 mt -98.93 -20.24 16.9 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 127.128 2.171 . . . . 0.0 112.674 -177.21 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.4 13.52 77.22 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 124.807 1.194 . . . . 0.0 112.964 -170.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 76.3 mt -118.69 151.36 38.12 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 118.229 1.014 . . . . 0.0 111.96 -169.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.8 p -62.89 145.53 54.94 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.497 -0.752 . . . . 0.0 109.783 -173.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -61.39 -17.39 53.9 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 176.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 6.0 m -73.42 -47.94 37.8 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.212 1.005 . . . . 0.0 111.68 169.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -66.17 -45.42 80.94 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.756 0.822 . . . . 0.0 111.134 175.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . 0.406 HG22 HD12 ' B' ' 44' ' ' LEU . 5.3 t -58.3 -40.02 76.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 117.929 -1.034 . . . . 0.0 112.218 171.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 67.8 m -67.34 -41.04 85.85 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 121.005 1.729 . . . . 0.0 112.676 174.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -57.99 -47.65 82.35 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.488 0.715 . . . . 0.0 111.218 177.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . 0.435 ' CG ' ' HB ' ' B' ' 22' ' ' THR . 79.0 m-70 -75.75 -26.11 57.13 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 121.262 -0.899 . . . . 0.0 113.329 175.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 38.3 mt -66.07 -29.43 69.77 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 121.077 1.762 . . . . 0.0 111.193 167.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.2 t -51.33 -57.93 7.56 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.593 1.088 . . . . 0.0 113.375 -172.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 34.2 t -79.69 -9.79 59.69 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 123.542 0.737 . . . . 0.0 112.672 172.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.2 tp -67.03 -37.57 84.36 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 121.965 2.166 . . . . 0.0 109.063 167.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 22.6 mtp-105 -82.2 -7.28 59.62 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.08 2.152 . . . . 0.0 111.429 174.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -91.14 -64.35 1.18 Allowed Glycine 0 C--N 1.342 0.863 0 C-N-CA 125.936 1.732 . . . . 0.0 111.358 173.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 67.8 m -61.1 13.79 0.01 OUTLIER 'General case' 0 CA--C 1.563 1.472 0 C-N-CA 128.227 2.611 . . . . 0.0 115.238 172.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.06 -2.36 6.97 Favored Glycine 0 N--CA 1.474 1.216 0 C-N-CA 126.439 1.971 . . . . 0.0 115.836 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.45 HD23 HD13 ' B' ' 82' ' ' LEU . 52.7 mt -59.27 -28.26 66.57 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.845 1.658 . . . . 0.0 113.8 -175.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -129.46 137.32 57.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 125.243 1.417 . . . . 0.0 112.636 172.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 75.1 t -116.0 136.75 51.91 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 C-N-CA 126.289 1.836 . . . . 0.0 109.566 171.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.68 145.56 28.71 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 122.192 0.996 . . . . 0.0 112.457 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 41.1 m -158.68 159.44 35.32 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 126.048 1.739 . . . . 0.0 107.206 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -83.63 144.2 29.59 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 119.481 1.037 . . . . 0.0 111.771 170.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.269 2.6 pp20? -88.39 -141.48 0.13 Allowed 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 165.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -69.82 -23.09 77.06 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 121.636 2.016 . . . . 0.0 114.572 177.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.72 -30.12 0.07 Allowed 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 -89.36 171.92 9.4 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 126.826 2.05 . . . . 0.0 112.068 174.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 19.7 m -96.13 150.21 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.315 0.646 . . . . 0.0 109.742 167.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -137.57 163.54 30.94 Favored 'General case' 0 CA--C 1.521 -0.139 0 C-N-CA 125.73 1.612 . . . . 0.0 110.935 -171.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -119.54 127.83 53.37 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 125.238 1.415 . . . . 0.0 109.187 174.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -141.15 156.06 46.0 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.348 1.459 . . . . 0.0 110.971 -175.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 61.8 mt -63.85 148.38 49.5 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.155 0.502 . . . . 0.0 111.751 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.0 -28.07 62.16 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 -173.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -167.16 160.12 13.52 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.06 1.344 . . . . 0.0 111.715 -178.078 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 94.6 p -41.7 -35.91 0.87 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 128.134 2.574 . . . . 0.0 113.448 167.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -48.38 -54.76 12.79 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 126.08 1.752 . . . . 0.0 112.784 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . 0.45 HD13 HD23 ' B' ' 63' ' ' LEU . 7.5 mt -75.32 -47.07 29.49 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.629 -0.7 . . . . 0.0 109.474 -177.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.42 -36.08 53.45 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.103 0.961 . . . . 0.0 113.026 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -76.03 -56.13 4.95 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.888 1.275 . . . . 0.0 111.865 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.81 -28.96 66.49 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 176.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 61.1 tp -77.64 -37.5 49.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.426 1.89 . . . . 0.0 112.524 171.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -80.95 -42.37 9.69 Favored Glycine 0 N--CA 1.469 0.837 0 C-N-CA 126.035 1.779 . . . . 0.0 113.915 -169.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -80.69 -23.74 39.35 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 117.967 0.884 . . . . 0.0 111.372 168.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 19.8 tp 68.76 160.71 0.19 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 129.464 3.106 . . . . 0.0 111.398 178.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . 0.407 HG23 HG12 ' B' ' 92' ' ' VAL . 17.8 m -58.92 12.22 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 125.857 1.663 . . . . 0.0 114.087 167.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 73.82 -17.75 0.43 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 126.146 1.778 . . . . 0.0 114.229 168.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.407 HG12 HG23 ' B' ' 90' ' ' VAL . 1.6 p -59.49 20.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 C-N-CA 128.187 2.595 . . . . 0.0 116.863 177.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.4 t 65.87 23.45 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 C-N-CA 125.373 1.469 . . . . 0.0 113.656 165.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 tt 79.34 92.56 0.06 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 127.47 2.308 . . . . 0.0 110.203 -176.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.694 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 178.279 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 N--CA 1.473 0.724 0 N-CA-C 113.199 0.815 . . . . 0.0 113.199 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.21 -34.38 76.35 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.173 -0.955 . . . . 0.0 112.356 178.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -58.27 -31.48 67.48 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 120.983 -1.073 . . . . 0.0 112.893 -176.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -49.57 -58.08 5.9 Favored 'General case' 0 C--O 1.225 -0.228 0 C-N-CA 126.119 1.768 . . . . 0.0 110.576 173.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -61.3 -35.01 90.29 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-N 118.77 0.714 . . . . 0.0 112.186 -173.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.8 -50.42 62.69 Favored 'General case' 0 C--O 1.221 -0.434 0 C-N-CA 124.043 0.937 . . . . 0.0 110.538 173.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.99 -22.93 64.98 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -177.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -88.19 -24.76 23.21 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 119.107 0.867 . . . . 0.0 112.133 170.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.45 31.74 1.48 Allowed 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.652 1.581 . . . . 0.0 112.574 167.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.56 167.29 21.28 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 125.528 1.531 . . . . 0.0 107.407 167.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.76 -105.9 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 123.975 3.117 . . . . 0.0 109.997 174.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.7 m -63.85 -14.76 55.87 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.626 1.57 . . . . 0.0 113.078 -178.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.75 -37.86 87.53 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 120.285 1.402 . . . . 0.0 111.765 169.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 19.8 t -64.93 -40.18 94.64 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 118.901 0.773 . . . . 0.0 110.593 172.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 13.5 mmp_? -59.69 -51.4 69.96 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.941 0.896 . . . . 0.0 112.77 172.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.3 mm -47.7 -57.16 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 124.279 1.032 . . . . 0.0 110.835 170.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 86.9 mt -60.8 -50.4 73.62 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.022 0.828 . . . . 0.0 112.092 -176.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.4 p -72.12 -27.07 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -174.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.3 -26.23 28.7 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.358 0.663 . . . . 0.0 112.685 173.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.499 ' O ' HG13 ' A' ' 34' ' ' VAL . 7.8 mt -63.2 -41.76 99.21 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 117.879 -1.057 . . . . 0.0 112.154 170.007 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -40.13 -51.89 2.6 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.93 2.492 . . . . 0.0 114.492 -177.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -97.8 -16.08 19.99 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.613 1.565 . . . . 0.0 112.459 173.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.09 -46.9 9.75 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 125.388 1.471 . . . . 0.0 115.069 -174.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.546 HG12 ' HA ' ' A' ' 76' ' ' ALA . 15.9 m 3.48 58.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 131.245 3.818 . . . . 0.0 118.603 -178.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 55.6 m -118.65 -57.86 2.01 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.517 1.927 . . . . 0.0 111.669 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -149.02 148.77 28.16 Favored Pre-proline 0 N--CA 1.474 0.728 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -171.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -55.53 -45.34 40.4 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 122.7 2.266 . . . . 0.0 112.406 172.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -74.89 -6.55 78.86 Favored Glycine 0 CA--C 1.532 1.14 0 CA-C-O 118.836 -0.98 . . . . 0.0 114.541 178.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -65.42 -33.74 76.66 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.159 1.48 . . . . 0.0 111.875 -175.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.49 HD21 ' HG ' ' A' ' 30' ' ' LEU . 2.2 mt -64.39 -6.97 8.18 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 123.443 0.697 . . . . 0.0 112.043 -175.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.84 -39.96 95.47 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 122.638 0.375 . . . . 0.0 110.462 172.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.77 -38.85 62.07 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.608 0.763 . . . . 0.0 111.59 171.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.412 ' HD2' HD23 ' A' ' 40' ' ' LEU . 2.4 m-70 -61.63 -23.73 66.24 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 177.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 69.0 mt -119.81 -16.3 8.75 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.076 1.35 . . . . 0.0 113.941 -173.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.78 10.31 67.4 Favored Glycine 0 CA--C 1.537 1.423 0 CA-C-N 118.99 0.814 . . . . 0.0 112.925 -168.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 79.4 mt -104.86 158.26 16.65 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.574 1.187 . . . . 0.0 112.98 -171.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.2 t -66.4 153.37 42.96 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 122.103 0.954 . . . . 0.0 111.374 176.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -54.59 -22.47 13.45 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.348 1.459 . . . . 0.0 113.424 173.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.6 t -67.39 -56.71 8.57 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.336 0.971 . . . . 0.0 111.293 169.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -62.69 -37.58 87.02 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.47 1.108 . . . . 0.0 112.151 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.8 t -58.16 -50.0 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 123.557 0.743 . . . . 0.0 111.024 169.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.4 m -63.34 -34.09 76.95 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 177.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -57.43 -52.63 64.59 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.722 1.609 . . . . 0.0 110.651 -178.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 49.1 m-70 -76.98 -19.0 57.85 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.343 1.238 . . . . 0.0 114.343 175.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 41.7 mt -76.05 -22.14 56.01 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 120.402 1.456 . . . . 0.0 112.845 169.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 88.9 p -52.2 -64.13 0.92 Allowed 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 120.648 1.567 . . . . 0.0 113.48 -175.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 51.0 t -64.69 -39.62 93.97 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.404 1.082 . . . . 0.0 110.785 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.5 tp -48.02 -40.65 23.41 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.673 1.589 . . . . 0.0 113.761 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 -88.1 -17.0 31.99 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.928 1.291 . . . . 0.0 113.3 -175.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -93.3 -45.55 3.49 Favored Glycine 0 N--CA 1.477 1.4 0 C-N-CA 125.248 1.404 . . . . 0.0 111.959 175.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 55.5 m -75.23 7.58 3.32 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 127.151 2.181 . . . . 0.0 112.866 170.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 66.1 6.28 31.42 Favored Glycine 0 N--CA 1.468 0.827 0 C-N-CA 126.019 1.771 . . . . 0.0 117.083 169.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 47.2 mt -61.37 -19.95 62.45 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.4 1.6 . . . . 0.0 113.384 178.221 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.1 m -132.47 147.26 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 127.333 2.253 . . . . 0.0 111.862 169.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 82.8 t -128.82 137.37 57.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 126.791 2.036 . . . . 0.0 109.616 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.19 172.82 11.08 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 123.126 1.441 . . . . 0.0 114.346 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.7 m -160.72 149.16 16.37 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.92 1.288 . . . . 0.0 108.514 177.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -98.63 114.25 26.64 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.692 1.133 . . . . 0.0 110.869 168.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.46 ' CD ' ' HD3' ' A' ' 74' ' ' ARG . 12.1 mm-40 -93.52 34.36 1.18 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.144 1.778 . . . . 0.0 113.428 -173.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.33 -17.35 1.08 Allowed Glycine 0 CA--C 1.536 1.363 0 O-C-N 120.209 -1.557 . . . . 0.0 115.254 174.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -145.26 -17.09 0.49 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.28 1.432 . . . . 0.0 113.773 -178.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -152.61 -178.98 7.2 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 127.944 2.498 . . . . 0.0 107.105 175.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 16.3 m -108.85 155.48 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 123.785 0.834 . . . . 0.0 109.212 168.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.46 ' HD3' ' CD ' ' A' ' 69' ' ' GLU . 2.2 ptt180 -122.95 175.21 6.7 Favored 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 124.76 1.224 . . . . 0.0 111.092 176.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.402 ' O ' HD22 ' A' ' 30' ' ' LEU . 39.1 m-85 -130.76 118.66 21.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.094 -1.412 . . . . 0.0 107.914 168.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.546 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -108.92 156.97 19.08 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 125.07 1.348 . . . . 0.0 109.396 174.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.2 tp -54.99 152.27 7.76 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.048 1.339 . . . . 0.0 111.377 172.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -45.54 -48.35 14.27 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.514 1.302 . . . . 0.0 114.514 -171.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -171.87 -179.96 2.57 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.122 0.963 . . . . 0.0 111.308 -176.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.6 p -42.78 -39.23 2.39 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.441 1.896 . . . . 0.0 112.309 167.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -54.19 -57.08 12.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.469 1.507 . . . . 0.0 113.262 177.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 18.4 mt -74.61 -34.87 62.92 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.9 1.227 . . . . 0.0 110.626 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.39 -21.92 66.73 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.457 0.571 . . . . 0.0 112.329 -178.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -81.58 -74.28 0.34 Allowed 'General case' 0 C--O 1.219 -0.515 0 CA-C-O 116.753 -1.594 . . . . 0.0 111.278 166.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.04 -21.91 66.71 Favored 'General case' 0 CA--C 1.555 1.168 0 CA-C-N 123.06 2.663 . . . . 0.0 115.974 -169.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.69 -42.62 50.57 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 120.553 1.524 . . . . 0.0 109.702 167.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -66.26 -32.32 81.74 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 127.912 2.672 . . . . 0.0 115.6 179.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.32 -27.25 62.04 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 126.85 2.06 . . . . 0.0 112.416 169.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 28.6 tp 71.29 97.95 0.07 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 128.408 2.683 . . . . 0.0 108.909 -170.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.464 HG23 HG12 ' A' ' 92' ' ' VAL . 33.6 m -51.62 11.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 129.414 3.086 . . . . 0.0 118.418 -176.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.5 mm-40 80.64 -28.58 0.13 Allowed 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 119.749 -1.844 . . . . 0.0 113.464 157.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.464 HG12 HG23 ' A' ' 90' ' ' VAL . 4.9 p -62.12 43.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 C-N-CA 128.755 2.822 . . . . 0.0 115.691 176.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 67.32 6.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 C-N-CA 127.609 2.364 . . . . 0.0 113.058 177.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.8 tt 71.97 93.71 0.08 Allowed 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 127.731 2.412 . . . . 0.0 107.414 -168.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.49 123.23 14.04 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.108 0.563 . . . . 0.0 112.326 -173.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 29.0 t -63.55 164.78 1.38 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 126.19 1.796 . . . . 0.0 110.149 169.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.88 19.27 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 126.098 1.759 . . . . 0.0 113.905 172.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 16.3 p -109.39 131.58 54.93 Favored 'General case' 0 CA--C 1.516 -0.352 0 O-C-N 120.124 -1.61 . . . . 0.0 114.268 -173.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -87.89 131.31 34.62 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 105.81 -1.922 . . . . 0.0 105.81 162.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -132.84 137.88 30.66 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 105.675 -1.972 . . . . 0.0 105.675 -174.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -73.6 179.37 5.65 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 124.682 3.588 . . . . 0.0 113.367 -168.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.55 0.967 0 CA-C-O 121.595 0.712 . . . . 0.0 111.178 178.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 29.3 mt . . . . . 0 N--CA 1.469 0.52 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.31 -37.69 68.89 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 122.833 0.453 . . . . 0.0 112.166 173.221 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.33 -30.19 62.27 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -176.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -46.4 -60.93 2.04 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 127.199 2.2 . . . . 0.0 110.015 169.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.13 -21.96 70.36 Favored Glycine 0 C--N 1.338 0.684 0 CA-C-O 118.806 -0.997 . . . . 0.0 112.842 -172.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -53.81 8.79 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.388 1.094 . . . . 0.0 110.171 169.089 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.98 -22.77 65.9 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -174.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -87.97 -19.38 27.3 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.369 0.986 . . . . 0.0 112.093 169.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -82.31 63.65 6.59 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.009 1.324 . . . . 0.0 110.097 171.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.5 166.88 20.13 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 125.033 1.333 . . . . 0.0 112.73 -168.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -71.64 -116.82 0.01 OUTLIER 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 124.671 3.581 . . . . 0.0 107.781 165.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 42.4 p -60.19 -22.18 62.64 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 -173.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.423 ' CG ' HD13 ' B' ' 58' ' ' LEU . 4.5 ttp180 -61.57 -36.24 80.08 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 121.635 2.016 . . . . 0.0 112.23 174.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 48.7 t -69.25 -41.74 76.54 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.027 0.83 . . . . 0.0 111.577 168.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 17.1 mmp_? -58.97 -52.44 65.73 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.372 0.669 . . . . 0.0 112.075 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 18.3 mm -42.78 -56.16 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 125.837 1.655 . . . . 0.0 109.832 172.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 94.6 mt -62.71 -45.53 92.33 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 118.983 -0.532 . . . . 0.0 112.422 -175.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 8.4 p -74.24 -28.05 22.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -178.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . 0.47 ' HB1' ' CD2' ' B' ' 43' ' ' HIS . . . -84.8 -25.75 27.96 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 175.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.506 HD23 ' HA ' ' B' ' 30' ' ' LEU . 9.0 mt -62.23 -43.05 99.72 Favored 'General case' 0 CA--C 1.52 -0.178 0 O-C-N 121.28 -0.888 . . . . 0.0 111.977 172.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -41.65 -45.18 3.34 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 129.137 2.975 . . . . 0.0 115.092 -174.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -117.35 13.17 14.48 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 126.059 1.744 . . . . 0.0 112.658 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.69 -69.34 0.77 Allowed Glycine 0 N--CA 1.472 1.093 0 C-N-CA 127.321 2.391 . . . . 0.0 112.806 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 29.43 41.13 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 128.599 2.76 . . . . 0.0 117.201 -177.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 94.2 m -84.07 -79.31 0.21 Allowed 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 125.443 1.497 . . . . 0.0 110.208 173.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.36 158.35 51.17 Favored Pre-proline 0 N--CA 1.482 1.143 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 -168.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.08 -34.69 93.39 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 123.162 2.574 . . . . 0.0 113.519 176.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -76.92 -12.43 84.61 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-O 118.419 -1.212 . . . . 0.0 113.916 175.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.12 -31.15 72.2 Favored 'General case' 0 C--N 1.348 0.502 0 CA-C-N 120.076 1.938 . . . . 0.0 112.424 -170.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.447 HD21 ' HG ' ' B' ' 30' ' ' LEU . 1.1 mt -69.06 -7.34 34.88 Favored 'General case' 0 C--N 1.342 0.258 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -175.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.0 -39.06 80.7 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 118.422 0.555 . . . . 0.0 110.651 169.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.79 -43.93 57.41 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.62 0.768 . . . . 0.0 111.867 172.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . 0.47 ' CD2' ' HB1' ' B' ' 29' ' ' ALA . 5.4 m-70 -59.13 -27.1 65.3 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 67.9 mt -111.83 -16.59 13.13 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.983 1.713 . . . . 0.0 113.533 -177.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.09 15.26 69.45 Favored Glycine 0 CA--C 1.536 1.367 0 CA-C-N 118.757 0.708 . . . . 0.0 112.708 -168.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 86.4 mt -108.76 171.04 7.66 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.753 1.276 . . . . 0.0 113.453 -173.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.9 t -69.98 151.09 45.99 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 122.026 0.917 . . . . 0.0 111.149 169.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -54.45 -18.92 4.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.686 1.594 . . . . 0.0 113.553 168.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 11.7 t -68.05 -58.62 4.2 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.066 0.848 . . . . 0.0 111.493 169.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -59.32 -36.73 76.16 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.452 -0.78 . . . . 0.0 112.531 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 42.1 t -57.83 -50.29 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 123.419 0.688 . . . . 0.0 111.027 170.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 41.2 m -68.7 -31.82 71.18 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -178.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 32.4 t-20 -57.43 -62.0 2.09 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.212 1.405 . . . . 0.0 109.806 178.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 -68.13 -24.53 65.02 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 121.034 -1.041 . . . . 0.0 112.876 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 73.7 mt -69.97 -19.19 63.37 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 119.711 1.141 . . . . 0.0 113.76 170.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 89.3 p -58.16 -48.17 81.11 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 121.075 1.761 . . . . 0.0 111.892 174.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 51.7 t -68.89 -46.23 68.91 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.566 0.621 . . . . 0.0 111.034 175.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . 0.423 HD13 ' CG ' ' B' ' 23' ' ' ARG . 2.9 tp -57.52 -36.83 72.08 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.307 1.043 . . . . 0.0 113.357 -171.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -90.13 -16.38 29.7 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.242 1.417 . . . . 0.0 112.867 178.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -79.97 -51.71 4.95 Favored Glycine 0 N--CA 1.472 1.06 0 CA-C-N 119.38 0.991 . . . . 0.0 111.135 170.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 83.4 m -74.44 3.19 7.91 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 126.913 2.085 . . . . 0.0 113.903 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.53 3.95 50.24 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.006 1.288 . . . . 0.0 115.446 169.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 84.5 mt -57.85 -23.81 54.59 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.496 1.648 . . . . 0.0 112.619 176.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.8 m -126.73 147.6 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 126.742 2.017 . . . . 0.0 111.662 168.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 65.8 t -136.05 132.99 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 126.838 2.055 . . . . 0.0 109.589 -176.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.75 157.82 27.04 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.832 1.653 . . . . 0.0 113.488 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 15.7 m -165.29 140.73 5.22 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.547 1.539 . . . . 0.0 108.072 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -63.83 122.29 16.08 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.814 0.734 . . . . 0.0 111.479 172.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . 0.469 ' CD ' ' H ' ' B' ' 72' ' ' GLN . 5.1 pt-20 -71.99 -21.66 61.54 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -178.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 116.25 4.67 17.92 Favored Glycine 0 CA--C 1.539 1.589 0 C-N-CA 125.52 1.534 . . . . 0.0 113.834 -168.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . 0.421 ' H ' ' HG2' ' B' ' 69' ' ' GLU . 29.2 ttm180 -155.5 -53.46 0.09 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.187 1.395 . . . . 0.0 111.493 175.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . 0.469 ' H ' ' CD ' ' B' ' 69' ' ' GLU . 9.4 mm-40 -116.37 -125.04 0.28 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.57 1.548 . . . . 0.0 108.181 167.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 11.5 p -149.13 137.07 14.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 126.095 1.758 . . . . 0.0 107.182 -167.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.2 ptt85 -105.04 170.84 7.64 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.967 1.307 . . . . 0.0 109.034 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.454 ' O ' HD22 ' B' ' 30' ' ' LEU . 45.6 m-85 -129.27 116.14 18.68 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 168.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -108.43 169.18 8.81 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.773 1.229 . . . . 0.0 109.579 175.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 tp -59.88 162.07 5.85 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.987 0.915 . . . . 0.0 111.421 169.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -48.96 -54.42 15.62 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.981 0.912 . . . . 0.0 112.603 176.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -165.97 165.63 17.91 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.708 1.203 . . . . 0.0 110.945 -169.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 92.2 p -40.26 -37.5 0.65 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.615 2.366 . . . . 0.0 112.582 166.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -52.33 -58.45 6.63 Favored 'General case' 0 C--N 1.341 0.231 0 C-N-CA 125.165 1.386 . . . . 0.0 113.762 173.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 13.9 mt -70.36 -32.47 70.17 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.505 1.048 . . . . 0.0 110.011 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.5 -28.33 67.74 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.682 0.793 . . . . 0.0 111.769 -176.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.42 -71.11 0.46 Allowed 'General case' 0 C--O 1.22 -0.461 0 CA-C-O 116.63 -1.652 . . . . 0.0 111.407 168.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.9 -22.91 65.97 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 122.998 2.635 . . . . 0.0 115.253 -170.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.57 -46.55 25.81 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.049 -1.032 . . . . 0.0 110.356 167.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.24 -28.83 74.02 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 126.158 1.837 . . . . 0.0 115.304 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.11 -26.9 67.99 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.673 1.989 . . . . 0.0 112.257 168.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 34.7 tp 70.32 100.11 0.06 Allowed 'General case' 0 C--O 1.232 0.172 0 C-N-CA 128.481 2.712 . . . . 0.0 109.281 -172.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . 0.54 HG23 HG12 ' B' ' 92' ' ' VAL . 34.0 m -51.5 11.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 C-N-CA 129.431 3.092 . . . . 0.0 118.247 -178.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . 0.45 ' C ' ' H ' ' B' ' 93' ' ' VAL . 31.0 mm-40 77.84 -18.0 0.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 O-C-N 119.854 -1.779 . . . . 0.0 114.53 159.284 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.54 HG12 HG23 ' B' ' 90' ' ' VAL . 4.5 p -66.42 34.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 127.049 2.14 . . . . 0.0 113.452 168.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . 0.45 ' H ' ' C ' ' B' ' 91' ' ' GLN . 2.7 t 69.98 1.07 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.028 0 C-N-CA 127.381 2.273 . . . . 0.0 113.367 169.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 87.53 99.41 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 130.101 3.36 . . . . 0.0 107.135 -174.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.611 0 C-N-CA 124.159 0.984 . . . . 0.0 113.137 -173.765 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 pp . . . . . 0 CA--C 1.535 0.374 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.94 -56.83 9.69 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 169.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 -53.76 -36.37 62.29 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.369 1.068 . . . . 0.0 113.647 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.25 -64.92 0.75 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.492 1.517 . . . . 0.0 110.404 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.64 -19.18 76.32 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 118.927 -0.929 . . . . 0.0 113.531 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -65.55 -4.09 5.5 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.63 1.715 . . . . 0.0 113.328 174.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.4 -6.73 1.54 Allowed 'General case' 0 CA--C 1.547 0.865 0 CA-C-O 117.116 -1.421 . . . . 0.0 114.3 169.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.88 -31.61 17.25 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 121.394 1.906 . . . . 0.0 110.171 165.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.436 ' HB2' ' HA3' ' B' ' 15' ' ' GLY . . . -94.73 76.04 3.69 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.435 1.094 . . . . 0.0 111.913 -177.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.519 ' CG ' ' HE ' ' A' ' 23' ' ' ARG . 1.4 t70 -164.27 140.34 5.0 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 126.62 1.968 . . . . 0.0 111.239 -173.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -51.84 -60.59 0.72 Allowed 'Trans proline' 0 C--N 1.353 0.81 1 C-N-CA 125.463 4.109 . . . . 0.0 112.97 -171.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.9 m -79.15 -31.36 44.02 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 119.425 -0.321 . . . . 0.0 110.566 -173.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.519 ' HE ' ' CG ' ' A' ' 20' ' ' ASP . 67.1 mtm180 -69.23 -33.56 73.48 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 116.241 -1.838 . . . . 0.0 113.633 -173.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 44.5 t -57.67 -55.21 37.79 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 121.185 1.812 . . . . 0.0 110.29 168.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 44.3 mtt180 -45.2 -45.33 11.63 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.221 1.408 . . . . 0.0 112.998 169.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.5 mt -62.4 -58.41 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 CA-C-N 120.181 1.355 . . . . 0.0 111.156 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.13 -44.86 79.57 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.967 0.907 . . . . 0.0 110.883 -175.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.4 p -79.2 -29.39 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 124.496 1.118 . . . . 0.0 112.374 -174.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.73 -35.11 30.08 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 122.893 0.477 . . . . 0.0 112.022 175.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.506 ' O ' HG13 ' A' ' 34' ' ' VAL . 13.2 tp -67.29 -32.14 72.93 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 116.733 -1.603 . . . . 0.0 112.37 172.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -41.67 -45.31 3.39 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.431 1.892 . . . . 0.0 112.579 -178.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -99.9 -26.22 14.08 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.524 1.93 . . . . 0.0 112.724 169.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -83.01 -3.7 90.33 Favored Glycine 0 C--N 1.339 0.74 0 CA-C-O 116.591 -2.227 . . . . 0.0 117.101 -168.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.506 HG13 ' O ' ' A' ' 30' ' ' LEU . 16.7 m -29.91 45.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.663 1 C-N-CA 132.087 4.155 . . . . 0.0 120.564 171.445 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 2.4 t -107.78 -51.88 2.84 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 119.369 -2.082 . . . . 0.0 113.203 -175.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.3 p90 -158.24 157.78 29.34 Favored Pre-proline 0 N--CA 1.477 0.882 0 N-CA-C 115.347 1.61 . . . . 0.0 115.347 -178.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -55.83 128.77 31.67 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.223 1.949 . . . . 0.0 108.214 169.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.69 -3.61 68.36 Favored Glycine 0 CA--C 1.531 1.086 0 CA-C-O 116.639 -2.201 . . . . 0.0 115.413 -176.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.493 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -53.94 -37.3 63.72 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 121.475 2.638 . . . . 0.0 110.841 170.702 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 20.5 mt -53.14 -28.99 28.71 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 127.144 2.178 . . . . 0.0 112.488 176.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.79 -32.62 70.78 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 118.427 0.558 . . . . 0.0 110.89 -179.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.82 -45.62 27.96 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.687 0.795 . . . . 0.0 112.092 174.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.493 ' CD2' HE22 ' A' ' 39' ' ' GLN . 4.8 m-70 -58.8 -32.66 69.54 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 175.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 16.0 mt -102.37 -26.86 13.13 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -173.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.41 1.79 66.1 Favored Glycine 0 CA--C 1.533 1.215 0 CA-C-N 119.503 1.047 . . . . 0.0 113.975 -170.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.9 mp -99.52 147.44 25.31 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.104 0.952 . . . . 0.0 109.663 177.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 70.4 p -59.23 151.95 21.87 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.305 1.442 . . . . 0.0 111.184 -169.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.14 -20.34 57.94 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.308 171.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.3 m -73.62 -55.29 6.48 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.232 -0.918 . . . . 0.0 110.805 169.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -53.08 -56.45 16.11 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.402 1.081 . . . . 0.0 110.898 178.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 69.3 t -65.96 -24.5 34.11 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 O-C-N 120.904 -1.122 . . . . 0.0 112.428 -177.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.7 m -71.05 -36.69 72.42 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 120.54 1.518 . . . . 0.0 113.657 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -52.99 -50.48 64.1 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.675 0.79 . . . . 0.0 110.4 169.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -63.84 -36.06 82.68 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.381 1.073 . . . . 0.0 113.688 178.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 21.3 mt -72.51 -31.56 65.44 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 117.841 -1.076 . . . . 0.0 113.533 174.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.89 -46.7 43.08 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.821 1.191 . . . . 0.0 112.876 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 4.0 t -78.9 -35.63 43.28 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-O 121.601 0.715 . . . . 0.0 112.093 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.6 tp -59.61 -38.44 81.29 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.738 1.215 . . . . 0.0 112.332 178.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 45.2 mtm105 -77.47 -30.0 52.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.372 1.069 . . . . 0.0 112.467 177.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.33 -40.39 5.76 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 124.59 1.091 . . . . 0.0 114.769 -173.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 69.9 m -71.6 -9.75 58.71 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 124.116 0.966 . . . . 0.0 111.828 171.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 91.17 20.76 37.67 Favored Glycine 0 C--N 1.344 0.976 0 C-N-CA 125.472 1.511 . . . . 0.0 115.851 168.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.3 mt -86.6 -23.09 25.87 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.622 1.711 . . . . 0.0 114.799 178.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.5 m -127.97 148.49 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 124.728 1.211 . . . . 0.0 111.214 169.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 25.6 t -137.45 148.96 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.383 1.473 . . . . 0.0 109.8 -178.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.97 160.88 30.06 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.262 1.425 . . . . 0.0 113.814 173.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.2 m -163.24 167.8 21.48 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.392 1.877 . . . . 0.0 108.426 173.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -101.68 121.19 41.58 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 165.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.27 -13.25 59.36 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -178.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 133.37 -26.01 3.57 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 125.762 1.648 . . . . 0.0 113.958 173.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 48.5 ttt-85 -132.62 -10.75 3.14 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.395 1.878 . . . . 0.0 112.737 172.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -148.79 160.05 43.57 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.892 2.077 . . . . 0.0 111.304 -177.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 23.4 m -82.91 145.0 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 O-C-N 121.44 -0.787 . . . . 0.0 109.757 168.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.1 ptt180 -131.2 165.62 22.93 Favored 'General case' 0 CA--C 1.518 -0.275 0 C-N-CA 124.769 1.228 . . . . 0.0 110.408 -172.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -107.65 148.64 29.1 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 163.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.436 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -147.67 156.97 43.32 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 123.397 0.679 . . . . 0.0 110.146 174.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tp -53.96 144.79 18.06 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 123.542 0.526 . . . . 0.0 110.172 170.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.97 -20.12 64.17 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 116.083 1.883 . . . . 0.0 116.083 -170.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -168.97 164.03 11.47 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.711 1.604 . . . . 0.0 112.367 173.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 50.7 m -51.49 -30.14 18.99 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.845 2.058 . . . . 0.0 112.574 168.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -52.82 -58.24 7.57 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 126.643 1.977 . . . . 0.0 112.334 171.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 19.1 mt -64.21 -44.19 92.7 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 177.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -56.94 -34.3 67.87 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 125.068 1.347 . . . . 0.0 111.444 -175.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.1 ttm-85 -74.22 -57.7 3.78 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 116.685 -1.626 . . . . 0.0 112.092 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.26 -22.91 64.73 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 122.103 2.229 . . . . 0.0 113.33 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 54.5 tp -71.64 -45.52 61.81 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.425 1.89 . . . . 0.0 110.69 168.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.53 -36.24 12.52 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 126.147 1.832 . . . . 0.0 115.088 -171.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -77.91 -5.51 51.32 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.34 1.456 . . . . 0.0 112.777 176.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 25.9 tp 60.79 89.46 0.07 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.657 2.383 . . . . 0.0 113.484 168.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.3 m -41.37 150.42 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 125.194 1.398 . . . . 0.0 112.4 176.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -72.0 2.9 4.94 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 -159.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.7 p -66.45 35.39 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 126.289 1.836 . . . . 0.0 114.221 174.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 61.08 20.01 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 126.396 1.879 . . . . 0.0 113.544 169.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 tt 94.93 106.96 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 129.337 3.055 . . . . 0.0 106.513 -167.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.79 89.5 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.97 0.908 . . . . 0.0 111.667 170.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.0 t -63.43 135.57 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 125.201 1.4 . . . . 0.0 110.266 171.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -62.57 6.26 0.1 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 127.547 2.339 . . . . 0.0 115.065 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.6 138.09 58.09 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 122.307 1.051 . . . . 0.0 110.612 176.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -92.92 153.6 18.69 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 113.438 -1.71 . . . . 0.0 107.595 164.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -161.16 136.17 5.55 Favored Pre-proline 0 N--CA 1.447 -0.575 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 174.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -60.59 165.34 11.64 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 121.331 1.354 . . . . 0.0 109.886 169.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 46.3 t . . . . . 0 CA--C 1.555 1.143 0 CA-C-O 122.647 1.213 . . . . 0.0 110.189 170.699 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 pp . . . . . 0 N--CA 1.468 0.466 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.93 -55.27 27.4 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.95 0.9 . . . . 0.0 109.982 169.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 24.5 ttm180 -60.07 -40.13 88.44 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 177.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -53.54 -59.27 4.81 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.451 1.1 . . . . 0.0 110.416 176.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . 0.436 ' HA3' ' HB2' ' A' ' 19' ' ' ALA . . . -73.26 -21.1 79.99 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-O 118.739 -1.034 . . . . 0.0 113.689 -177.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.83 -18.11 53.73 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 126.465 1.906 . . . . 0.0 114.179 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -123.83 -7.58 7.87 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 177.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 3.1 mt -87.56 -37.08 17.17 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 119.429 1.013 . . . . 0.0 110.911 167.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.6 77.45 5.67 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.647 1.179 . . . . 0.0 111.676 -177.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -163.78 139.16 4.97 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 125.219 1.408 . . . . 0.0 111.598 -171.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -51.46 -50.26 14.5 Favored 'Trans proline' 0 C--N 1.353 0.8 1 C-N-CA 125.677 4.251 . . . . 0.0 114.117 -172.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 45.7 m -91.83 -32.96 15.14 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 119.394 -0.336 . . . . 0.0 110.52 -172.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 74.1 mtm180 -68.74 -34.21 75.22 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 116.571 -1.68 . . . . 0.0 112.691 -177.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 45.9 t -55.13 -55.51 30.32 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 120.755 1.616 . . . . 0.0 110.637 168.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -48.07 -52.27 20.96 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.126 1.37 . . . . 0.0 112.47 172.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.5 mt -51.12 -58.83 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 CA-C-N 119.424 1.011 . . . . 0.0 111.234 174.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 93.4 mt -63.37 -41.84 98.82 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.222 1.009 . . . . 0.0 111.176 -169.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.7 p -75.98 -26.72 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.226 0.611 . . . . 0.0 112.399 178.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.61 -39.09 67.56 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 118.793 -0.622 . . . . 0.0 111.039 169.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.494 ' O ' HG13 ' B' ' 34' ' ' VAL . 2.1 tp -65.32 -26.62 68.13 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 -176.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 7.8 mt -45.95 -26.51 0.72 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 125.959 1.704 . . . . 0.0 112.205 168.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -113.64 -31.65 6.42 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 127.658 2.383 . . . . 0.0 111.522 167.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -82.51 15.57 29.26 Favored Glycine 0 C--N 1.335 0.477 0 C-N-CA 129.775 3.559 . . . . 0.0 115.204 -166.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . 0.494 HG13 ' O ' ' B' ' 30' ' ' LEU . 26.1 m -60.15 28.75 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.038 0 C-N-CA 126.111 1.765 . . . . 0.0 115.565 167.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.6 -73.11 0.46 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.434 1.494 . . . . 0.0 111.528 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -159.07 157.35 27.86 Favored Pre-proline 0 N--CA 1.474 0.726 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -169.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -57.29 121.27 9.76 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.628 2.218 . . . . 0.0 109.046 173.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.91 -5.66 83.2 Favored Glycine 0 CA--C 1.531 1.071 0 CA-C-O 117.572 -1.682 . . . . 0.0 115.024 -175.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . 0.536 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -57.67 -35.11 70.13 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 120.942 2.371 . . . . 0.0 111.402 172.114 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 23.0 mt -56.96 -25.33 57.69 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 125.216 1.406 . . . . 0.0 111.928 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.85 -32.75 73.12 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 121.883 -0.51 . . . . 0.0 111.461 -174.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.11 -49.12 18.26 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.486 0.714 . . . . 0.0 111.543 172.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . 0.536 ' CD2' HE22 ' B' ' 39' ' ' GLN . 2.8 m-70 -56.18 -32.92 64.78 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.217 1.191 . . . . 0.0 114.217 178.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 14.1 mt -104.02 -23.87 13.28 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.624 1.17 . . . . 0.0 113.118 -173.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.18 -6.67 49.24 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.533 1.063 . . . . 0.0 114.1 -171.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 10.6 mp -93.19 156.39 16.87 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.44 1.096 . . . . 0.0 109.539 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 71.2 p -71.91 154.7 41.05 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 122.448 1.118 . . . . 0.0 111.745 -170.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 -56.68 -25.34 53.68 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.099 169.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 15.3 m -71.82 -58.28 3.6 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.657 1.183 . . . . 0.0 110.633 169.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -53.27 -58.12 8.17 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.831 1.252 . . . . 0.0 111.676 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 88.7 t -63.33 -22.09 29.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 121.363 -0.836 . . . . 0.0 111.575 -175.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 50.1 m -68.69 -36.32 78.33 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 119.87 1.213 . . . . 0.0 113.93 178.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -56.72 -47.14 80.63 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.98 0.809 . . . . 0.0 111.61 169.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -63.69 -32.24 73.66 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.092 0.957 . . . . 0.0 112.621 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 43.4 mt -75.87 -32.92 59.93 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.084 1.354 . . . . 0.0 113.628 172.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 19.4 m -54.61 -39.02 67.47 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 120.292 1.405 . . . . 0.0 113.323 177.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 42.1 t -69.18 -47.86 63.76 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.524 1.056 . . . . 0.0 112.132 171.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.3 tp -58.25 -37.82 75.67 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.359 1.464 . . . . 0.0 112.0 -171.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 34.3 mtm105 -83.12 -7.03 59.69 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.842 1.657 . . . . 0.0 113.774 178.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -106.6 -37.95 2.32 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 125.558 1.551 . . . . 0.0 114.414 177.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 22.5 m -73.75 -13.54 60.97 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 124.928 1.291 . . . . 0.0 112.288 172.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.33 20.14 42.89 Favored Glycine 0 C--N 1.341 0.837 0 CA-C-O 118.355 -1.247 . . . . 0.0 114.572 172.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.05 -24.09 30.6 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 119.626 1.713 . . . . 0.0 113.825 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 3.5 m -127.72 147.28 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 124.336 1.054 . . . . 0.0 113.003 171.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 24.2 t -130.0 143.05 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.373 1.869 . . . . 0.0 110.808 -176.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.02 152.34 27.98 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.787 1.635 . . . . 0.0 112.936 174.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.9 m -161.02 172.26 17.2 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.393 1.477 . . . . 0.0 109.075 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -100.99 126.05 47.63 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 165.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.34 -14.38 59.02 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 177.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 136.12 -26.77 3.08 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 126.201 1.858 . . . . 0.0 114.0 175.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 51.5 ttt-85 -136.42 -6.9 1.99 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.809 2.044 . . . . 0.0 112.977 174.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -150.36 160.23 43.88 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.17 2.188 . . . . 0.0 110.749 -178.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 33.6 m -82.4 148.02 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 O-C-N 121.509 -0.745 . . . . 0.0 110.565 169.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 3.0 ptt180 -132.52 167.99 19.02 Favored 'General case' 0 C--O 1.231 0.116 0 C-N-CA 125.43 1.492 . . . . 0.0 110.745 -171.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -112.16 160.58 17.44 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 164.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -160.28 150.61 18.37 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 120.742 -1.224 . . . . 0.0 111.257 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -49.94 129.65 20.71 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 169.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.23 0.41 2.8 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 -168.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -179.61 161.74 1.05 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 128.123 2.569 . . . . 0.0 110.644 169.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 43.4 m -48.35 -29.99 4.49 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.573 1.549 . . . . 0.0 111.797 168.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -49.08 -53.78 18.96 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 126.226 1.811 . . . . 0.0 113.526 171.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 13.3 mt -79.45 -41.41 27.62 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.919 -0.562 . . . . 0.0 109.818 -175.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.9 -36.11 59.03 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.033 0.533 . . . . 0.0 111.952 170.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 34.5 ttm-85 -75.93 -61.04 2.06 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-O 116.719 -1.61 . . . . 0.0 112.836 174.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.04 -20.74 66.28 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 122.5 2.409 . . . . 0.0 113.384 -176.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.15 -53.54 8.14 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.672 -0.643 . . . . 0.0 109.28 166.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.98 -28.36 70.65 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.374 1.464 . . . . 0.0 115.574 -171.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -78.38 -6.76 56.12 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.681 1.24 . . . . 0.0 112.051 169.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 30.6 tp 60.67 86.36 0.1 Allowed 'General case' 0 C--N 1.345 0.394 0 C-N-CA 127.623 2.369 . . . . 0.0 113.565 167.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.2 m -43.36 147.59 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 CA-C-O 122.667 1.222 . . . . 0.0 112.986 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . 0.481 ' C ' ' H ' ' B' ' 93' ' ' VAL . 20.1 mm-40 -68.54 6.62 0.78 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 117.021 2.23 . . . . 0.0 117.021 -163.054 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 6.1 p -66.28 32.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 126.476 1.911 . . . . 0.0 113.243 169.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . 0.481 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.4 OUTLIER 63.16 11.63 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 128.6 2.76 . . . . 0.0 114.359 171.499 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.6 tt 102.05 107.62 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 130.519 3.528 . . . . 0.0 105.35 -167.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.573 0 C-N-CA 124.617 1.167 . . . . 0.0 111.812 174.465 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.557 HD23 ' H ' ' A' ' 12' ' ' ALA . 1.1 pt? . . . . . 0 N--CA 1.475 0.797 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.557 ' H ' HD23 ' A' ' 11' ' ' LEU . . . -67.25 -18.72 65.34 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.661 1.584 . . . . 0.0 113.468 177.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.473 HH11 ' HG2' ' A' ' 13' ' ' ARG . 0.2 OUTLIER -86.11 -42.81 13.58 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.052 0.842 . . . . 0.0 109.421 167.738 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.55 -46.41 82.94 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.623 1.569 . . . . 0.0 112.25 -171.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.96 -18.39 68.7 Favored Glycine 0 CA--C 1.535 1.333 0 O-C-N 121.182 -0.949 . . . . 0.0 113.073 172.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 81.6 mtp180 -99.16 29.84 3.72 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 127.546 2.339 . . . . 0.0 111.314 170.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.93 -35.47 0.57 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.463 1.905 . . . . 0.0 111.898 169.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mt -95.78 -39.38 9.88 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 178.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -96.26 54.35 1.41 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.656 1.116 . . . . 0.0 109.54 170.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -132.42 138.28 31.82 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 126.933 2.093 . . . . 0.0 108.202 -168.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -52.61 -98.35 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.809 1 C-N-CA 126.66 4.907 . . . . 0.0 115.789 -164.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.95 -27.82 63.76 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 125.571 1.548 . . . . 0.0 111.799 175.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.39 -36.04 63.5 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -174.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 14.1 t -65.85 -38.0 87.7 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.519 -1.363 . . . . 0.0 109.921 167.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -57.52 -38.55 74.84 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.056 0.942 . . . . 0.0 112.964 169.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.9 mm -62.11 -49.52 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 O-C-N 120.717 -1.24 . . . . 0.0 110.997 170.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.4 mt -58.61 -48.46 80.9 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.246 0.475 . . . . 0.0 112.157 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.2 p -68.51 -20.39 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 118.986 0.812 . . . . 0.0 112.782 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.51 -16.84 60.24 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.351 1.061 . . . . 0.0 113.069 171.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.432 HD23 ' CG1' ' A' ' 64' ' ' VAL . 0.0 OUTLIER -93.39 -13.55 27.91 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 170.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.92 -20.92 64.3 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.211 163.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -116.99 -60.39 1.85 Allowed 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 127.456 2.302 . . . . 0.0 115.205 -177.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.37 -83.05 0.43 Allowed Glycine 0 C--N 1.343 0.948 0 C-N-CA 124.989 1.281 . . . . 0.0 114.313 -165.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.8 m 49.58 30.96 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 125.288 1.435 . . . . 0.0 113.768 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.6 m -77.81 -66.52 0.83 Allowed 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 178.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -140.88 156.63 68.57 Favored Pre-proline 0 C--O 1.238 0.465 0 CA-C-O 118.665 -0.683 . . . . 0.0 112.124 -169.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -59.13 115.37 2.52 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 122.509 2.139 . . . . 0.0 109.128 169.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 95.93 -0.88 62.84 Favored Glycine 0 CA--C 1.531 1.084 0 CA-C-O 117.552 -1.693 . . . . 0.0 115.93 -178.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.23 -30.47 71.53 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.949 2.374 . . . . 0.0 112.317 172.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.74 HD12 ' H ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -56.5 -22.65 34.11 Favored 'General case' 0 C--O 1.222 -0.346 0 C-N-CA 124.431 1.093 . . . . 0.0 111.61 177.833 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.25 -36.99 79.03 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.482 0.713 . . . . 0.0 112.322 176.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.45 -38.06 74.43 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.372 0.533 . . . . 0.0 111.436 175.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -64.57 -38.12 89.92 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 175.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 32.9 mt -99.69 -14.67 18.82 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -172.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 64.8 25.36 70.49 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-O 118.717 -1.046 . . . . 0.0 112.281 -169.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 67.4 mt -126.95 134.53 50.38 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.266 1.027 . . . . 0.0 112.223 -176.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.3 p -50.18 156.81 0.75 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.101 1.36 . . . . 0.0 114.311 -168.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.6 ttm180 -53.24 -26.16 16.96 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.07 -1.423 . . . . 0.0 112.049 169.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.6 m -80.04 -47.23 15.2 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.063 -1.023 . . . . 0.0 111.778 175.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -60.07 -52.61 64.62 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.481 1.112 . . . . 0.0 110.266 176.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.4 t -58.84 -38.92 75.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 121.018 -1.051 . . . . 0.0 111.955 176.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 74.9 m -64.69 -39.72 94.15 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.916 1.234 . . . . 0.0 113.31 174.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -56.51 -52.55 64.32 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.676 0.79 . . . . 0.0 110.771 174.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 20.0 m80 -61.22 -39.77 91.53 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 48.7 mt -68.09 -25.85 65.53 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.171 -0.919 . . . . 0.0 112.968 175.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.4 t -59.42 -56.82 17.23 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 120.705 1.593 . . . . 0.0 113.637 -168.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 30.8 t -67.95 -28.78 67.76 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 122.209 -0.307 . . . . 0.0 111.764 172.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.4 tp -60.78 -35.42 76.4 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.915 0.886 . . . . 0.0 111.647 177.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 87.0 mtm-85 -74.83 -28.98 60.91 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.188 0.995 . . . . 0.0 112.026 172.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.39 -50.31 6.76 Favored Glycine 0 N--CA 1.472 1.072 0 CA-C-N 119.357 0.981 . . . . 0.0 113.129 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 18.2 m -67.53 -2.01 5.89 Favored 'General case' 0 CA--C 1.562 1.423 0 C-N-CA 126.826 2.05 . . . . 0.0 111.444 168.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.32 -0.62 16.23 Favored Glycine 0 C--N 1.343 0.959 0 C-N-CA 126.884 2.183 . . . . 0.0 115.191 173.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 77.5 mt -53.27 -25.67 15.39 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.13 1.772 . . . . 0.0 112.667 179.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.432 ' CG1' HD23 ' A' ' 30' ' ' LEU . 3.3 m -123.91 153.31 29.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 126.718 2.007 . . . . 0.0 109.641 164.045 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -142.32 155.28 18.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 C-N-CA 126.77 2.028 . . . . 0.0 109.891 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.6 151.93 28.8 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 122.706 1.241 . . . . 0.0 111.009 171.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.624 HG22 ' H ' ' A' ' 68' ' ' TYR . 8.0 m -158.11 -170.85 3.28 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 127.008 2.123 . . . . 0.0 105.959 173.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.624 ' H ' HG22 ' A' ' 67' ' ' THR . 47.6 m-85 -120.91 157.99 28.66 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 119.773 1.17 . . . . 0.0 113.418 174.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -110.49 -151.45 0.48 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 126.641 1.976 . . . . 0.0 109.414 167.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.48 -12.49 56.22 Favored Glycine 0 CA--C 1.539 1.562 0 O-C-N 120.027 -1.671 . . . . 0.0 116.332 -172.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -164.54 -28.71 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.644 1.577 . . . . 0.0 113.307 173.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -99.48 170.64 8.47 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.801 1.64 . . . . 0.0 110.405 -177.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 26.0 m -80.81 160.87 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 O-C-N 121.92 -0.488 . . . . 0.0 111.54 168.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -126.61 171.78 10.83 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.394 1.877 . . . . 0.0 110.455 175.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -123.87 121.96 36.72 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.214 1.406 . . . . 0.0 107.963 167.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.13 167.53 17.44 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.866 1.266 . . . . 0.0 111.552 177.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 69.7 mt -60.61 156.7 15.98 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.573 0.749 . . . . 0.0 111.765 172.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.22 -51.36 68.35 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 125.948 1.699 . . . . 0.0 113.846 179.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -164.27 173.55 12.18 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 123.683 1.706 . . . . 0.0 114.258 -167.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 43.2 t -47.18 -42.42 19.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 113.168 -1.833 . . . . 0.0 113.308 170.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 55.9 m-70 -63.97 -42.47 97.25 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 116.938 -1.506 . . . . 0.0 113.478 -178.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 10.2 mt -71.9 -45.14 62.3 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 121.188 1.813 . . . . 0.0 109.846 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.99 -35.65 59.44 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.814 0.846 . . . . 0.0 111.782 175.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.401 ' HE ' ' CD ' ' A' ' 88' ' ' GLU . 0.4 OUTLIER -70.86 -67.27 0.52 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 128.398 2.679 . . . . 0.0 112.661 175.532 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.74 -30.25 70.43 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -173.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.04 -39.57 60.92 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.723 -0.611 . . . . 0.0 109.642 169.394 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -57.61 -45.06 93.64 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 125.897 1.713 . . . . 0.0 114.347 -178.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.401 ' CD ' ' HE ' ' A' ' 84' ' ' ARG . 2.0 pt-20 -87.84 3.76 47.09 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 174.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 39.0 tp 73.5 143.2 0.07 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 129.3 3.04 . . . . 0.0 111.64 177.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 31.2 m -38.25 -20.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 128.992 2.917 . . . . 0.0 116.367 176.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 86.82 -35.83 0.03 OUTLIER 'General case' 0 C--O 1.218 -0.594 0 C-N-CA 126.232 1.813 . . . . 0.0 108.963 161.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.521 HG21 ' CD2' ' B' ' 14' ' ' LEU . 8.7 p -62.62 36.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 128.915 2.886 . . . . 0.0 114.677 168.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.5 t 79.07 -25.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 128.7 2.8 . . . . 0.0 113.027 170.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 tt 110.59 99.05 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.636 1 C-N-CA 132.57 4.348 . . . . 0.0 104.582 -169.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.99 133.84 56.48 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 119.309 -0.377 . . . . 0.0 110.968 -178.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.1 t -74.76 137.14 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -166.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -60.68 -23.04 64.53 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.26 1.424 . . . . 0.0 114.72 173.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 59.0 p -64.82 117.08 7.01 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.382 1.073 . . . . 0.0 109.098 176.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -69.46 12.77 0.16 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.083 2.153 . . . . 0.0 114.447 -175.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 -74.16 159.29 84.21 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 125.674 1.59 . . . . 0.0 113.424 -167.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.85 135.92 43.23 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.376 2.718 . . . . 0.0 110.965 169.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 20.5 p . . . . . 0 CA--C 1.544 0.74 0 C-N-CA 123.833 0.853 . . . . 0.0 110.816 168.424 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.551 HD23 ' H ' ' B' ' 12' ' ' ALA . 1.2 pt? . . . . . 0 N--CA 1.468 0.468 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.551 ' H ' HD23 ' B' ' 11' ' ' LEU . . . -63.29 -21.9 66.54 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.541 1.536 . . . . 0.0 114.202 176.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . 0.534 HH11 ' HG2' ' B' ' 13' ' ' ARG . 1.3 mmt-85 -84.03 -41.11 17.58 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 119.607 1.094 . . . . 0.0 111.723 170.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.521 ' CD2' HG21 ' A' ' 92' ' ' VAL . 3.1 tm? -57.98 -52.73 64.31 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.709 1.604 . . . . 0.0 111.114 177.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.39 -22.48 69.45 Favored Glycine 0 CA--C 1.533 1.177 0 O-C-N 121.884 -0.51 . . . . 0.0 112.715 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 72.3 mtp180 -87.47 14.05 8.89 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 126.212 1.805 . . . . 0.0 112.508 173.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -125.19 -37.58 2.39 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.845 1.258 . . . . 0.0 112.354 168.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 24.5 mt -88.88 -25.75 21.97 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.541 -1.218 . . . . 0.0 113.078 178.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -115.9 55.16 0.8 Allowed 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 120.977 1.717 . . . . 0.0 110.705 168.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -133.43 143.9 49.99 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 127.587 2.355 . . . . 0.0 106.678 -174.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -57.54 -98.98 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.945 1 C-N-CA 125.698 4.266 . . . . 0.0 115.7 -163.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 1.3 p -53.08 -32.92 49.69 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.515 1.926 . . . . 0.0 112.42 172.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.84 -43.85 62.12 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.687 0.795 . . . . 0.0 112.906 -170.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 46.8 t -63.38 -39.26 94.04 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.193 0.906 . . . . 0.0 109.455 168.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -55.92 -33.24 64.5 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 120.582 -1.324 . . . . 0.0 113.973 171.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . 0.411 HG23 HD13 ' B' ' 40' ' ' LEU . 1.6 mm -62.06 -48.76 86.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 CA-C-N 120.23 1.377 . . . . 0.0 110.061 169.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 89.6 mt -58.56 -45.01 89.86 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.957 0.799 . . . . 0.0 112.066 176.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . 0.678 HG22 HD21 ' B' ' 86' ' ' LEU . 51.8 t -61.38 -47.25 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 126.424 1.889 . . . . 0.0 110.847 179.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.52 -36.21 63.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.89 0.876 . . . . 0.0 112.298 -177.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 16.6 tp -66.17 -35.35 80.24 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 117.486 -1.245 . . . . 0.0 112.103 -178.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -37.14 -45.71 0.64 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 129.492 3.117 . . . . 0.0 113.91 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -105.34 -16.96 14.6 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.065 1.746 . . . . 0.0 113.165 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.28 -71.42 1.23 Allowed Glycine 0 C--N 1.341 0.85 0 C-N-CA 124.658 1.123 . . . . 0.0 112.329 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . 0.454 HG12 ' HA ' ' B' ' 76' ' ' ALA . 34.6 m 33.45 36.43 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 -170.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.93 -76.27 0.3 Allowed 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.357 -0.84 . . . . 0.0 111.553 -177.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -145.74 158.15 50.11 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-O 118.648 -0.692 . . . . 0.0 112.82 -168.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -58.62 123.14 12.91 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.919 2.413 . . . . 0.0 110.162 172.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 88.19 -3.83 85.52 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 117.575 -1.68 . . . . 0.0 115.449 -174.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -32.82 71.08 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 120.493 2.146 . . . . 0.0 111.87 174.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.411 HD13 HG23 ' B' ' 26' ' ' ILE . 2.1 mt -59.52 -15.74 20.05 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 123.716 0.806 . . . . 0.0 112.246 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.9 -41.76 87.98 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.57 0.623 . . . . 0.0 111.159 175.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -75.57 -30.35 59.63 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.512 0.725 . . . . 0.0 112.418 176.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -69.01 -33.97 74.5 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 171.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 23.9 mt -106.59 -14.57 15.01 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -170.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.33 16.95 69.85 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-N 119.136 0.88 . . . . 0.0 113.008 -169.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 36.7 mt -117.65 139.63 50.74 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 118.506 1.153 . . . . 0.0 111.6 -175.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.2 p -59.67 161.68 5.92 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.388 0.675 . . . . 0.0 111.933 -172.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 20.7 ttm180 -58.61 -29.08 66.2 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 122.056 -0.403 . . . . 0.0 111.938 175.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 20.3 m -69.81 -46.07 66.5 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.386 0.994 . . . . 0.0 111.622 175.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -61.94 -55.19 32.02 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 122.821 0.449 . . . . 0.0 110.128 173.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.8 t -56.26 -40.73 67.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 121.002 -1.061 . . . . 0.0 112.976 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 49.7 m -66.17 -37.93 86.83 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.663 1.12 . . . . 0.0 112.865 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -55.54 -49.97 71.25 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.93 0.786 . . . . 0.0 110.89 172.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 20.6 m80 -64.17 -37.44 87.45 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 26.1 mt -73.27 -27.33 61.5 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 117.599 -1.191 . . . . 0.0 113.441 175.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.1 t -50.65 -63.71 1.04 Allowed 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.293 0.951 . . . . 0.0 112.608 -169.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.7 t -66.76 -33.79 76.41 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.541 0.736 . . . . 0.0 111.66 174.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 3.6 tp -53.34 -33.92 55.46 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.29 1.036 . . . . 0.0 112.47 178.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 79.9 mtm-85 -83.16 -21.54 33.51 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 173.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -80.73 -47.43 6.71 Favored Glycine 0 N--CA 1.475 1.273 0 CA-C-N 120.228 1.376 . . . . 0.0 111.825 176.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 3.3 m -62.93 -11.29 17.6 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.961 2.104 . . . . 0.0 112.388 168.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 59.65 28.09 64.83 Favored Glycine 0 C--N 1.345 1.083 0 C-N-CA 125.818 1.675 . . . . 0.0 113.477 -178.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 93.0 mt -73.15 -24.73 60.62 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 117.918 0.859 . . . . 0.0 111.167 168.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 4.5 m -130.28 159.68 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 C-N-CA 126.108 1.763 . . . . 0.0 110.284 168.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -145.5 155.44 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 126.016 1.726 . . . . 0.0 110.266 -172.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.28 150.77 24.55 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.073 1.349 . . . . 0.0 111.53 172.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 10.6 m -158.99 168.83 25.74 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 176.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -102.67 142.62 33.51 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.349 0.977 . . . . 0.0 111.197 168.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.261 1.6 pp20? -99.52 -155.74 0.52 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.35 1.06 . . . . 0.0 109.435 166.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -67.09 -14.95 64.49 Favored Glycine 0 CA--C 1.535 1.341 0 O-C-N 120.176 -1.577 . . . . 0.0 115.46 -171.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -159.19 -20.85 0.07 Allowed 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.95 1.375 . . . . 0.0 114.433 174.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -111.93 162.36 15.41 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.975 2.11 . . . . 0.0 110.994 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 17.6 m -82.1 152.4 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 O-C-N 121.468 -0.77 . . . . 0.0 109.377 167.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -129.15 168.67 15.8 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 122.594 1.188 . . . . 0.0 109.643 -178.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -113.16 148.2 35.86 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 164.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . 0.454 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -149.55 157.8 43.6 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.307 1.043 . . . . 0.0 110.285 176.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -53.14 151.83 4.73 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.988 0.915 . . . . 0.0 110.651 168.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -49.66 -52.35 31.47 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.535 1.134 . . . . 0.0 113.775 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.35 179.81 3.76 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 122.818 1.294 . . . . 0.0 113.896 -167.115 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 24.5 t -49.3 -43.96 43.76 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.054 -1.43 . . . . 0.0 113.25 170.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -62.06 -48.42 80.31 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 117.664 -1.16 . . . . 0.0 112.926 -178.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 15.8 mt -68.72 -38.89 80.54 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 120.615 1.552 . . . . 0.0 109.954 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.35 -32.24 73.61 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.535 0.607 . . . . 0.0 110.994 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -69.56 -70.13 0.3 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 128.462 2.705 . . . . 0.0 110.936 171.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.72 -33.44 61.08 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 120.803 1.638 . . . . 0.0 114.555 -178.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.678 HD21 HG22 ' B' ' 28' ' ' VAL . 1.4 tt -77.65 -39.93 43.41 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 121.322 -0.861 . . . . 0.0 111.123 173.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.12 -46.77 90.23 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.634 1.588 . . . . 0.0 114.41 -173.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 12.8 pm0 -84.08 -0.49 52.05 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 119.255 1.528 . . . . 0.0 113.499 168.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 33.8 tp 72.85 135.35 0.05 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 129.563 3.145 . . . . 0.0 111.504 177.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 97.5 t -62.79 8.62 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 129.225 3.01 . . . . 0.0 113.716 -176.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 93.4 -35.85 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.611 -1.306 . . . . 0.0 110.82 129.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 7.7 p -56.48 35.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.043 1 C-N-CA 132.628 4.371 . . . . 0.0 115.626 171.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER 67.15 6.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.876 0 C-N-CA 126.698 1.999 . . . . 0.0 112.836 176.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 tt 78.54 105.4 0.07 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.762 2.425 . . . . 0.0 107.631 -168.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.007 0 O-C-N 121.563 -0.711 . . . . 0.0 110.336 174.779 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.9 mt . . . . . 0 N--CA 1.472 0.65 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.45 -41.62 98.63 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -177.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -53.91 -51.05 64.98 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.668 1.187 . . . . 0.0 110.633 172.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.73 -47.18 73.11 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.759 1.223 . . . . 0.0 113.001 -178.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.61 -40.95 94.23 Favored Glycine 0 N--CA 1.473 1.133 0 CA-C-N 120.301 1.41 . . . . 0.0 111.303 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -40.4 92.18 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.15 1.38 . . . . 0.0 110.763 172.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.6 -3.18 4.21 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.725 1.379 . . . . 0.0 114.725 175.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.9 mp -115.29 -35.63 4.59 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.836 1.254 . . . . 0.0 111.836 166.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.91 98.93 11.89 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 128.113 2.565 . . . . 0.0 111.929 -176.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.66 172.13 5.99 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 127.421 2.288 . . . . 0.0 108.971 -169.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -74.27 -119.71 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 124.927 3.751 . . . . 0.0 110.482 172.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 68.4 m -50.15 -28.96 8.19 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.732 2.013 . . . . 0.0 113.227 176.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.94 -24.93 64.33 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 120.093 1.315 . . . . 0.0 113.479 174.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 30.0 t -74.23 -45.0 50.87 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.185 -0.947 . . . . 0.0 109.251 166.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.44 -44.75 76.61 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.498 -0.751 . . . . 0.0 112.726 173.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.2 mm -50.06 -51.24 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 119.984 1.265 . . . . 0.0 110.714 169.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 25.5 mt -59.67 -45.34 92.36 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 117.249 -1.358 . . . . 0.0 112.87 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.5 m -66.55 -28.05 42.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 CA-C-N 121.267 1.849 . . . . 0.0 111.862 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.23 -20.0 45.62 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.057 1.343 . . . . 0.0 112.932 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 77.2 mt -63.02 -49.45 74.6 Favored 'General case' 0 N--CA 1.469 0.489 0 O-C-N 121.075 -1.015 . . . . 0.0 111.017 170.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -46.41 -53.48 10.97 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 129.304 3.042 . . . . 0.0 112.56 -169.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -105.72 22.79 14.95 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 127.444 2.298 . . . . 0.0 111.272 177.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.68 -84.7 0.96 Allowed Glycine 0 C--N 1.34 0.758 0 C-N-CA 126.456 1.979 . . . . 0.0 112.633 -178.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.474 HG12 ' HA ' ' A' ' 76' ' ' ALA . 23.7 m 30.71 39.2 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 127.245 2.218 . . . . 0.0 116.557 -171.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 34.6 m -89.52 -76.72 0.41 Allowed 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.236 -0.915 . . . . 0.0 112.718 -177.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -137.51 164.24 42.94 Favored Pre-proline 0 CA--C 1.546 0.813 0 CA-C-O 118.454 -0.784 . . . . 0.0 111.515 -174.28 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -66.3 -20.23 55.54 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.583 2.188 . . . . 0.0 114.379 -167.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.55 8.24 43.57 Favored Glycine 0 CA--C 1.535 1.302 0 CA-C-O 118.388 -1.229 . . . . 0.0 115.028 171.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -28.97 67.25 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 120.189 1.995 . . . . 0.0 113.899 -170.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.74 -18.38 59.52 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.359 0.664 . . . . 0.0 111.723 -177.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.52 -32.96 71.96 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.133 0.973 . . . . 0.0 112.249 174.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.5 -41.49 46.8 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.209 0.604 . . . . 0.0 111.478 176.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -63.63 -40.13 96.1 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 175.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 28.6 mt -92.62 -22.83 19.25 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -174.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.81 8.72 82.54 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 123.961 0.791 . . . . 0.0 112.644 -169.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 86.3 mt -103.73 152.01 22.34 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.305 1.442 . . . . 0.0 110.919 -171.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.5 p -63.94 154.53 33.66 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.543 0.737 . . . . 0.0 111.442 -171.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -56.88 -31.36 64.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 176.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.9 m -69.42 -49.69 52.8 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 123.883 0.873 . . . . 0.0 111.473 172.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -63.32 -37.11 86.0 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 119.133 0.879 . . . . 0.0 113.099 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.3 t -63.64 -50.78 76.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 C-N-CA 123.907 0.883 . . . . 0.0 111.381 169.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.3 m -63.48 -35.65 81.14 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 119.225 0.921 . . . . 0.0 113.212 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 43.8 m-20 -49.21 -37.15 21.93 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 125.726 1.611 . . . . 0.0 111.998 170.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 53.1 m-70 -100.58 2.99 42.32 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 115.505 1.668 . . . . 0.0 115.505 176.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 87.4 mt -92.07 -31.65 15.46 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.807 1.185 . . . . 0.0 111.754 165.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.8 t -45.98 -59.27 2.94 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -170.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 10.6 t -76.45 -21.08 56.37 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.6 tp -61.18 -36.36 79.65 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.613 1.165 . . . . 0.0 110.931 177.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 55.6 mtm180 -79.94 -20.29 46.0 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.147 1.379 . . . . 0.0 112.41 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.8 -41.39 4.7 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.984 1.278 . . . . 0.0 114.227 -177.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 58.5 m -74.8 -3.48 31.99 Favored 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 124.615 1.166 . . . . 0.0 112.305 170.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 92.04 -4.03 77.6 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 126.008 1.766 . . . . 0.0 116.312 169.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 78.4 mt -64.25 -28.99 70.11 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 120.582 2.191 . . . . 0.0 114.77 -173.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -122.12 132.45 70.97 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.406 0 C-N-CA 124.629 1.172 . . . . 0.0 110.455 175.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.8 t -120.66 133.23 68.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 C-N-CA 125.828 1.651 . . . . 0.0 107.971 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.98 144.5 50.47 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 122.953 1.359 . . . . 0.0 112.16 172.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 m -156.98 157.7 35.23 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 126.47 1.908 . . . . 0.0 106.405 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -91.83 135.33 34.0 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.929 1.241 . . . . 0.0 112.458 176.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.69 -11.95 59.83 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.156 0.582 . . . . 0.0 110.773 164.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 126.68 -44.45 1.24 Allowed Glycine 0 C--N 1.346 1.09 0 C-N-CA 126.831 2.158 . . . . 0.0 112.859 169.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.0 mtp-105 -92.6 -22.11 19.67 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.85 2.86 . . . . 0.0 111.502 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -156.66 168.48 27.29 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 127.525 2.33 . . . . 0.0 109.087 -169.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 33.3 m -85.15 158.08 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 123.436 0.694 . . . . 0.0 110.828 168.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -129.57 162.39 28.33 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 128.518 2.727 . . . . 0.0 109.0 172.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -108.06 110.95 22.77 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 168.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.474 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -109.88 145.98 35.9 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.901 0.88 . . . . 0.0 110.399 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.6 mt -56.11 145.34 26.21 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 123.17 0.294 . . . . 0.0 110.208 169.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.2 -32.77 73.22 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -167.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -155.82 159.81 39.71 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.639 1.976 . . . . 0.0 111.033 168.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.2 p -45.27 -30.47 1.25 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 128.534 2.733 . . . . 0.0 114.176 168.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -54.41 -45.97 73.07 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 125.01 1.324 . . . . 0.0 112.652 172.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 11.2 mt -74.08 -45.36 49.81 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 118.527 -0.749 . . . . 0.0 109.645 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.97 -31.53 60.81 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.157 0.983 . . . . 0.0 112.459 175.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.5 mtt-85 -72.44 -64.03 1.03 Allowed 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 125.194 1.398 . . . . 0.0 113.379 174.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.56 -12.23 59.9 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 120.429 1.468 . . . . 0.0 112.592 -176.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 60.2 tp -75.78 -53.27 8.76 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.245 1.818 . . . . 0.0 110.155 164.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.22 -41.15 8.13 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 128.183 2.802 . . . . 0.0 117.947 -168.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.47 -22.39 66.86 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.105 1.453 . . . . 0.0 111.274 169.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 35.6 tp 68.94 128.48 0.03 OUTLIER 'General case' 0 C--N 1.344 0.363 0 C-N-CA 129.657 3.183 . . . . 0.0 114.223 165.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.492 HG23 HG12 ' A' ' 92' ' ' VAL . 3.6 m -53.19 140.86 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-O 122.566 1.174 . . . . 0.0 109.849 174.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -74.78 -4.95 40.69 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -162.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.492 HG12 HG23 ' A' ' 90' ' ' VAL . 2.4 p -62.31 23.89 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 C-N-CA 127.585 2.354 . . . . 0.0 115.722 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.7 t 73.85 8.51 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 C-N-CA 126.7 2.0 . . . . 0.0 112.23 167.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 tt 82.56 93.52 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 128.676 2.79 . . . . 0.0 108.609 -170.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.77 160.29 32.87 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.595 0.758 . . . . 0.0 112.616 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 58.4 t -65.29 144.94 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 124.648 1.179 . . . . 0.0 111.914 173.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -66.28 49.53 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 127.22 2.208 . . . . 0.0 114.773 169.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.8 p -122.49 165.39 16.45 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.853 1.661 . . . . 0.0 112.422 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -118.59 138.38 52.61 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 112.906 -1.952 . . . . 0.0 106.366 163.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 70.0 mm-40 -155.53 150.64 20.89 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 127.581 2.352 . . . . 0.0 107.476 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.47 149.33 84.57 Favored 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 122.481 2.12 . . . . 0.0 116.025 -167.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 34.5 t . . . . . 0 CA--C 1.553 1.077 0 C-N-CA 127.29 2.236 . . . . 0.0 108.475 175.015 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 12.1 mt . . . . . 0 N--CA 1.472 0.629 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.02 -48.35 76.66 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.98 0.912 . . . . 0.0 111.901 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 -51.35 -50.06 60.23 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.022 1.329 . . . . 0.0 110.996 177.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -65.34 -52.59 52.82 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.395 1.078 . . . . 0.0 111.955 -175.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.81 -29.73 73.94 Favored Glycine 0 CA--C 1.527 0.823 0 CA-C-O 119.098 -0.834 . . . . 0.0 112.806 -178.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.73 -37.65 73.49 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 118.495 1.148 . . . . 0.0 110.758 174.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.31 -29.36 70.7 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 118.174 -0.917 . . . . 0.0 112.749 176.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 mp -93.0 -34.69 13.63 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 175.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -90.77 92.02 8.62 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.723 1.209 . . . . 0.0 110.606 -178.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -169.11 141.12 2.07 Favored Pre-proline 0 N--CA 1.47 0.575 0 C-N-CA 127.487 2.315 . . . . 0.0 107.361 -169.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . 0.414 ' HG2' ' H ' ' B' ' 22' ' ' THR . 58.8 Cg_endo -45.74 -82.07 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.848 1 C-N-CA 125.475 4.117 . . . . 0.0 113.272 -167.647 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.43 ' HB ' ' CD2' ' B' ' 54' ' ' HIS . 29.5 m -85.32 -22.39 28.53 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.777 1.231 . . . . 0.0 111.179 -173.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.47 ' HG2' HD13 ' B' ' 58' ' ' LEU . 24.5 ttp-105 -68.38 -37.35 80.32 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 120.779 1.627 . . . . 0.0 112.274 176.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 40.2 t -57.52 -46.84 83.34 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 167.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.29 -41.06 96.32 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 117.895 -1.05 . . . . 0.0 113.47 178.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 5.4 mm -57.47 -45.7 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 CA-C-N 120.903 1.683 . . . . 0.0 110.767 171.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 85.6 mt -60.78 -49.83 75.91 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 118.008 -0.996 . . . . 0.0 111.378 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 m -65.36 -31.04 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 CA-C-N 119.481 1.037 . . . . 0.0 111.951 -177.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.07 -26.67 48.3 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.412 1.085 . . . . 0.0 111.611 178.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 tp -66.49 -40.67 89.4 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 117.647 -1.168 . . . . 0.0 112.712 168.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.49 -53.42 11.26 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.357 2.263 . . . . 0.0 112.168 -179.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -102.76 25.69 8.92 Favored 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 127.903 2.481 . . . . 0.0 111.334 177.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -126.01 -91.43 0.82 Allowed Glycine 0 N--CA 1.465 0.596 0 C-N-CA 127.52 2.486 . . . . 0.0 111.676 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . 0.525 HG12 ' HA ' ' B' ' 76' ' ' ALA . 23.6 m 39.25 30.27 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 126.272 1.829 . . . . 0.0 114.12 -165.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 80.6 m -82.46 -150.83 0.09 Allowed 'General case' 0 N--CA 1.438 -1.059 0 CA-C-O 123.872 1.796 . . . . 0.0 107.617 168.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.64 162.2 75.4 Favored Pre-proline 0 C--N 1.311 -1.068 0 O-C-N 120.801 -1.187 . . . . 0.0 113.846 -166.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -61.1 -15.78 41.67 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.261 2.641 . . . . 0.0 114.9 -177.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.66 0.97 45.59 Favored Glycine 0 CA--C 1.536 1.396 0 CA-C-O 118.663 -1.076 . . . . 0.0 115.356 170.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . 0.5 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -63.5 -31.51 72.7 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.353 1.577 . . . . 0.0 113.783 -169.337 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mt -64.48 -16.98 63.41 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.803 0.841 . . . . 0.0 111.692 -176.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.89 -28.17 69.66 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.279 0.49 . . . . 0.0 112.22 173.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.04 -52.1 9.92 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.352 0.661 . . . . 0.0 111.069 171.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . 0.5 ' CD2' HE22 ' B' ' 39' ' ' GLN . 8.0 m-70 -58.77 -36.33 74.22 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 22.3 mt -98.11 -15.88 19.78 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -175.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.34 6.06 31.83 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-N 119.252 0.933 . . . . 0.0 113.345 -170.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 79.9 mt -102.2 156.6 17.46 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.81 1.244 . . . . 0.0 111.163 -172.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 31.0 p -65.48 154.69 37.82 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.034 0.534 . . . . 0.0 110.939 -170.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -55.34 -27.8 49.53 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.206 0.602 . . . . 0.0 112.181 171.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 4.1 m -70.42 -53.63 15.68 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.056 0.943 . . . . 0.0 111.032 171.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -58.2 -43.65 87.71 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 124.227 1.011 . . . . 0.0 112.232 177.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 7.7 t -60.68 -44.27 96.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 124.847 1.259 . . . . 0.0 111.947 170.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 65.0 m -64.19 -38.44 91.05 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 120.49 1.495 . . . . 0.0 112.968 175.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -57.01 -57.99 10.12 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.32 1.448 . . . . 0.0 110.611 176.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . 0.43 ' CD2' ' HB ' ' B' ' 22' ' ' THR . 63.4 m-70 -74.39 -18.81 60.61 Favored 'General case' 0 CA--C 1.553 1.068 0 CA-C-O 118.219 -0.896 . . . . 0.0 113.099 -179.4 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 28.7 mt -71.53 -37.92 71.12 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 121.059 1.754 . . . . 0.0 113.009 167.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 18.9 m -53.32 -52.66 58.44 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 120.652 1.569 . . . . 0.0 114.708 -171.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 3.3 t -68.56 -24.44 64.62 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 119.635 1.107 . . . . 0.0 112.924 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . 0.47 HD13 ' HG2' ' B' ' 23' ' ' ARG . 5.4 tp -70.08 -43.06 71.91 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 127.057 2.143 . . . . 0.0 110.845 177.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 70.4 mtm180 -81.83 -9.67 59.54 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.934 1.694 . . . . 0.0 112.255 176.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.61 -52.68 2.42 Favored Glycine 0 C--N 1.34 0.776 0 C-N-CA 124.583 1.087 . . . . 0.0 111.314 174.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 91.0 m -76.53 0.45 19.92 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 125.635 1.574 . . . . 0.0 115.124 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.22 29.6 49.56 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.414 1.007 . . . . 0.0 114.666 174.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 86.9 mt -89.06 -24.52 22.28 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.251 -1.146 . . . . 0.0 113.007 172.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 5.8 m -136.71 150.39 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.221 1.409 . . . . 0.0 111.618 176.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 60.0 t -141.43 140.81 31.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.182 1.393 . . . . 0.0 110.381 -169.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -77.75 141.42 39.3 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.136 0.969 . . . . 0.0 112.146 175.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.8 m -162.33 167.3 24.03 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.689 1.996 . . . . 0.0 107.262 -173.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -90.91 149.04 22.06 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.885 1.675 . . . . 0.0 113.143 172.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -99.55 11.27 39.61 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 125.687 1.595 . . . . 0.0 110.078 165.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.76 -56.05 4.91 Favored Glycine 0 C--N 1.343 0.926 0 C-N-CA 126.061 1.791 . . . . 0.0 111.196 -176.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 22.5 mtp-105 -69.51 -21.14 63.69 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.845 1.658 . . . . 0.0 113.523 178.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -174.43 173.33 2.98 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.243 2.617 . . . . 0.0 108.788 -167.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 3.4 m -79.13 162.04 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 C-N-CA 123.616 0.766 . . . . 0.0 109.736 166.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 22.1 ptt180 -147.35 164.7 32.45 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.88 1.272 . . . . 0.0 111.694 -178.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -106.11 120.89 42.98 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 165.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . 0.525 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -114.1 153.17 29.95 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.008 1.323 . . . . 0.0 110.947 177.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 77.9 mt -59.06 148.81 29.64 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.477 0.58 . . . . 0.0 110.02 169.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.52 -9.57 58.71 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 115.91 1.819 . . . . 0.0 115.91 -169.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -177.32 157.91 1.39 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.897 2.879 . . . . 0.0 110.865 168.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 98.0 p -44.78 -32.51 1.57 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 128.517 2.727 . . . . 0.0 114.065 166.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -54.96 -47.05 75.04 Favored 'General case' 0 C--N 1.343 0.288 0 C-N-CA 124.361 1.064 . . . . 0.0 112.202 171.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 16.4 mt -70.83 -44.3 66.78 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 118.402 -0.809 . . . . 0.0 109.135 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.9 -35.24 57.84 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.557 0.743 . . . . 0.0 112.501 177.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 3.5 mtt-85 -71.74 -63.26 1.16 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.25 1.02 . . . . 0.0 113.624 174.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.63 -19.07 65.48 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.474 1.488 . . . . 0.0 112.852 -175.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 56.0 tp -72.86 -49.37 30.5 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.177 1.791 . . . . 0.0 111.005 167.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -82.24 -40.74 9.88 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 128.221 2.82 . . . . 0.0 116.758 -168.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -64.51 -23.48 67.29 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.429 1.614 . . . . 0.0 111.48 169.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 37.2 tp 70.56 132.03 0.03 OUTLIER 'General case' 0 C--N 1.344 0.354 0 C-N-CA 129.719 3.208 . . . . 0.0 113.675 167.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . 0.458 HG23 HG12 ' B' ' 92' ' ' VAL . 3.2 m -53.38 138.12 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-O 122.61 1.195 . . . . 0.0 110.173 176.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -69.72 -10.46 58.39 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 -163.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.458 HG12 HG23 ' B' ' 90' ' ' VAL . 2.6 p -62.79 24.35 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 127.244 2.218 . . . . 0.0 115.632 -177.402 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.7 t 71.23 11.47 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 C-N-CA 125.073 1.349 . . . . 0.0 111.622 168.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.8 tt 77.99 99.89 0.07 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 128.859 2.863 . . . . 0.0 109.342 -170.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.804 0 C-N-CA 123.785 0.834 . . . . 0.0 112.732 179.493 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 88.7 mt . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -45.89 -30.38 1.71 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.229 1.812 . . . . 0.0 114.824 174.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.5 mmt85 -68.09 -36.11 79.25 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 116.253 -1.832 . . . . 0.0 113.428 174.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -62.27 -48.29 80.59 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 121.807 2.094 . . . . 0.0 111.043 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.27 -40.03 98.55 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 111.728 -0.549 . . . . 0.0 111.728 176.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.2 ttt180 -62.55 -33.93 75.91 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.737 0.815 . . . . 0.0 111.413 170.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.05 -19.31 64.87 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.29 1.405 . . . . 0.0 112.302 175.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 mp -92.21 -28.07 17.27 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.417 1.008 . . . . 0.0 112.964 169.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -100.53 -12.57 19.18 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 -172.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -56.77 140.55 75.59 Favored Pre-proline 0 CA--C 1.549 0.93 0 CA-C-N 119.922 1.237 . . . . 0.0 107.989 168.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -52.83 -77.2 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.432 1 C-N-CA 126.36 4.707 . . . . 0.0 112.076 -167.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.9 m -58.84 -26.35 64.1 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-O 117.513 -1.232 . . . . 0.0 111.775 177.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.6 mtt85 -65.96 -44.34 85.25 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.693 1.588 . . . . 0.0 112.604 177.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.7 t -54.1 -51.16 65.05 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.173 1.351 . . . . 0.0 110.347 171.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.4 ttt85 -62.67 -40.7 97.9 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.921 -178.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.0 mm -53.14 -56.88 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 125.413 1.485 . . . . 0.0 109.22 168.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.33 -45.38 93.46 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.886 -0.578 . . . . 0.0 111.965 -172.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.1 p -69.85 -24.65 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 CA-C-N 119.333 0.97 . . . . 0.0 113.41 176.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.48 -8.56 59.74 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 121.153 -0.967 . . . . 0.0 113.441 170.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.468 HD23 ' HA ' ' A' ' 30' ' ' LEU . 11.4 mt -94.66 -9.53 34.64 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 172.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.37 -13.14 61.4 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 128.724 2.81 . . . . 0.0 111.902 165.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -141.08 -46.8 0.39 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.773 2.029 . . . . 0.0 113.963 -169.064 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.98 -66.17 2.31 Favored Glycine 0 C--N 1.339 0.746 0 C-N-CA 125.254 1.407 . . . . 0.0 112.955 -167.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 34.9 m 41.15 20.8 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 128.353 2.661 . . . . 0.0 117.418 171.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 67.0 m -85.28 -63.4 1.33 Allowed 'General case' 0 C--O 1.223 -0.31 0 O-C-N 120.486 -1.384 . . . . 0.0 111.899 -178.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -151.49 159.88 32.68 Favored Pre-proline 0 N--CA 1.473 0.723 0 N-CA-C 115.031 1.493 . . . . 0.0 115.031 -172.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -57.82 119.99 7.6 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.091 1.861 . . . . 0.0 107.56 168.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.57 0.17 84.48 Favored Glycine 0 CA--C 1.533 1.167 0 CA-C-O 117.297 -1.835 . . . . 0.0 115.483 -173.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -37.77 85.91 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 121.209 2.505 . . . . 0.0 109.971 168.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.9 mt -55.42 -27.29 46.91 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 125.962 1.705 . . . . 0.0 110.648 176.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.87 -30.3 68.9 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.301 -0.874 . . . . 0.0 113.071 -174.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.55 -53.68 7.73 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.661 0.784 . . . . 0.0 111.172 170.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -50.6 -35.39 30.03 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.2 mt -101.08 -13.87 18.02 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.86 1.264 . . . . 0.0 113.389 -173.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.15 13.05 66.61 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.337 0.97 . . . . 0.0 113.724 -173.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 53.9 mt -123.9 141.28 52.17 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.577 1.151 . . . . 0.0 110.114 -168.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.8 p -59.2 157.57 10.37 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -168.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -52.95 -28.63 24.51 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.909 0.884 . . . . 0.0 112.279 171.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.5 t -79.12 -36.68 40.23 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.06 -1.025 . . . . 0.0 112.832 175.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -68.33 -38.67 81.75 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.335 0.971 . . . . 0.0 111.888 171.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.8 t -57.12 -44.84 83.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.518 174.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.79 -39.17 93.16 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-N 120.483 1.492 . . . . 0.0 114.081 173.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -56.18 -32.96 64.84 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.214 1.005 . . . . 0.0 112.612 176.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 19.2 m-70 -94.56 -19.64 20.32 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 115.146 1.535 . . . . 0.0 115.146 172.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 47.1 mt -70.47 -28.67 65.18 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 121.159 1.8 . . . . 0.0 113.948 169.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 p -52.0 -59.42 4.37 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 -169.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 2.9 t -64.95 -39.39 93.42 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 118.557 0.617 . . . . 0.0 110.901 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.2 tp -51.76 -32.44 30.83 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.499 1.92 . . . . 0.0 112.266 -178.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.2 mtm105 -72.63 -45.67 57.85 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 118.824 0.738 . . . . 0.0 112.915 174.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.34 -28.08 62.51 Favored Glycine 0 N--CA 1.474 1.203 0 C-N-CA 125.348 1.452 . . . . 0.0 112.433 -176.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.1 m -66.93 -5.57 13.14 Favored 'General case' 0 CA--C 1.566 1.568 0 C-N-CA 127.414 2.285 . . . . 0.0 111.115 165.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.02 -24.92 1.91 Allowed Glycine 0 C--N 1.343 0.924 0 C-N-CA 128.711 3.053 . . . . 0.0 113.809 -172.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 69.9 mt -43.27 -39.55 3.08 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 128.519 2.728 . . . . 0.0 115.549 -170.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -115.4 133.68 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 124.922 1.289 . . . . 0.0 113.231 173.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 71.7 t -124.59 136.99 58.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 126.369 1.868 . . . . 0.0 109.549 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.33 141.4 30.94 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.797 1.239 . . . . 0.0 111.095 169.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.0 m -164.0 163.56 23.36 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.947 1.699 . . . . 0.0 107.244 -169.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -84.34 148.43 26.65 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.222 1.374 . . . . 0.0 114.177 174.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -91.76 -18.54 23.75 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.453 0.701 . . . . 0.0 110.24 163.609 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 128.8 -37.81 2.16 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 127.188 2.328 . . . . 0.0 113.252 173.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 23.1 ttm180 -93.97 -34.49 13.04 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 128.646 2.778 . . . . 0.0 111.841 170.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -144.43 164.07 31.93 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.745 2.018 . . . . 0.0 110.166 -170.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 32.9 m -84.56 150.3 4.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 CA-C-O 121.585 0.707 . . . . 0.0 111.298 168.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -135.63 162.27 33.18 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 126.872 2.069 . . . . 0.0 109.304 -171.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -97.57 153.74 17.98 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 164.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -158.83 161.52 36.91 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.164 1.386 . . . . 0.0 109.366 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 57.3 mt -72.35 152.76 41.87 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.363 0.665 . . . . 0.0 111.479 175.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.09 -40.21 95.07 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 115.13 1.53 . . . . 0.0 115.13 -173.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -162.57 161.19 26.7 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 125.411 1.484 . . . . 0.0 110.553 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.58 -37.69 0.14 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 129.515 3.126 . . . . 0.0 112.766 165.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -56.23 -52.11 65.63 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 125.563 1.545 . . . . 0.0 113.398 178.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.9 mt -70.5 -45.7 65.12 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.182 0.901 . . . . 0.0 109.23 -178.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -51.79 -42.11 62.18 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.453 1.101 . . . . 0.0 111.059 177.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 -65.59 -59.74 3.64 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.689 1.196 . . . . 0.0 113.321 171.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.28 -24.46 55.04 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 119.551 1.069 . . . . 0.0 113.329 -178.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.22 -41.5 16.88 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.077 -1.014 . . . . 0.0 112.937 169.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.01 -55.46 4.83 Favored Glycine 0 N--CA 1.471 1.014 0 C-N-CA 126.485 1.993 . . . . 0.0 114.259 -173.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -72.1 -10.34 59.65 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 119.196 1.498 . . . . 0.0 110.895 167.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.5 tp 74.88 138.9 0.06 Allowed 'General case' 0 C--N 1.345 0.409 0 C-N-CA 129.568 3.147 . . . . 0.0 110.554 169.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 32.6 m -66.74 21.05 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 124.923 1.289 . . . . 0.0 113.584 176.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 48.0 mm-40 78.14 -12.3 1.09 Allowed 'General case' 0 N--CA 1.443 -0.782 0 O-C-N 120.238 -1.539 . . . . 0.0 112.058 161.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.6 p -65.84 34.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 128.881 2.872 . . . . 0.0 115.24 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . 0.271 34.8 m 51.27 15.49 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 130.028 3.331 . . . . 0.0 115.832 175.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 38.7 tp 107.25 101.88 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.659 1 C-N-CA 131.759 4.024 . . . . 0.0 110.501 178.116 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.36 76.49 0.26 Allowed 'General case' 0 CA--C 1.553 1.074 0 O-C-N 121.262 -0.899 . . . . 0.0 111.89 168.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.92 162.02 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 C-N-CA 126.818 2.047 . . . . 0.0 113.178 175.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -63.6 -1.37 1.23 Allowed 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 126.914 2.086 . . . . 0.0 115.008 173.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.2 p -62.61 111.44 2.07 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 126.178 1.791 . . . . 0.0 111.323 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -66.21 140.75 58.19 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 171.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -157.47 127.06 3.2 Favored Pre-proline 0 N--CA 1.443 -0.811 0 N-CA-C 106.125 -1.805 . . . . 0.0 106.125 174.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . 0.27 59.5 Cg_endo -73.42 117.13 4.95 Favored 'Trans proline' 0 C--N 1.352 0.713 0 CA-C-N 121.399 1.535 . . . . 0.0 114.149 -166.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 50.5 t . . . . . 0 CA--C 1.538 0.495 0 C-N-CA 130.221 3.408 . . . . 0.0 106.946 -160.567 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 72.2 mt . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 116.33 1.974 . . . . 0.0 116.33 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -39.22 -33.86 0.16 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.302 2.241 . . . . 0.0 114.485 172.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 1.8 mmm-85 -63.09 -31.21 72.29 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.795 2.038 . . . . 0.0 114.482 178.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -60.93 -51.88 67.38 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 120.41 1.459 . . . . 0.0 111.033 173.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.61 -35.52 74.61 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.106 -0.798 . . . . 0.0 111.106 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 52.7 ttt180 -64.55 -31.84 73.23 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 123.76 0.824 . . . . 0.0 111.057 171.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.28 -27.51 65.48 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 120.714 1.597 . . . . 0.0 111.99 174.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 mp -87.95 -7.57 56.93 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 172.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -125.2 -14.55 6.49 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 117.235 2.309 . . . . 0.0 117.235 -175.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -54.93 143.8 50.48 Favored Pre-proline 0 CA--C 1.546 0.821 0 CA-C-N 120.671 1.578 . . . . 0.0 108.582 170.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -43.64 -80.69 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 1 C-N-CA 127.453 5.436 . . . . 0.0 113.992 -166.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.5 ' HB ' ' CD2' ' B' ' 54' ' ' HIS . 7.3 m -67.74 -14.23 62.78 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.664 -0.647 . . . . 0.0 111.553 176.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.68 -47.06 42.56 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.768 1.167 . . . . 0.0 112.712 -171.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 54.1 t -51.83 -47.33 64.41 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 167.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 13.9 ttt85 -61.22 -42.56 98.83 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 118.059 -0.972 . . . . 0.0 112.862 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -56.62 -47.78 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 CA-C-N 121.176 1.807 . . . . 0.0 111.176 171.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 40.7 mt -66.94 -50.68 61.59 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 118.919 -0.562 . . . . 0.0 111.397 -178.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 p -70.14 -25.38 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 CA-C-N 119.163 0.892 . . . . 0.0 111.265 -177.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.33 -43.87 63.47 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-O 117.566 -1.207 . . . . 0.0 110.414 167.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.432 ' HA ' HD23 ' B' ' 30' ' ' LEU . 9.7 mt -60.08 -27.09 66.71 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.539 1.518 . . . . 0.0 115.042 -178.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -44.71 -28.84 0.67 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 126.717 2.007 . . . . 0.0 111.925 168.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -120.08 -31.27 4.47 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 129.556 3.142 . . . . 0.0 113.784 169.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.79 16.43 4.23 Favored Glycine 0 N--CA 1.468 0.793 0 C-N-CA 130.019 3.676 . . . . 0.0 115.999 -163.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 20.0 m -58.49 30.39 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 127.609 2.364 . . . . 0.0 117.361 170.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 71.1 m -87.64 -69.06 0.71 Allowed 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.793 -1.192 . . . . 0.0 113.442 178.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -159.54 158.3 27.51 Favored Pre-proline 0 N--CA 1.475 0.781 0 CA-C-N 120.266 1.394 . . . . 0.0 114.341 -172.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -57.07 115.31 2.41 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 122.451 2.101 . . . . 0.0 109.28 170.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 93.66 1.45 65.92 Favored Glycine 0 CA--C 1.532 1.143 0 CA-C-O 117.348 -1.807 . . . . 0.0 115.313 -174.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . 0.471 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -63.56 -39.5 94.57 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 120.566 2.183 . . . . 0.0 110.007 168.91 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 9.9 mt -56.52 -24.29 45.51 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 124.69 1.196 . . . . 0.0 110.986 -177.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.8 -31.62 62.8 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.289 -0.882 . . . . 0.0 112.219 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.45 -55.97 5.05 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.96 0.904 . . . . 0.0 111.198 171.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . 0.471 ' CD2' HE22 ' B' ' 39' ' ' GLN . 3.2 m-70 -54.51 -29.27 49.95 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.436 HD12 HG22 ' B' ' 51' ' ' VAL . 19.5 mt -105.34 -14.58 15.29 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.197 1.399 . . . . 0.0 112.887 -175.083 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 65.51 14.17 59.68 Favored Glycine 0 CA--C 1.53 0.978 0 C-N-CA 124.323 0.963 . . . . 0.0 113.2 -173.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 39.9 mt -120.3 158.66 26.59 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.184 0.992 . . . . 0.0 112.214 -168.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 20.4 p -66.03 154.65 38.93 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.468 0.651 . . . . 0.0 111.151 -169.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -60.99 -19.76 61.62 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.701 -0.624 . . . . 0.0 111.806 173.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 13.6 m -72.27 -53.55 12.15 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.841 1.256 . . . . 0.0 110.931 168.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -59.22 -37.23 77.0 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.616 1.166 . . . . 0.0 112.024 176.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . 0.436 HG22 HD12 ' B' ' 44' ' ' LEU . 10.5 t -63.79 -43.3 97.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 124.293 1.037 . . . . 0.0 112.348 169.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 18.1 m -61.02 -45.12 96.1 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 120.462 1.483 . . . . 0.0 112.069 173.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 -57.41 -28.11 62.97 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 127.31 2.244 . . . . 0.0 113.089 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . 0.5 ' CD2' ' HB ' ' B' ' 22' ' ' THR . 35.3 m-70 -99.29 -20.12 16.72 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 173.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 50.0 mt -77.71 -22.52 50.3 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 117.039 -1.458 . . . . 0.0 114.875 170.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -44.97 -69.89 0.12 Allowed 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 121.987 2.176 . . . . 0.0 113.888 175.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.5 t -63.9 -42.97 97.3 Favored 'General case' 0 C--O 1.215 -0.76 0 C-N-CA 124.384 1.074 . . . . 0.0 109.916 -178.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.04 -39.63 28.08 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.994 1.318 . . . . 0.0 113.531 176.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 49.1 mtm180 -87.36 -19.91 27.47 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.57 -31.46 10.32 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 125.323 1.439 . . . . 0.0 114.902 175.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 85.1 m -67.27 -10.77 54.04 Favored 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 128.365 2.666 . . . . 0.0 112.501 169.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.31 19.16 78.6 Favored Glycine 0 CA--C 1.529 0.952 0 C-N-CA 124.685 1.136 . . . . 0.0 113.54 -174.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 83.0 mt -78.3 -30.71 48.49 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.401 1.1 . . . . 0.0 112.704 175.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 19.6 t -133.5 137.0 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 125.485 1.514 . . . . 0.0 111.259 -170.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 42.4 t -133.97 144.84 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.034 1.334 . . . . 0.0 110.825 -169.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -86.81 137.85 32.07 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.124 1.37 . . . . 0.0 111.38 173.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 18.2 m -161.45 170.04 20.75 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.891 1.676 . . . . 0.0 107.652 -171.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -91.3 145.49 24.61 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 120.419 1.463 . . . . 0.0 113.434 171.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.262 0.0 OUTLIER -88.16 -16.81 32.38 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.492 0.717 . . . . 0.0 110.928 164.667 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 128.28 -35.55 2.68 Favored Glycine 0 CA--C 1.535 1.308 0 C-N-CA 127.407 2.432 . . . . 0.0 113.201 172.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 13.1 ttm180 -96.36 -35.75 11.09 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 129.07 2.948 . . . . 0.0 111.62 170.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -143.62 163.23 33.81 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 127.171 2.188 . . . . 0.0 109.827 -169.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 33.7 m -82.81 153.2 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-O 121.309 0.576 . . . . 0.0 111.652 169.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -136.35 159.02 43.03 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 127.071 2.148 . . . . 0.0 109.845 -171.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -99.54 147.37 25.4 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 162.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -147.42 156.12 42.58 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 123.679 0.792 . . . . 0.0 109.133 178.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 40.5 mt -60.58 154.13 21.87 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 168.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.59 -26.81 68.01 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -171.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -174.79 164.43 3.53 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.108 2.163 . . . . 0.0 110.673 169.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.2 m -35.59 -34.78 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 129.749 3.22 . . . . 0.0 113.213 165.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -61.88 -43.32 99.08 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.03 1.332 . . . . 0.0 111.767 -179.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 11.6 mt -74.31 -44.3 53.16 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.985 1.266 . . . . 0.0 110.045 172.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.08 -28.11 16.35 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.661 1.184 . . . . 0.0 112.313 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 39.5 mtt180 -72.23 -63.32 1.17 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.013 1.725 . . . . 0.0 114.682 170.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.33 -13.93 9.89 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 120.129 -1.607 . . . . 0.0 113.303 175.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 5.3 tp -86.09 -44.34 12.34 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 127.5 2.32 . . . . 0.0 112.824 168.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -83.83 -58.26 2.28 Favored Glycine 0 N--CA 1.476 1.305 0 C-N-CA 127.428 2.442 . . . . 0.0 114.428 -174.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 9.4 pm0 -67.89 -14.73 63.19 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 119.882 1.841 . . . . 0.0 110.232 165.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . 0.405 ' C ' ' H ' ' B' ' 91' ' ' GLN . 43.3 tp 76.55 160.0 0.22 Allowed 'General case' 0 C--N 1.346 0.437 0 C-N-CA 129.63 3.172 . . . . 0.0 110.558 169.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 28.9 m -66.79 18.8 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 120.856 -1.152 . . . . 0.0 112.401 168.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . 0.405 ' H ' ' C ' ' B' ' 89' ' ' LEU . 33.3 mm-40 72.48 -0.91 3.13 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.815 1.246 . . . . 0.0 113.268 166.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.9 p -60.57 34.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 130.107 3.363 . . . . 0.0 115.455 173.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.263 30.0 m 52.03 14.6 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 130.266 3.426 . . . . 0.0 116.201 175.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 41.9 tp 109.93 101.92 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 130.45 3.5 . . . . 0.0 109.697 -174.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.932 0 C-N-CA 124.675 1.19 . . . . 0.0 111.592 168.796 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.0 mp . . . . . 0 CA--C 1.542 0.672 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.74 -50.07 33.47 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.421 -0.799 . . . . 0.0 111.139 169.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.4 mmt85 -60.13 -35.55 75.52 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.236 -1.54 . . . . 0.0 112.566 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -56.27 -56.92 15.03 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 126.55 1.94 . . . . 0.0 110.72 178.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -75.02 -30.76 58.7 Favored Glycine 0 CA--C 1.531 1.084 0 CA-C-N 119.28 0.946 . . . . 0.0 112.54 -178.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -61.62 -28.84 69.65 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 118.501 1.151 . . . . 0.0 112.027 169.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.514 ' CB ' HH21 ' A' ' 23' ' ' ARG . . . -85.77 -21.48 28.17 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.285 2.234 . . . . 0.0 114.356 173.182 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.9 tp -78.45 -28.84 46.68 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.101 1.76 . . . . 0.0 110.005 177.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -108.04 62.81 0.61 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.599 1.16 . . . . 0.0 112.197 168.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -125.46 141.58 39.34 Favored Pre-proline 0 CA--C 1.557 1.232 0 C-N-CA 127.686 2.394 . . . . 0.0 107.047 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -45.84 -90.46 0.0 OUTLIER 'Trans proline' 0 C--N 1.356 0.944 1 C-N-CA 127.634 5.556 . . . . 0.0 117.073 -163.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.2 m -46.96 -27.43 1.27 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.437 1.895 . . . . 0.0 111.987 169.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.514 HH21 ' CB ' ' A' ' 17' ' ' ALA . 1.8 ttp180 -73.3 -45.89 52.82 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 126.012 1.725 . . . . 0.0 113.644 -168.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.9 t -54.35 -48.82 71.01 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 120.229 1.377 . . . . 0.0 110.324 168.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 -52.45 -52.38 54.42 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-O 117.945 -1.026 . . . . 0.0 112.127 173.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.462 ' HA ' HD11 ' A' ' 44' ' ' LEU . 1.3 mt -50.52 -50.17 22.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 CA-C-N 121.03 1.741 . . . . 0.0 111.767 172.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 93.6 mt -69.55 -37.58 77.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 118.28 -0.866 . . . . 0.0 112.608 -170.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.3 p -74.74 -21.34 17.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 CA-C-N 119.19 0.904 . . . . 0.0 111.985 174.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.9 -44.29 27.53 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 118.077 -0.963 . . . . 0.0 110.764 168.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 30' ' ' LEU . 12.4 mt -62.18 -18.96 62.52 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -176.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.6 mt -53.29 -22.11 6.57 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 124.528 1.131 . . . . 0.0 111.665 166.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -129.17 -29.11 2.29 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 128.815 2.846 . . . . 0.0 113.564 169.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.25 11.21 2.98 Favored Glycine 0 N--CA 1.473 1.156 0 C-N-CA 128.941 3.162 . . . . 0.0 116.057 -165.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.626 HG12 ' HA ' ' A' ' 76' ' ' ALA . 27.7 m -66.46 39.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 C-N-CA 128.21 2.604 . . . . 0.0 115.721 172.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 5.1 t -100.81 -60.42 1.53 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.416 1.086 . . . . 0.0 113.033 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 53.6 p90 -158.21 154.97 25.09 Favored Pre-proline 0 N--CA 1.478 0.927 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -178.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -61.01 116.88 3.65 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.525 2.15 . . . . 0.0 109.538 175.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.41 -12.19 59.94 Favored Glycine 0 C--O 1.22 -0.772 0 CA-C-O 115.986 -2.563 . . . . 0.0 114.75 -175.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -29.26 68.96 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-N 120.629 2.214 . . . . 0.0 111.838 175.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.413 HD13 HG23 ' A' ' 26' ' ' ILE . 17.9 mt -63.13 -18.97 64.02 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.311 0.644 . . . . 0.0 110.775 177.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.52 -42.37 96.31 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 119.444 1.02 . . . . 0.0 110.472 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.45 -51.16 66.86 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.517 1.053 . . . . 0.0 112.348 173.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -57.27 -36.69 71.32 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.462 HD11 ' HA ' ' A' ' 26' ' ' ILE . 19.6 mt -101.82 -14.49 17.26 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -170.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.08 10.97 36.24 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 114.676 0.63 . . . . 0.0 114.676 -172.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.0 mp -101.16 141.52 33.92 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 173.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.3 t -59.1 147.8 33.63 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 121.909 -0.495 . . . . 0.0 111.277 -176.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -57.09 -27.99 62.23 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.253 1.021 . . . . 0.0 113.439 -171.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.8 p -69.41 -55.44 10.32 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.261 -0.9 . . . . 0.0 112.767 170.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -54.57 -49.06 71.26 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.08 0.952 . . . . 0.0 112.12 177.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 84.9 t -59.56 -40.69 82.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 O-C-N 121.803 -0.561 . . . . 0.0 111.065 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 46.5 m -69.99 -27.24 64.54 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 178.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 32.0 t-20 -58.93 -45.36 90.57 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.019 0.827 . . . . 0.0 110.94 170.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 40.0 m-70 -71.65 -22.65 61.66 Favored 'General case' 0 CA--C 1.551 1.019 0 O-C-N 120.146 -1.596 . . . . 0.0 114.268 170.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 73.6 mt -70.55 -25.35 63.05 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 120.62 1.555 . . . . 0.0 111.697 168.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.14 -42.1 63.07 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.121 0.873 . . . . 0.0 111.736 170.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 2.4 t -83.68 -39.45 20.18 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 119.483 1.038 . . . . 0.0 111.886 -178.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.441 ' CD1' ' HG2' ' A' ' 23' ' ' ARG . 1.1 tp -52.31 -42.33 63.71 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.609 1.564 . . . . 0.0 113.408 175.058 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.8 mtm180 -85.19 -1.07 56.49 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.493 1.117 . . . . 0.0 112.025 -179.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -109.17 -41.84 1.35 Allowed Glycine 0 N--CA 1.477 1.413 0 C-N-CA 126.159 1.838 . . . . 0.0 113.201 175.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.7 m -59.49 -16.62 25.45 Favored 'General case' 0 CA--C 1.561 1.394 0 C-N-CA 127.515 2.326 . . . . 0.0 112.785 169.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.98 20.0 74.02 Favored Glycine 0 C--N 1.343 0.953 0 C-N-CA 125.714 1.626 . . . . 0.0 113.987 -176.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.6 mt -71.12 -23.98 62.19 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.303 1.441 . . . . 0.0 113.13 171.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 13.7 t -142.6 144.97 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -166.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 9.6 t -133.42 141.63 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 C-N-CA 125.276 1.43 . . . . 0.0 109.479 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -96.67 148.52 22.78 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.377 1.071 . . . . 0.0 112.526 175.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.9 p -133.91 144.85 49.11 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.634 0.774 . . . . 0.0 109.674 172.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -94.96 107.97 20.02 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 125.376 1.47 . . . . 0.0 108.978 169.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.78 14.24 0.22 Allowed 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -176.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.2 -17.48 26.61 Favored Glycine 0 CA--C 1.529 0.933 0 C-N-CA 126.008 1.766 . . . . 0.0 113.189 -177.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 20.3 ttp-105 -158.17 -48.15 0.06 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.658 1.183 . . . . 0.0 112.103 -169.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -93.75 173.76 7.52 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.096 1.758 . . . . 0.0 110.317 171.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 20.6 m -122.77 149.28 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 125.014 1.325 . . . . 0.0 108.664 167.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.5 ptt85 -138.14 177.12 8.12 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.877 1.671 . . . . 0.0 109.372 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -117.03 174.69 5.96 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.035 0.934 . . . . 0.0 110.893 168.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.626 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -168.87 145.97 3.7 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 126.385 1.874 . . . . 0.0 109.859 177.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 91.0 mt -56.23 148.76 17.61 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 123.505 0.503 . . . . 0.0 110.589 169.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.15 -28.5 60.16 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.875 1.806 . . . . 0.0 115.875 -168.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -156.16 160.12 39.6 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 124.195 1.95 . . . . 0.0 112.988 170.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -40.32 -28.85 0.07 Allowed 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 130.49 3.516 . . . . 0.0 113.831 165.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -60.15 -62.16 2.07 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 126.484 1.914 . . . . 0.0 110.653 171.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.8 mt -62.31 -47.65 83.34 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -176.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.69 -48.06 66.82 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.7 ptp180 -75.55 -37.2 60.17 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -175.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -76.7 -39.41 52.07 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.455 1.025 . . . . 0.0 110.69 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.99 -32.32 70.74 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.216 -0.928 . . . . 0.0 110.163 169.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.86 -18.56 76.21 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 125.712 1.625 . . . . 0.0 115.401 171.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.38 -20.36 63.83 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 120.04 1.92 . . . . 0.0 110.259 166.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 13.5 tp 66.91 61.86 0.5 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 128.101 2.56 . . . . 0.0 109.877 -169.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 61.9 t -25.88 128.17 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 128.035 2.534 . . . . 0.0 114.557 -172.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.417 ' C ' ' H ' ' A' ' 93' ' ' VAL . 0.8 OUTLIER -94.3 6.86 47.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 112.758 -2.019 . . . . 0.0 111.269 -109.688 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.8 p -63.71 34.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 130.239 3.416 . . . . 0.0 113.382 169.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.417 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.5 t 69.63 18.18 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.983 0 C-N-CA 125.534 1.534 . . . . 0.0 112.004 168.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 5.4 tt 103.0 102.93 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 131.342 3.857 . . . . 0.0 108.749 -173.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.46 76.22 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 115.34 1.608 . . . . 0.0 115.34 176.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 99.2 t -58.73 153.51 3.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 127.419 2.288 . . . . 0.0 111.241 169.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -59.48 -0.24 0.15 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 127.752 2.421 . . . . 0.0 116.813 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.437 ' HG1' ' N ' ' B' ' 11' ' ' LEU . 31.3 p -49.01 101.53 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.214 1.406 . . . . 0.0 113.394 178.099 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -99.21 141.08 32.44 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 164.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -138.34 141.8 32.86 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 -169.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -54.85 -29.44 63.22 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 123.325 2.684 . . . . 0.0 114.779 -171.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 10.4 t . . . . . 0 CA--C 1.536 0.404 0 C-N-CA 126.829 2.052 . . . . 0.0 112.189 169.173 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.437 ' N ' ' HG1' ' A' ' 98' ' ' THR . 5.0 mp . . . . . 0 CA--C 1.545 0.751 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -81.67 -43.96 17.8 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.945 0.793 . . . . 0.0 110.736 166.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 12.0 mmt85 -62.32 -32.06 72.77 Favored 'General case' 0 N--CA 1.473 0.7 0 O-C-N 120.394 -1.441 . . . . 0.0 112.394 178.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -46.04 -63.9 0.87 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 127.896 2.478 . . . . 0.0 110.725 170.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.76 -31.33 62.6 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 119.758 -1.211 . . . . 0.0 112.491 -174.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -66.79 -27.72 67.81 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.448 1.099 . . . . 0.0 112.285 174.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -86.43 -21.58 27.02 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 127.556 2.342 . . . . 0.0 113.727 175.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.0 mp -84.37 -45.19 13.0 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.045 0.838 . . . . 0.0 109.901 173.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.91 49.16 1.32 Allowed 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.204 -0.935 . . . . 0.0 112.162 169.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -117.75 134.57 23.22 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 128.587 2.755 . . . . 0.0 106.567 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -46.3 -90.13 0.0 OUTLIER 'Trans proline' 0 CA--C 1.537 0.672 1 C-N-CA 126.545 4.83 . . . . 0.0 115.682 -164.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 91.3 m -54.63 -26.79 35.1 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.764 1.226 . . . . 0.0 111.251 174.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.636 ' HG2' HD13 ' B' ' 58' ' ' LEU . 6.6 mtp180 -74.13 -36.7 64.2 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 117.062 -1.447 . . . . 0.0 114.355 -171.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 41.4 t -58.04 -51.15 70.85 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.521 1.509 . . . . 0.0 109.364 168.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 38.8 mtp180 -51.89 -45.37 64.15 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 124.854 1.261 . . . . 0.0 111.825 173.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 7.0 mt -52.8 -67.05 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 CA-C-N 120.167 1.349 . . . . 0.0 110.099 169.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 87.4 mt -53.68 -37.99 63.75 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -168.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 7.2 p -72.29 -24.28 22.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-N 119.484 1.038 . . . . 0.0 113.75 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -95.35 -18.58 20.64 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.017 1.327 . . . . 0.0 113.461 173.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.04 -50.3 71.19 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.901 1.681 . . . . 0.0 109.102 175.046 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -39.11 -53.12 1.86 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 130.514 3.526 . . . . 0.0 113.639 -174.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -101.55 -15.48 17.09 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.556 1.942 . . . . 0.0 112.619 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.62 -65.31 2.17 Favored Glycine 0 C--N 1.341 0.808 0 C-N-CA 125.501 1.524 . . . . 0.0 112.005 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . 0.441 HG12 ' HA ' ' B' ' 76' ' ' ALA . 29.6 m 27.21 40.14 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 N-CA-C 116.664 2.098 . . . . 0.0 116.664 -173.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -92.11 -73.71 0.54 Allowed 'General case' 0 N--CA 1.465 0.302 0 O-C-N 121.394 -0.816 . . . . 0.0 112.365 -167.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . 0.495 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 34.7 p90 -151.18 163.53 23.33 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 124.168 0.987 . . . . 0.0 113.441 -178.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -51.76 117.2 3.3 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 122.507 2.138 . . . . 0.0 110.953 170.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.06 -4.57 84.72 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-O 118.383 -1.232 . . . . 0.0 115.16 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . 0.495 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 0.0 OUTLIER -56.29 -18.53 10.91 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 120.371 2.085 . . . . 0.0 114.848 175.966 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.401 ' HB2' HG11 ' B' ' 51' ' ' VAL . 1.8 mt -75.46 -15.97 60.37 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 124.325 1.05 . . . . 0.0 110.894 178.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.76 -39.16 87.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 119.398 0.999 . . . . 0.0 112.698 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.77 -42.06 77.96 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.803 170.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -62.19 -36.79 82.98 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 176.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 27.0 mt -101.69 -17.37 16.32 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 -169.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.1 13.15 47.4 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-O 121.961 0.756 . . . . 0.0 113.844 -169.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mp -99.44 131.14 45.65 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 169.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 11.8 t -56.38 148.83 18.01 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -176.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -55.19 -23.87 24.08 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.482 1.513 . . . . 0.0 114.382 -175.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 60.7 p -72.98 -53.17 11.87 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.292 1.405 . . . . 0.0 112.339 169.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 63.7 t-20 -57.52 -47.19 82.64 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.357 1.063 . . . . 0.0 111.916 -178.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . 0.401 HG11 ' HB2' ' B' ' 40' ' ' LEU . 27.4 t -63.11 -36.59 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 O-C-N 121.203 -0.935 . . . . 0.0 111.54 177.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 55.3 m -71.87 -29.72 64.67 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -55.48 -45.85 76.92 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 122.089 0.947 . . . . 0.0 110.54 170.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 -71.73 -23.16 61.57 Favored 'General case' 0 CA--C 1.556 1.199 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 171.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 65.9 mt -74.85 -18.71 60.4 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-N 121.192 1.814 . . . . 0.0 112.175 168.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.36 -50.17 70.38 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.21 0.914 . . . . 0.0 110.581 172.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 6.1 t -76.01 -39.45 55.73 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 118.554 0.615 . . . . 0.0 112.236 -177.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . 0.636 HD13 ' HG2' ' B' ' 23' ' ' ARG . 4.8 tp -56.05 -40.87 74.15 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.845 1.658 . . . . 0.0 112.361 -175.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 -81.32 -9.75 59.69 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.717 1.207 . . . . 0.0 112.33 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -93.17 -39.42 5.13 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 125.076 1.322 . . . . 0.0 111.827 169.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 43.5 m -58.07 -18.18 22.96 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 127.528 2.331 . . . . 0.0 113.216 169.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 81.51 -9.52 54.8 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 125.709 1.624 . . . . 0.0 113.838 -176.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 92.5 mt -51.41 -31.63 23.4 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 128.079 2.551 . . . . 0.0 114.315 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -129.91 138.87 52.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 C-N-CA 126.376 1.87 . . . . 0.0 109.44 177.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 51.2 t -122.02 135.9 60.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 C-N-CA 127.153 2.181 . . . . 0.0 108.713 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -87.54 136.05 33.1 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.589 0.756 . . . . 0.0 112.42 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 14.1 p -136.74 148.08 47.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.492 0.717 . . . . 0.0 110.566 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -100.09 107.25 19.1 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.964 1.306 . . . . 0.0 110.198 175.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.83 9.46 0.38 Allowed 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 116.2 1.926 . . . . 0.0 116.2 -177.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 116.24 -17.93 14.24 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.921 1.724 . . . . 0.0 113.083 -177.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 20.0 ttp-105 -157.88 -42.99 0.06 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.447 1.499 . . . . 0.0 111.957 -169.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -102.27 171.64 7.35 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.259 1.824 . . . . 0.0 111.136 175.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 23.8 m -120.01 143.06 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.017 1.327 . . . . 0.0 110.377 168.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.2 ptt180 -131.98 175.1 9.51 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.041 1.336 . . . . 0.0 110.808 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -122.65 125.65 46.03 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.556 1.142 . . . . 0.0 108.588 167.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . 0.441 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -123.61 150.42 44.15 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.451 1.1 . . . . 0.0 110.365 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 tp -53.02 145.26 13.34 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.585 1.154 . . . . 0.0 110.326 172.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.27 -37.9 84.83 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 -173.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -169.11 161.41 10.37 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 123.698 1.713 . . . . 0.0 112.592 -174.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -34.96 -39.45 0.1 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 130.662 3.585 . . . . 0.0 113.162 165.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -50.79 -67.39 0.26 Allowed 'General case' 0 C--N 1.345 0.386 0 C-N-CA 127.033 2.133 . . . . 0.0 111.877 173.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 16.8 mt -62.35 -37.46 85.75 Favored 'General case' 0 C--O 1.223 -0.336 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.6 -41.89 98.3 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 118.471 -0.776 . . . . 0.0 112.276 -174.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -71.45 -52.06 20.49 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-O 117.878 -1.058 . . . . 0.0 111.772 174.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.79 -38.01 89.5 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 120.109 1.322 . . . . 0.0 112.311 -173.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' B' ' 86' ' ' LEU . 0.3 OUTLIER -71.85 -29.16 64.09 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.39 -0.819 . . . . 0.0 112.109 173.445 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -87.09 -29.75 21.97 Favored Glycine 0 CA--C 1.543 1.796 0 C-N-CA 124.847 1.213 . . . . 0.0 116.022 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -89.04 -8.68 53.5 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.971 1.709 . . . . 0.0 112.82 171.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 13.7 tp 85.69 84.94 0.02 OUTLIER 'General case' 0 C--O 1.239 0.521 0 C-N-CA 128.801 2.84 . . . . 0.0 114.18 166.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 55.4 t -46.89 131.3 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-O 124.624 2.155 . . . . 0.0 110.172 169.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . 0.404 ' C ' ' H ' ' B' ' 93' ' ' VAL 0.288 2.0 tp-100 -100.19 10.76 40.76 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 111.902 -2.408 . . . . 0.0 112.501 -120.021 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 6.7 p -67.32 42.39 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.71 1 C-N-CA 132.674 4.389 . . . . 0.0 110.853 166.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . 0.404 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.2 OUTLIER 56.73 9.24 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 C-N-CA 129.326 3.05 . . . . 0.0 116.247 177.767 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 7.3 tt 97.41 106.06 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 129.902 3.281 . . . . 0.0 104.415 -165.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.736 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 -177.098 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.561 ' HG ' HG11 ' B' ' 92' ' ' VAL . 0.7 OUTLIER . . . . . 0 N--CA 1.467 0.388 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.97 -60.3 3.5 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 118.249 -0.881 . . . . 0.0 112.43 -177.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.5 ptp85 -61.33 -35.41 77.31 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.658 1.117 . . . . 0.0 112.69 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -59.55 -63.11 1.42 Allowed 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.805 0.842 . . . . 0.0 110.793 174.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.83 -31.34 62.42 Favored Glycine 0 C--N 1.337 0.588 0 CA-C-O 118.222 -1.321 . . . . 0.0 112.388 -169.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.77 -8.1 32.86 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.032 1.916 . . . . 0.0 114.269 173.102 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.47 -6.23 14.47 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.153 1.381 . . . . 0.0 112.753 169.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.492 HD12 ' HA ' ' A' ' 18' ' ' LEU . 3.7 tp -96.07 -37.71 10.5 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.227 1.411 . . . . 0.0 110.381 176.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.61 34.69 0.33 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 128.149 2.58 . . . . 0.0 115.469 -172.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -103.0 165.76 13.06 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 129.785 3.234 . . . . 0.0 113.209 -168.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -69.57 -104.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.549 1.258 1 C-N-CA 126.206 4.604 . . . . 0.0 110.832 168.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -46.9 -37.99 9.77 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 127.346 2.259 . . . . 0.0 112.877 176.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.515 ' CD ' HD13 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -67.18 -32.7 73.95 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 117.964 -1.017 . . . . 0.0 113.505 -176.523 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 40.6 t -60.74 -52.14 66.36 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 119.041 0.837 . . . . 0.0 109.826 169.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 78.7 mtt-85 -52.61 -45.43 66.57 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.175 1.39 . . . . 0.0 113.239 175.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.8 mt -45.27 -63.94 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 C-N-CA 124.028 0.931 . . . . 0.0 110.887 169.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.9 mt -60.9 -42.23 97.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.774 -1.103 . . . . 0.0 112.462 -170.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -63.02 -25.61 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 CA-C-N 119.016 0.826 . . . . 0.0 112.354 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.448 ' HB1' ' CD2' ' A' ' 43' ' ' HIS . . . -89.2 -26.4 21.26 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.505 0.722 . . . . 0.0 112.867 175.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.31 -39.46 94.62 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.278 1.431 . . . . 0.0 112.639 -175.632 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 mt -41.13 -44.36 2.49 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 128.119 2.568 . . . . 0.0 111.809 173.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -112.59 11.63 19.68 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 126.966 2.106 . . . . 0.0 112.251 173.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.29 -4.91 19.94 Favored Glycine 0 N--CA 1.47 0.949 0 C-N-CA 127.61 2.528 . . . . 0.0 114.357 -170.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.6 m -40.95 67.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 C-N-CA 127.85 2.46 . . . . 0.0 117.344 166.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 52.0 m -133.25 -61.16 0.83 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.844 1.257 . . . . 0.0 114.168 -178.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -161.69 163.02 20.2 Favored Pre-proline 0 N--CA 1.479 0.993 0 CA-C-N 120.647 1.567 . . . . 0.0 115.143 -177.159 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -57.65 131.33 43.59 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.633 2.222 . . . . 0.0 108.159 168.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.87 1.72 59.69 Favored Glycine 0 CA--C 1.528 0.896 0 CA-C-O 116.993 -2.004 . . . . 0.0 114.928 -176.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -35.96 73.33 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 121.143 2.471 . . . . 0.0 110.766 170.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 mt -59.32 -20.9 58.3 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 125.838 1.655 . . . . 0.0 112.071 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.5 -35.09 76.7 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.931 -0.481 . . . . 0.0 111.833 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.71 -45.62 61.26 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.586 0.754 . . . . 0.0 111.18 171.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.448 ' CD2' ' HB1' ' A' ' 29' ' ' ALA . 5.4 m-70 -59.21 -37.39 77.34 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 177.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 21.0 mt -99.33 -16.47 18.44 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.441 1.096 . . . . 0.0 113.676 -173.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.68 8.02 71.05 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-N 119.105 0.866 . . . . 0.0 113.803 -170.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.7 mt -110.91 147.75 33.95 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.695 1.198 . . . . 0.0 111.276 -173.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.8 t -58.37 136.77 57.49 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.568 0.699 . . . . 0.0 112.089 -173.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 38.6 ptt180 -57.73 -33.66 68.68 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.428 1.091 . . . . 0.0 112.912 -176.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.8 m -61.88 -43.08 99.58 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.606 0.762 . . . . 0.0 111.509 174.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -80.08 -39.42 29.7 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 59.9 t -60.33 -38.63 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-N 119.521 1.055 . . . . 0.0 110.773 173.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 14.9 m -70.02 -21.11 63.23 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 177.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -57.01 -45.22 83.2 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-O 123.301 1.524 . . . . 0.0 110.806 174.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -69.94 -14.16 62.58 Favored 'General case' 0 CA--C 1.561 1.388 0 C-N-CA 125.857 1.663 . . . . 0.0 114.63 170.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 95.5 mt -81.11 -26.98 35.77 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 120.662 -1.274 . . . . 0.0 112.353 172.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.8 t -47.23 -50.89 20.19 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.204 0.911 . . . . 0.0 111.94 -178.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 41.5 t -86.8 -23.29 25.43 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 178.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.515 HD13 ' CD ' ' A' ' 23' ' ' ARG . 5.6 tp -58.49 -39.33 79.7 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 121.031 1.741 . . . . 0.0 111.199 171.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -77.88 -24.93 48.33 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.526 1.53 . . . . 0.0 112.021 176.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.55 -52.22 4.27 Favored Glycine 0 CA--C 1.534 1.264 0 C-N-CA 124.951 1.263 . . . . 0.0 113.462 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 17.5 m -64.75 -2.05 2.28 Favored 'General case' 0 CA--C 1.562 1.415 0 C-N-CA 125.903 1.681 . . . . 0.0 113.278 171.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.26 6.67 87.81 Favored Glycine 0 C--N 1.344 1.011 0 C-N-CA 124.987 1.279 . . . . 0.0 114.375 170.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.6 mt -66.68 -36.89 83.6 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 118.175 0.988 . . . . 0.0 111.818 -177.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.5 m -113.22 135.8 51.59 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.101 0 C-N-CA 125.881 1.672 . . . . 0.0 110.818 170.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 46.9 t -116.71 141.84 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 125.614 1.566 . . . . 0.0 108.784 176.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.11 142.32 49.16 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.753 0.821 . . . . 0.0 113.063 174.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.0 m -134.21 144.81 48.66 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 169.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -83.54 103.84 13.2 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 118.697 0.68 . . . . 0.0 109.536 168.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.269 1.3 pp20? -70.79 -161.11 0.05 OUTLIER 'General case' 0 CA--C 1.558 1.267 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 168.724 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -60.59 -28.32 67.54 Favored Glycine 0 CA--C 1.535 1.31 0 O-C-N 119.695 -1.878 . . . . 0.0 115.801 -169.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.0 tpt85 -158.03 14.5 0.21 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 174.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.29 174.0 11.28 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.618 1.567 . . . . 0.0 110.075 -177.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 9.1 p -87.49 139.16 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 167.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.25 165.41 16.24 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 125.334 1.453 . . . . 0.0 109.002 173.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -114.35 152.91 30.71 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 123.116 0.566 . . . . 0.0 109.735 170.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -144.38 143.32 30.88 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 125.777 1.631 . . . . 0.0 109.552 -177.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.01 143.28 22.36 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 168.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.12 -60.94 2.69 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.589 0.631 . . . . 0.0 112.479 -175.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -146.87 165.66 29.06 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.971 1.367 . . . . 0.0 112.02 -175.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -31.91 -36.29 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 130.736 3.614 . . . . 0.0 113.139 166.33 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -48.59 -66.26 0.43 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 127.208 2.203 . . . . 0.0 113.608 172.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 10.7 mt -70.24 -31.9 69.52 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 119.434 1.015 . . . . 0.0 110.179 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.49 -40.64 97.62 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.894 0.77 . . . . 0.0 111.123 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -68.99 -55.46 10.81 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 117.664 -1.16 . . . . 0.0 111.585 169.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.93 -31.6 72.72 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 120.64 1.564 . . . . 0.0 113.36 -172.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.5 tt -71.8 -54.76 9.17 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.765 0.826 . . . . 0.0 109.307 168.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.39 -24.48 75.01 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 124.708 1.147 . . . . 0.0 115.475 -167.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 -74.33 -25.17 59.38 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 126.713 2.005 . . . . 0.0 111.908 168.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.3 tp 76.73 108.71 0.08 Allowed 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 129.336 3.054 . . . . 0.0 110.553 -178.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.721 HG23 HG12 ' A' ' 92' ' ' VAL . 14.8 m -54.17 2.79 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 129.016 2.926 . . . . 0.0 117.099 -176.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 74.73 -5.3 2.16 Favored 'General case' 0 C--O 1.218 -0.577 0 O-C-N 120.21 -1.556 . . . . 0.0 113.217 162.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.721 HG12 HG23 ' A' ' 90' ' ' VAL . 7.4 p -64.88 43.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 127.951 2.501 . . . . 0.0 113.424 168.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER 59.55 10.34 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.887 0 C-N-CA 128.332 2.653 . . . . 0.0 113.882 174.318 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 18.9 tp 77.47 107.0 0.08 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 127.254 2.222 . . . . 0.0 107.639 -165.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.401 ' CB ' HD12 ' B' ' 11' ' ' LEU . . . -51.4 141.87 14.65 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.834 0.854 . . . . 0.0 112.872 172.534 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.4 m -149.92 165.01 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 127.693 2.397 . . . . 0.0 108.79 -176.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -75.2 26.97 0.09 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.707 2.403 . . . . 0.0 114.593 -172.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 18.2 p -114.46 44.54 1.7 Allowed 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.581 1.953 . . . . 0.0 109.967 168.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 16.4 p30 -68.59 38.93 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 129.232 3.013 . . . . 0.0 113.668 176.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.22 135.81 68.57 Favored Pre-proline 0 CA--C 1.556 1.198 0 C-N-CA 125.778 1.631 . . . . 0.0 110.788 172.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -75.58 -156.11 0.05 OUTLIER 'Trans proline' 0 CA--C 1.544 0.984 1 C-N-CA 126.155 4.57 . . . . 0.0 115.587 -164.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 16.5 t . . . . . 0 CA--C 1.556 1.18 0 C-N-CA 127.825 2.45 . . . . 0.0 114.341 -177.789 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.593 ' HG ' HG11 ' A' ' 92' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.465 0.279 0 CA-C-O 118.148 -0.93 . . . . 0.0 113.496 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.77 -61.08 2.53 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.923 -178.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 7.4 ptp85 -61.31 -33.3 73.35 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.613 1.097 . . . . 0.0 112.889 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.54 -65.87 0.62 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.605 0.762 . . . . 0.0 110.233 174.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.57 -28.37 69.53 Favored Glycine 0 C--O 1.22 -0.736 0 CA-C-O 117.288 -1.84 . . . . 0.0 112.395 -169.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.56 -13.03 61.7 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 120.926 2.363 . . . . 0.0 114.343 173.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -108.58 -8.29 15.52 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.438 1.495 . . . . 0.0 112.746 170.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . 0.453 HD12 ' HA ' ' B' ' 18' ' ' LEU . 4.7 tp -93.39 -37.13 12.15 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.848 1.259 . . . . 0.0 110.456 176.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.16 37.42 0.44 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 128.335 2.654 . . . . 0.0 115.324 -176.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . 0.409 ' CG ' ' HE ' ' B' ' 23' ' ' ARG . 0.2 OUTLIER -104.72 165.48 13.2 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 129.141 2.976 . . . . 0.0 112.045 -169.865 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.58 -105.8 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.355 1 C-N-CA 125.975 4.45 . . . . 0.0 111.011 169.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -45.89 -36.64 5.52 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 127.194 2.197 . . . . 0.0 113.516 175.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.419 ' CD ' HD13 ' B' ' 58' ' ' LEU . 0.0 OUTLIER -66.94 -33.56 75.85 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 -178.377 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 43.8 t -62.2 -49.34 76.17 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.1 0.864 . . . . 0.0 110.109 169.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 80.2 mtt-85 -53.26 -46.91 69.41 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.495 1.118 . . . . 0.0 113.119 174.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 3.5 mt -44.57 -63.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 123.975 0.91 . . . . 0.0 110.504 169.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.44 -39.46 93.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 117.917 -1.039 . . . . 0.0 113.128 -169.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -64.56 -25.23 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.294 0.952 . . . . 0.0 112.418 176.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . 0.431 ' HB1' ' CD2' ' B' ' 43' ' ' HIS . . . -89.59 -27.17 20.4 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 174.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.3 -39.6 91.08 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.892 1.277 . . . . 0.0 112.872 -175.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -43.79 -45.51 7.32 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 128.709 2.804 . . . . 0.0 112.116 176.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -108.76 9.56 26.9 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 127.614 2.365 . . . . 0.0 111.569 175.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.19 -33.53 3.67 Favored Glycine 0 C--O 1.222 -0.626 0 CA-C-O 117.015 -1.992 . . . . 0.0 114.395 -169.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . 0.515 HG12 ' HA ' ' B' ' 76' ' ' ALA . 34.3 m -10.88 51.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 N-CA-C 121.787 3.995 . . . . 0.0 121.787 170.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 35.8 m -119.94 -60.51 1.7 Allowed 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.189 -1.569 . . . . 0.0 112.532 -176.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -162.58 165.4 15.37 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 -174.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -58.06 128.82 30.26 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 122.564 2.176 . . . . 0.0 107.879 167.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.13 2.65 73.21 Favored Glycine 0 CA--C 1.528 0.875 0 CA-C-O 116.912 -2.049 . . . . 0.0 114.895 -176.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -39.08 80.58 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 121.44 2.62 . . . . 0.0 110.255 169.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 9.7 mt -58.85 -20.86 54.66 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 126.193 1.797 . . . . 0.0 112.561 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.9 -35.56 80.46 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.703 0.401 . . . . 0.0 111.593 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.95 -46.72 64.67 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.243 0.617 . . . . 0.0 111.15 170.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . 0.431 ' CD2' ' HB1' ' B' ' 29' ' ' ALA . 4.7 m-70 -58.27 -38.59 77.26 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 114.128 1.158 . . . . 0.0 114.128 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 27.8 mt -97.13 -16.55 20.41 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.4 1.08 . . . . 0.0 113.545 -173.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.07 5.14 64.81 Favored Glycine 0 CA--C 1.537 1.445 0 CA-C-N 119.249 0.931 . . . . 0.0 113.931 -169.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 96.5 mt -108.33 146.11 33.45 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.926 1.29 . . . . 0.0 111.251 -173.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 10.3 t -57.83 139.16 54.75 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.485 0.66 . . . . 0.0 112.448 -173.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -58.6 -32.19 68.76 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.208 1.003 . . . . 0.0 112.911 -176.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 4.1 m -62.26 -44.8 95.72 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.636 0.653 . . . . 0.0 111.862 173.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -77.79 -39.99 42.11 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -178.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 61.2 t -60.46 -38.44 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 118.992 0.815 . . . . 0.0 110.695 173.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 18.4 m -69.21 -24.2 63.99 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 177.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -56.09 -43.95 78.53 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 122.916 1.341 . . . . 0.0 111.232 173.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 -74.11 -17.26 60.96 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 125.11 1.364 . . . . 0.0 114.525 170.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 96.0 mt -76.65 -28.99 56.23 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 120.394 1.452 . . . . 0.0 112.297 169.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 7.6 t -46.67 -56.19 6.53 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.95 0.796 . . . . 0.0 111.901 -179.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 52.7 t -78.4 -28.98 47.02 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 118.321 -0.847 . . . . 0.0 113.262 177.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . 0.419 HD13 ' CD ' ' B' ' 23' ' ' ARG . 6.4 tp -52.2 -41.03 62.34 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 120.84 1.654 . . . . 0.0 111.461 175.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 30.4 mtm180 -81.94 -21.64 37.16 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.283 1.433 . . . . 0.0 112.521 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.71 -39.96 11.4 Favored Glycine 0 N--CA 1.477 1.402 0 C-N-CA 124.969 1.271 . . . . 0.0 113.024 174.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 20.9 m -72.12 -11.79 60.91 Favored 'General case' 0 CA--C 1.561 1.371 0 C-N-CA 126.185 1.794 . . . . 0.0 111.883 169.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.96 11.8 85.04 Favored Glycine 0 N--CA 1.472 1.085 0 C-N-CA 124.818 1.199 . . . . 0.0 114.593 169.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 20.7 mt -67.71 -33.87 75.75 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.991 1.316 . . . . 0.0 111.492 -178.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -112.02 145.43 18.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 C-N-CA 127.865 2.466 . . . . 0.0 110.314 170.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.07 143.94 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.902 1.281 . . . . 0.0 110.796 177.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.09 136.67 52.62 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.015 0.926 . . . . 0.0 112.293 171.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 2.8 m -134.28 144.63 48.45 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 106.02 -1.845 . . . . 0.0 106.02 168.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -82.14 103.82 12.03 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.948 0.795 . . . . 0.0 110.13 169.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.27 1.1 pp20? -71.65 -160.49 0.06 Allowed 'General case' 0 CA--C 1.559 1.298 0 CA-C-N 118.249 0.477 . . . . 0.0 111.83 168.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -60.48 -27.54 66.03 Favored Glycine 0 CA--C 1.536 1.373 0 O-C-N 119.53 -1.982 . . . . 0.0 115.607 -169.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 3.4 tpt85 -157.93 11.44 0.19 Allowed 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 174.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.24 176.83 8.68 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.734 1.613 . . . . 0.0 110.724 -177.021 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 7.1 p -90.15 134.45 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 168.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.18 161.99 17.67 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.098 1.759 . . . . 0.0 110.184 174.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -117.29 118.71 33.02 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 121.853 -0.529 . . . . 0.0 110.306 175.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . 0.515 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -106.3 149.04 27.31 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.674 1.59 . . . . 0.0 110.724 177.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 tp -58.23 151.86 18.43 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 166.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.14 -66.76 0.47 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.926 0.87 . . . . 0.0 112.923 -174.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -142.07 163.4 32.97 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.953 1.359 . . . . 0.0 111.049 -178.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -32.51 -35.2 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 130.681 3.592 . . . . 0.0 113.159 166.587 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -48.54 -69.77 0.11 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.312 2.245 . . . . 0.0 113.56 170.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.92 -32.35 74.02 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 120.097 1.317 . . . . 0.0 110.266 179.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.08 -41.97 98.73 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.782 0.719 . . . . 0.0 110.896 -177.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 19.0 tpp85 -68.27 -54.17 19.45 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.628 1.171 . . . . 0.0 111.863 171.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.02 -33.78 75.0 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 120.325 1.421 . . . . 0.0 113.347 -173.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 4.7 tt -70.12 -54.49 12.76 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.613 0.765 . . . . 0.0 109.522 168.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.68 -25.12 75.88 Favored Glycine 0 CA--C 1.54 1.609 0 C-N-CA 124.982 1.277 . . . . 0.0 115.282 -167.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -70.78 -29.25 65.4 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 126.461 1.904 . . . . 0.0 111.07 167.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 20.6 tp 81.46 121.21 0.05 OUTLIER 'General case' 0 C--N 1.341 0.222 0 C-N-CA 130.147 3.379 . . . . 0.0 109.581 -172.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . 0.747 HG23 HG12 ' B' ' 92' ' ' VAL . 12.0 m -62.01 3.72 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.242 0 C-N-CA 125.208 1.403 . . . . 0.0 114.739 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 71.75 -9.79 0.92 Allowed 'General case' 0 C--O 1.217 -0.612 0 C-N-CA 125.404 1.482 . . . . 0.0 114.605 165.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.747 HG12 HG23 ' B' ' 90' ' ' VAL . 7.9 p -59.39 45.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 C-N-CA 129.35 3.06 . . . . 0.0 115.242 171.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.3 t 63.29 5.97 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 128.865 2.866 . . . . 0.0 113.742 173.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 18.6 tp 80.66 109.38 0.07 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 127.608 2.363 . . . . 0.0 106.308 -164.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . 0.4 ' CB ' HD12 ' A' ' 11' ' ' LEU . . . . . . . . 0 CA--C 1.545 0.76 0 C-N-CA 123.506 0.722 . . . . 0.0 112.863 171.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.471 0.596 0 CA-C-O 117.672 -1.156 . . . . 0.0 113.158 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.6 -58.19 7.03 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 120.72 1.6 . . . . 0.0 111.711 176.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -54.73 -40.09 68.9 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.076 1.35 . . . . 0.0 112.856 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -75.34 -53.89 7.99 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.823 1.249 . . . . 0.0 111.55 177.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.18 -17.98 70.64 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-O 118.103 -1.387 . . . . 0.0 112.895 -175.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 66.2 mtt-85 -56.92 -19.59 18.68 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 119.844 1.822 . . . . 0.0 113.45 168.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.18 -6.53 15.54 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.576 1.151 . . . . 0.0 114.051 169.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.6 tp -101.34 -32.11 10.63 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.728 1.149 . . . . 0.0 111.638 -175.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -87.0 65.8 9.13 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 127.503 2.321 . . . . 0.0 111.133 -178.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -138.07 167.73 18.93 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 125.769 1.628 . . . . 0.0 110.541 -174.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -66.31 -103.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.553 1.432 1 C-N-CA 125.622 4.215 . . . . 0.0 111.059 169.037 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.0 p -37.56 -45.89 0.79 Allowed 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 128.347 2.659 . . . . 0.0 113.175 169.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.55 ' HG2' HD13 ' A' ' 58' ' ' LEU . 5.1 ttm180 -62.83 -42.45 99.74 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.108 0.867 . . . . 0.0 111.621 -171.579 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 19.5 t -58.27 -53.5 57.6 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 118.324 0.511 . . . . 0.0 110.385 168.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 -53.84 -36.38 62.5 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 178.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.457 HG13 ' HA ' ' A' ' 23' ' ' ARG . 1.5 mt -48.75 -58.43 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 CA-C-N 119.593 1.088 . . . . 0.0 109.039 170.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 79.0 mt -66.21 -37.45 85.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.435 -171.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.442 HG12 HD21 ' A' ' 86' ' ' LEU . 0.9 OUTLIER -69.33 -31.9 51.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 122.719 0.407 . . . . 0.0 111.934 177.513 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.02 -30.47 31.47 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.356 1.062 . . . . 0.0 112.709 177.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.42 ' O ' HG13 ' A' ' 34' ' ' VAL . 1.0 OUTLIER -65.47 -35.51 81.13 Favored 'General case' 0 C--O 1.224 -0.243 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 177.911 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.3 mt -46.18 -21.59 0.17 Allowed 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 117.3 -1.333 . . . . 0.0 114.55 169.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -122.38 -35.04 3.18 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 126.392 1.877 . . . . 0.0 113.815 178.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.9 -76.54 0.94 Allowed Glycine 0 N--CA 1.475 1.253 0 C-N-CA 127.043 2.259 . . . . 0.0 113.172 -170.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.42 HG13 ' O ' ' A' ' 30' ' ' LEU . 1.4 m 45.44 31.29 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 C-N-CA 125.283 1.433 . . . . 0.0 114.82 178.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 32.8 m -88.16 -79.3 0.3 Allowed 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.141 0.976 . . . . 0.0 112.888 -178.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.476 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 2.5 m-85 -140.54 154.86 69.74 Favored Pre-proline 0 N--CA 1.478 0.961 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -168.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -66.41 16.05 0.11 Allowed 'Trans proline' 0 CA--C 1.55 1.322 0 C-N-CA 124.668 3.579 . . . . 0.0 115.068 171.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -124.21 -10.37 5.16 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 125.885 1.707 . . . . 0.0 113.688 168.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.476 ' HG2' ' H ' ' A' ' 36' ' ' TYR . 0.0 OUTLIER -71.59 -39.75 70.33 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.695 1.747 . . . . 0.0 111.115 -174.301 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.7 mt -57.18 -19.2 19.21 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 123.925 0.89 . . . . 0.0 112.915 173.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.19 -30.99 71.94 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 120.019 1.281 . . . . 0.0 112.036 -179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.81 -49.96 11.22 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.565 0.746 . . . . 0.0 111.304 173.114 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -53.89 -31.11 48.79 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.409 HD11 HG12 ' A' ' 26' ' ' ILE . 60.0 mt -102.52 -7.6 21.74 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.848 1.659 . . . . 0.0 112.995 -177.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.27 0.72 8.17 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.272 1.415 . . . . 0.0 114.069 -173.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.5 mp -110.76 144.21 40.08 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 124.334 1.054 . . . . 0.0 111.864 -169.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.9 t -59.42 149.22 29.99 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 121.932 0.873 . . . . 0.0 111.205 177.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -63.42 -16.24 59.96 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.966 1.098 . . . . 0.0 113.966 -170.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.8 p -71.34 -48.3 51.18 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.065 1.302 . . . . 0.0 112.043 168.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -60.67 -43.1 98.06 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.219 0.918 . . . . 0.0 111.48 172.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 69.6 t -62.84 -40.95 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 O-C-N 121.827 -0.546 . . . . 0.0 111.34 176.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 73.8 m -62.14 -36.93 83.3 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 178.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -56.39 -41.54 76.45 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.138 0.575 . . . . 0.0 111.778 172.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -73.66 -35.23 65.22 Favored 'General case' 0 CA--C 1.558 1.288 0 O-C-N 121.264 -0.897 . . . . 0.0 112.805 174.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.1 mt -69.88 -37.02 75.91 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 120.607 1.549 . . . . 0.0 114.127 176.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 38.9 m -54.61 -39.72 68.17 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.926 1.239 . . . . 0.0 113.094 -177.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 9.0 t -67.63 -43.53 80.16 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 118.578 0.626 . . . . 0.0 112.021 175.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.55 HD13 ' HG2' ' A' ' 23' ' ' ARG . 3.3 tp -61.96 -37.33 84.35 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 127.94 2.496 . . . . 0.0 112.823 -175.706 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.0 mtm105 -82.35 2.45 32.25 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.34 1.856 . . . . 0.0 112.721 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -112.63 -45.16 0.79 Allowed Glycine 0 N--CA 1.475 1.241 0 C-N-CA 126.582 2.039 . . . . 0.0 112.352 173.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 98.6 m -66.01 3.31 0.86 Allowed 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 127.2 2.2 . . . . 0.0 113.751 171.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 58.21 35.89 79.99 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 125.625 1.583 . . . . 0.0 113.687 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.6 mt -86.56 -29.07 22.92 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.563 1.145 . . . . 0.0 112.698 173.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.1 m -140.17 143.84 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 125.39 1.476 . . . . 0.0 112.115 -175.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.4 t -131.12 142.81 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 125.98 1.712 . . . . 0.0 110.236 -174.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.08 158.35 35.88 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.475 1.91 . . . . 0.0 113.961 176.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.3 m -156.67 174.71 15.05 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 168.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -111.07 119.34 38.7 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.481 0.712 . . . . 0.0 110.519 169.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -77.42 -157.32 0.09 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.248 0.619 . . . . 0.0 110.767 167.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.86 -24.9 68.74 Favored Glycine 0 CA--C 1.537 1.465 0 O-C-N 119.479 -2.013 . . . . 0.0 115.819 -171.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -157.18 2.0 0.12 Allowed 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.298 1.549 . . . . 0.0 114.861 172.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -125.39 164.23 20.87 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 126.017 1.727 . . . . 0.0 109.584 -179.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 30.7 m -79.21 150.75 5.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 166.238 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -125.57 179.86 4.95 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.411 1.485 . . . . 0.0 110.205 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.412 ' O ' HG12 ' A' ' 34' ' ' VAL . 35.4 m-85 -142.87 132.06 23.24 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 124.443 1.097 . . . . 0.0 110.849 174.392 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.78 162.01 29.42 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.793 2.037 . . . . 0.0 110.079 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.0 mp -57.47 149.52 20.77 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 119.026 0.83 . . . . 0.0 110.293 169.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.5 -21.03 66.18 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 114.684 1.364 . . . . 0.0 114.684 -172.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -170.92 173.44 5.16 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 122.416 1.103 . . . . 0.0 113.223 168.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 52.9 p -40.5 -31.3 0.14 Allowed 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 128.958 2.903 . . . . 0.0 112.284 165.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -44.16 -76.27 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 127.379 2.272 . . . . 0.0 112.762 168.047 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.665 ' H ' HD22 ' A' ' 82' ' ' LEU . 0.0 OUTLIER -71.17 -28.69 64.43 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -171.635 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.5 -45.51 93.9 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.125 0.97 . . . . 0.0 111.586 177.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . 0.281 3.1 ppt_? -72.66 -46.12 55.51 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.618 177.112 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.09 -42.51 90.64 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 179.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.442 HD21 HG12 ' A' ' 28' ' ' VAL . 3.1 tt -73.54 -43.46 59.87 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.534 -0.729 . . . . 0.0 110.408 175.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.88 -35.92 57.94 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.261 0.934 . . . . 0.0 113.753 -172.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -78.21 -3.56 43.29 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.858 1.263 . . . . 0.0 112.353 169.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 54.8 tp 67.48 107.73 0.04 OUTLIER 'General case' 0 C--N 1.342 0.275 0 C-N-CA 129.028 2.931 . . . . 0.0 111.579 169.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.7 m -66.59 23.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 125.999 1.72 . . . . 0.0 114.424 178.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.406 ' C ' ' H ' ' A' ' 93' ' ' VAL . 28.1 mm-40 83.07 -13.93 0.77 Allowed 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.399 -1.438 . . . . 0.0 112.116 152.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 14.4 p -54.77 32.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.525 1 C-N-CA 133.166 4.587 . . . . 0.0 116.475 169.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.406 ' H ' ' C ' ' A' ' 91' ' ' GLN . 2.1 t 58.48 31.32 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 128.193 2.597 . . . . 0.0 111.533 168.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 79.37 113.87 0.07 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 127.589 2.356 . . . . 0.0 105.715 -165.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.51 64.68 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 127.201 2.2 . . . . 0.0 114.803 -179.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -51.57 161.16 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 127.631 2.372 . . . . 0.0 113.008 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.03 16.67 7.93 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 128.542 2.737 . . . . 0.0 114.422 -172.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 10.2 p -86.98 150.19 24.24 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.229 1.411 . . . . 0.0 112.402 176.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -140.7 139.99 34.83 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.904 1.682 . . . . 0.0 110.623 176.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -163.05 158.61 18.4 Favored Pre-proline 0 CA--C 1.541 0.609 0 O-C-N 120.32 -1.488 . . . . 0.0 111.727 -166.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -73.6 174.66 11.86 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 122.478 2.118 . . . . 0.0 108.275 165.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 48.9 t . . . . . 0 CA--C 1.543 0.692 0 CA-C-O 123.182 1.468 . . . . 0.0 114.033 -171.731 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.467 0.39 0 CA-C-O 117.479 -1.248 . . . . 0.0 113.437 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.24 -57.73 9.5 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.858 1.663 . . . . 0.0 111.425 174.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 13.9 mtp85 -54.46 -38.96 66.97 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.173 1.389 . . . . 0.0 112.398 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -76.22 -54.01 7.42 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.319 1.448 . . . . 0.0 112.497 177.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -73.42 -14.75 79.24 Favored Glycine 0 CA--C 1.53 1.009 0 CA-C-O 117.907 -1.496 . . . . 0.0 112.704 -174.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 62.1 mtt-85 -57.9 -12.79 3.5 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 119.947 1.873 . . . . 0.0 113.658 168.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -122.41 -1.44 9.12 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.026 1.73 . . . . 0.0 113.978 170.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 3.9 tp -106.91 -30.3 8.95 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.615 1.098 . . . . 0.0 111.566 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.22 66.61 9.81 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.405 2.282 . . . . 0.0 110.331 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . 0.484 ' CB ' ' HB3' ' B' ' 23' ' ' ARG . 0.3 OUTLIER -138.61 162.93 50.34 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 125.724 1.61 . . . . 0.0 111.343 -171.851 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -69.65 -100.54 0.01 OUTLIER 'Trans proline' 0 CA--C 1.551 1.337 0 C-N-CA 125.184 3.922 . . . . 0.0 109.584 169.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 22.7 p -36.74 -46.4 0.6 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 129.028 2.931 . . . . 0.0 113.458 168.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.484 ' HB3' ' CB ' ' B' ' 20' ' ' ASP . 7.4 ttm180 -70.9 -37.06 72.95 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.582 1.083 . . . . 0.0 112.947 -171.109 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 12.1 t -60.03 -52.47 65.24 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.853 0.835 . . . . 0.0 109.254 167.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 3.9 mmt85 -55.65 -36.75 67.39 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 177.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . 0.608 HG12 HD11 ' B' ' 44' ' ' LEU . 1.7 mt -49.9 -60.1 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 CA-C-N 119.756 1.162 . . . . 0.0 108.945 171.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 87.9 mt -63.78 -38.8 92.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 118.144 -0.932 . . . . 0.0 111.748 -173.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . 0.475 HG12 HD21 ' B' ' 86' ' ' LEU . 1.0 OUTLIER -68.93 -33.72 60.54 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-N 119.149 0.886 . . . . 0.0 111.881 177.659 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.44 -23.99 27.64 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.664 0.786 . . . . 0.0 113.028 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.406 ' O ' HG13 ' B' ' 34' ' ' VAL . 0.9 OUTLIER -63.06 -45.05 94.02 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 117.749 -1.12 . . . . 0.0 112.27 171.819 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -42.61 -43.16 3.68 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.719 2.408 . . . . 0.0 113.573 -174.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -100.47 -31.85 11.09 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.104 1.762 . . . . 0.0 112.67 177.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.04 -61.03 2.17 Favored Glycine 0 C--N 1.343 0.937 0 C-N-CA 124.542 1.068 . . . . 0.0 113.933 -171.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . 0.46 HG12 ' O ' ' B' ' 75' ' ' TYR . 0.2 OUTLIER 30.91 46.59 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 C-N-CA 127.598 2.359 . . . . 0.0 115.192 178.974 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 3.3 m -107.73 -67.91 0.93 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.665 1.586 . . . . 0.0 112.777 -176.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -143.17 152.77 58.77 Favored Pre-proline 0 N--CA 1.476 0.839 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -167.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -68.27 8.93 0.44 Allowed 'Trans proline' 0 CA--C 1.55 1.289 0 C-N-CA 124.689 3.593 . . . . 0.0 113.764 168.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -122.43 -10.18 6.17 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 125.811 1.672 . . . . 0.0 113.754 168.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.51 -40.11 80.98 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 119.717 1.758 . . . . 0.0 110.331 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 47.7 mt -63.14 -11.34 19.64 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 124.05 0.94 . . . . 0.0 112.355 -179.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -73.2 -33.69 65.53 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 119.743 -0.783 . . . . 0.0 111.003 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.56 -53.46 10.48 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.173 0.989 . . . . 0.0 110.34 169.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -52.62 -30.86 33.69 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 -178.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.678 HD12 HG22 ' B' ' 51' ' ' VAL . 65.5 mt -102.4 -18.78 15.22 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.319 1.447 . . . . 0.0 113.349 -178.024 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.51 -1.54 56.92 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.555 1.074 . . . . 0.0 113.854 -170.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 8.5 mp -110.95 146.94 35.71 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 119.222 1.511 . . . . 0.0 112.313 -174.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 8.9 t -56.37 150.52 14.68 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 122.291 1.043 . . . . 0.0 112.383 176.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -63.98 -14.18 52.05 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -171.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 13.5 p -72.66 -44.01 62.39 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 120.144 1.338 . . . . 0.0 112.235 169.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -61.27 -44.7 96.8 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.673 0.669 . . . . 0.0 111.506 170.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . 0.678 HG22 HD12 ' B' ' 44' ' ' LEU . 52.6 t -57.73 -47.54 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.831 174.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 75.5 m -59.53 -40.3 86.72 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.86 0.864 . . . . 0.0 113.155 -177.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -54.32 -46.26 72.81 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.921 0.888 . . . . 0.0 112.086 171.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -73.67 -28.22 61.64 Favored 'General case' 0 CA--C 1.558 1.27 0 O-C-N 121.141 -0.974 . . . . 0.0 112.682 176.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 45.3 mt -73.66 -33.98 64.72 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 120.864 1.665 . . . . 0.0 113.613 174.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 33.6 m -52.78 -40.67 63.39 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.447 1.022 . . . . 0.0 113.461 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.2 t -70.16 -39.64 75.22 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.208 0.913 . . . . 0.0 112.329 177.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 2.3 tp -60.95 -47.47 86.27 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 128.071 2.548 . . . . 0.0 111.688 -174.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 33.1 mtm105 -80.17 4.75 16.42 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.827 1.651 . . . . 0.0 112.214 177.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -106.22 -47.62 1.06 Allowed Glycine 0 CA--C 1.532 1.112 0 C-N-CA 125.958 1.742 . . . . 0.0 112.02 169.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 92.8 m -76.56 13.74 0.92 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 126.514 1.925 . . . . 0.0 114.431 177.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.03 29.06 69.92 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 125.731 1.634 . . . . 0.0 114.418 174.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 24.9 mt -80.78 -26.49 37.17 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.377 -1.072 . . . . 0.0 112.943 176.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.5 m -147.17 152.3 13.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 126.152 1.781 . . . . 0.0 112.572 -171.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -130.13 158.12 42.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.783 1.633 . . . . 0.0 111.187 173.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.53 161.08 30.1 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.04 1.336 . . . . 0.0 112.267 167.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.401 HG22 ' H ' ' B' ' 68' ' ' TYR . 1.1 m -156.56 176.71 12.35 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.583 1.553 . . . . 0.0 107.046 168.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.401 ' H ' HG22 ' B' ' 67' ' ' THR . 38.6 t80 -117.52 118.88 33.36 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.928 0.891 . . . . 0.0 111.344 172.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.25 1.2 pp20? -77.32 -151.96 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.457 0.703 . . . . 0.0 111.233 167.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -66.98 -24.79 73.2 Favored Glycine 0 CA--C 1.54 1.594 0 O-C-N 119.572 -1.955 . . . . 0.0 116.035 -173.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 5.4 ttp85 -158.71 0.32 0.09 Allowed 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 119.263 1.532 . . . . 0.0 114.528 174.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -124.98 162.93 23.43 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 126.11 1.764 . . . . 0.0 109.327 -178.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 20.8 m -80.29 152.44 4.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 O-C-N 121.709 -0.619 . . . . 0.0 109.415 165.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 8.0 ptt180 -124.62 172.47 9.22 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.263 1.425 . . . . 0.0 110.331 174.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.46 ' O ' HG12 ' B' ' 34' ' ' VAL . 28.3 m-85 -120.7 143.79 48.56 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.321 1.048 . . . . 0.0 110.027 167.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -142.02 149.45 40.0 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.566 1.546 . . . . 0.0 110.566 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 6.1 mp -52.93 146.78 10.25 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 119.216 0.916 . . . . 0.0 109.138 169.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.17 -16.22 63.27 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -172.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -169.91 172.4 6.63 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 123.055 1.407 . . . . 0.0 112.51 171.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 86.4 p -49.73 -26.13 3.55 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.408 2.283 . . . . 0.0 111.282 163.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 8.5 t60 -60.26 -58.06 10.11 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 128.298 2.639 . . . . 0.0 112.032 179.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.11 -33.15 71.49 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 120.579 1.536 . . . . 0.0 110.25 174.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.13 -37.41 82.74 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.949 0.9 . . . . 0.0 112.318 -176.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.26 -44.02 63.45 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-O 117.506 -1.235 . . . . 0.0 111.683 174.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.09 -43.72 95.32 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 120.017 1.281 . . . . 0.0 113.518 177.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.475 HD21 HG12 ' B' ' 28' ' ' VAL . 5.0 tt -67.02 -49.78 64.18 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.084 0.954 . . . . 0.0 110.312 174.059 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.81 -33.04 47.78 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.84 1.21 . . . . 0.0 114.623 -167.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -74.11 -10.96 60.14 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 118.958 1.379 . . . . 0.0 112.201 169.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 57.9 tp 69.66 110.3 0.05 Allowed 'General case' 0 C--O 1.235 0.303 0 C-N-CA 129.59 3.156 . . . . 0.0 110.939 171.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 21.0 m -66.32 23.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 C-N-CA 126.295 1.838 . . . . 0.0 114.286 177.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . 0.426 ' C ' ' H ' ' B' ' 93' ' ' VAL . 24.6 mm-40 78.22 -9.63 1.48 Allowed 'General case' 0 C--N 1.327 -0.402 0 O-C-N 120.43 -1.419 . . . . 0.0 113.166 156.323 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 11.2 p -54.22 26.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.25 1 C-N-CA 132.226 4.21 . . . . 0.0 115.993 167.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . 0.426 ' H ' ' C ' ' B' ' 91' ' ' GLN . 1.8 t 60.29 31.71 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 127.044 2.138 . . . . 0.0 111.589 167.52 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 80.86 112.33 0.07 Allowed 'General case' 0 C--N 1.347 0.485 0 C-N-CA 127.697 2.399 . . . . 0.0 106.338 -167.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.554 1.105 0 C-N-CA 128.38 2.672 . . . . 0.0 114.861 176.422 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 C--O 1.223 -0.313 0 CA-C-O 117.287 -1.34 . . . . 0.0 113.568 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.72 -37.99 63.87 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 121.611 2.005 . . . . 0.0 113.663 -172.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.551 HH21 ' HB3' ' A' ' 61' ' ' CYS . 0.0 OUTLIER -53.68 -23.26 10.87 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.645 0.979 . . . . 0.0 113.645 177.599 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.416 ' HG ' HG23 ' B' ' 92' ' ' VAL . 3.1 tm? -56.14 -41.82 75.96 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.29 1.836 . . . . 0.0 111.92 174.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.38 -35.8 92.54 Favored Glycine 0 CA--C 1.53 0.993 0 CA-C-N 120.388 1.449 . . . . 0.0 112.114 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.66 -45.71 61.17 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.803 0.841 . . . . 0.0 110.986 170.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.92 -24.17 67.63 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.728 1.149 . . . . 0.0 112.862 -178.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.7 mp -82.26 -28.39 31.85 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.014 0.825 . . . . 0.0 112.712 169.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -87.91 67.23 8.98 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.559 1.944 . . . . 0.0 112.831 173.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.536 ' HB3' HH11 ' A' ' 23' ' ' ARG . 31.3 t70 -143.55 135.86 13.33 Favored Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 128.241 2.616 . . . . 0.0 107.353 -176.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -52.68 -102.74 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.902 1 C-N-CA 127.26 5.307 . . . . 0.0 116.722 -163.677 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.4 m -56.0 -30.72 62.25 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.573 1.149 . . . . 0.0 110.511 -177.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.607 HH21 HD12 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -50.33 -42.08 52.26 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 172.717 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 36.8 t -58.7 -43.48 90.07 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.314 -0.866 . . . . 0.0 111.346 175.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.5 tpt180 -63.67 -29.47 70.7 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 118.051 -0.976 . . . . 0.0 112.118 174.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.491 HG13 ' HA ' ' A' ' 23' ' ' ARG . 1.6 mt -62.56 -53.57 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 120.756 1.616 . . . . 0.0 110.999 167.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.607 HD12 HH21 ' A' ' 23' ' ' ARG . 8.5 mt -60.17 -39.47 86.54 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 117.704 -1.141 . . . . 0.0 112.608 -177.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -68.73 -27.35 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 CA-C-N 120.292 1.406 . . . . 0.0 112.825 175.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.432 ' HB1' ' CD2' ' A' ' 43' ' ' HIS . . . -82.25 1.5 36.36 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 126.167 1.787 . . . . 0.0 114.222 169.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.64 -20.0 14.59 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 120.651 -1.281 . . . . 0.0 111.853 168.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.2 mt -66.79 -44.64 80.75 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.375 1.47 . . . . 0.0 109.218 165.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -132.49 95.94 3.73 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.666 1.986 . . . . 0.0 110.99 168.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -179.22 -83.48 0.06 OUTLIER Glycine 0 N--CA 1.468 0.769 0 C-N-CA 125.999 1.761 . . . . 0.0 110.592 171.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 19.5 m 43.06 25.37 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 116.881 2.178 . . . . 0.0 116.881 171.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 99.1 m -83.61 -76.48 0.29 Allowed 'General case' 0 C--O 1.223 -0.307 0 O-C-N 121.047 -1.033 . . . . 0.0 109.919 178.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.417 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 0.2 OUTLIER -139.38 159.71 64.84 Favored Pre-proline 0 CA--C 1.54 0.578 0 CA-C-O 118.549 -0.739 . . . . 0.0 112.902 -170.532 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -57.27 -18.8 31.81 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.183 2.588 . . . . 0.0 114.819 175.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -97.18 -6.48 57.74 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 118.175 -1.347 . . . . 0.0 115.766 172.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.417 ' HG2' ' H ' ' A' ' 36' ' ' TYR . 0.0 OUTLIER -70.37 -28.7 65.31 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.43 2.115 . . . . 0.0 113.143 -170.429 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 23.4 mt -63.75 -18.67 64.29 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 123.839 0.856 . . . . 0.0 111.717 178.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.24 -45.03 68.58 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.273 0.629 . . . . 0.0 111.496 177.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.46 -41.02 69.92 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.786 0.834 . . . . 0.0 112.151 176.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.432 ' CD2' ' HB1' ' A' ' 29' ' ' ALA . 14.0 m-70 -64.04 -21.37 66.48 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.903 1.446 . . . . 0.0 114.903 176.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 86.8 mt -115.32 -15.59 11.56 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.803 1.641 . . . . 0.0 114.029 -172.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.7 4.14 57.0 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.021 0.82 . . . . 0.0 113.405 -170.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 71.9 mt -102.31 172.86 6.64 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.814 1.246 . . . . 0.0 111.286 -176.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.1 p -86.27 158.34 19.72 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.503 -0.748 . . . . 0.0 110.065 175.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -61.92 -21.33 64.66 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 174.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.0 p -73.52 -52.58 13.05 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.078 -1.013 . . . . 0.0 109.712 168.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -69.77 -30.05 67.53 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.009 0.924 . . . . 0.0 112.505 -173.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 80.0 t -67.25 -30.26 48.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 O-C-N 120.681 -1.262 . . . . 0.0 111.769 167.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 74.3 m -70.52 -16.11 62.85 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.607 -1.308 . . . . 0.0 114.091 -175.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -54.2 -58.95 5.44 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.761 0.824 . . . . 0.0 110.635 169.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -77.02 -14.81 59.79 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-O 117.837 -1.078 . . . . 0.0 113.78 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 92.9 mt -70.81 -26.99 63.56 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 121.241 1.837 . . . . 0.0 111.668 169.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 65.1 p -59.26 -47.32 85.79 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 -175.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.9 t -72.97 -38.12 66.83 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.766 0.712 . . . . 0.0 111.829 172.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.5 tp -51.1 -48.86 61.58 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.202 1.001 . . . . 0.0 112.397 176.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.478 ' HG2' HG23 ' A' ' 64' ' ' VAL . 43.8 mtm180 -88.96 -5.54 57.89 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.627 1.571 . . . . 0.0 113.56 -176.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -100.9 -41.48 2.65 Favored Glycine 0 N--CA 1.474 1.2 0 C-N-CA 125.538 1.542 . . . . 0.0 112.811 175.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.551 ' HB3' HH21 ' A' ' 13' ' ' ARG . 3.8 m -77.44 8.73 3.87 Favored 'General case' 0 CA--C 1.552 1.051 0 O-C-N 120.832 -1.393 . . . . 0.0 113.297 169.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 58.41 34.65 75.92 Favored Glycine 0 CA--C 1.533 1.191 0 O-C-N 120.904 -1.123 . . . . 0.0 114.045 176.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 26.2 mt -82.38 -25.88 33.38 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.275 1.538 . . . . 0.0 111.989 171.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.478 HG23 ' HG2' ' A' ' 59' ' ' ARG . 2.5 m -133.98 149.3 30.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 127.34 2.256 . . . . 0.0 109.366 176.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.6 t -129.08 135.82 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 C-N-CA 124.995 1.318 . . . . 0.0 109.883 -176.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.72 148.23 44.87 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.671 1.189 . . . . 0.0 112.863 171.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 34.2 m -160.0 162.77 34.37 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.498 1.919 . . . . 0.0 106.584 -178.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -87.65 138.74 31.2 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.136 1.334 . . . . 0.0 110.917 169.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.98 -20.2 39.01 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 118.318 0.508 . . . . 0.0 112.239 169.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 139.76 -47.31 0.9 Allowed Glycine 0 CA--C 1.528 0.906 0 C-N-CA 126.009 1.766 . . . . 0.0 112.237 175.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 19.8 ttp180 -101.0 -29.67 12.05 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.562 1.945 . . . . 0.0 112.027 171.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.13 171.21 13.93 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.662 1.985 . . . . 0.0 110.913 -170.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 13.0 p -87.35 144.46 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 124.011 0.924 . . . . 0.0 109.438 169.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -128.8 174.22 9.66 Favored 'General case' 0 CA--C 1.522 -0.126 0 C-N-CA 126.244 1.818 . . . . 0.0 109.718 178.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -117.23 170.85 8.36 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.373 1.069 . . . . 0.0 109.08 166.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -164.97 154.97 13.5 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.46 1.904 . . . . 0.0 109.246 177.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 tp -56.71 142.44 40.22 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.315 0.961 . . . . 0.0 111.683 171.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -83.39 11.34 6.97 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 116.224 1.935 . . . . 0.0 116.224 -169.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.2 t0 165.65 144.87 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 128.69 2.796 . . . . 0.0 110.874 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 83.8 p -45.67 -29.87 1.39 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.924 2.089 . . . . 0.0 114.074 167.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -61.93 -49.74 74.93 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 124.062 0.945 . . . . 0.0 112.744 174.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 54.0 mt -60.85 -42.71 98.36 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 176.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.97 -34.08 65.38 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.617 1.167 . . . . 0.0 112.014 -174.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.7 mtt-85 -71.79 -60.68 2.11 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.417 1.087 . . . . 0.0 113.212 177.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.45 -34.6 75.69 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 120.309 1.413 . . . . 0.0 112.543 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 70.0 tp -62.46 -49.73 74.28 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.659 1.584 . . . . 0.0 110.795 169.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -67.93 -39.82 89.23 Favored Glycine 0 N--CA 1.475 1.239 0 C-N-CA 126.616 2.055 . . . . 0.0 113.926 -176.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 51.9 tp10 -64.79 -8.23 14.21 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 127.763 2.425 . . . . 0.0 112.713 168.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.3 tp 67.69 36.38 3.64 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 128.721 2.808 . . . . 0.0 110.6 169.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 3.8 m 48.63 -18.05 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 131.483 3.913 . . . . 0.0 117.366 -168.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 56.2 mm-40 69.94 -7.39 0.94 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 128.271 2.628 . . . . 0.0 114.076 -174.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.439 HG13 ' H ' ' A' ' 92' ' ' VAL . 0.7 OUTLIER -66.61 -10.38 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 C-N-CA 126.39 1.876 . . . . 0.0 114.467 170.813 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 79.5 42.57 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.043 0 C-N-CA 129.937 3.295 . . . . 0.0 113.158 168.071 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 tt 78.09 95.85 0.06 Allowed 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 123.614 1.673 . . . . 0.0 109.09 -168.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -49.55 70.72 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 128.355 2.662 . . . . 0.0 116.336 169.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 94.1 t -58.73 130.97 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 N-CA-C 106.09 -1.818 . . . . 0.0 106.09 165.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.598 ' HA ' ' HB3' ' B' ' 12' ' ' ALA . 29.0 t70 -60.93 -80.3 0.03 OUTLIER 'General case' 0 C--O 1.235 0.33 0 O-C-N 123.905 0.753 . . . . 0.0 112.294 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 5.7 p 66.24 132.59 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 128.785 2.834 . . . . 0.0 108.777 -169.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -84.92 83.67 7.97 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 120.974 1.715 . . . . 0.0 110.011 178.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.52 151.23 76.94 Favored Pre-proline 0 CA--C 1.551 1.007 0 CA-C-N 114.042 -1.435 . . . . 0.0 109.717 177.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -86.17 -102.39 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 124.083 3.189 . . . . 0.0 108.196 174.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 34.9 t . . . . . 0 N--CA 1.447 -0.598 0 CA-C-O 123.438 1.589 . . . . 0.0 109.784 165.205 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? . . . . . 0 CA--C 1.543 0.677 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.598 ' HB3' ' HA ' ' A' ' 97' ' ' ASP . . . -82.22 -39.82 22.54 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 121.016 1.734 . . . . 0.0 111.154 166.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -59.07 -21.37 59.06 Favored 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 124.583 1.153 . . . . 0.0 111.518 176.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -47.78 -47.07 30.87 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.976 2.511 . . . . 0.0 111.668 165.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.07 -15.0 69.1 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-O 119.139 -0.812 . . . . 0.0 112.557 -175.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.39 -56.25 4.59 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 166.303 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.24 -27.81 68.72 Favored 'General case' 0 CA--C 1.549 0.914 0 N-CA-C 115.583 1.698 . . . . 0.0 115.583 -173.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 5.8 mp -84.19 -20.05 33.01 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 119.284 0.947 . . . . 0.0 113.458 171.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.6 51.88 1.95 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.092 1.357 . . . . 0.0 110.995 169.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -117.21 146.85 39.14 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 127.511 2.325 . . . . 0.0 107.808 176.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -59.78 -94.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.929 1 C-N-CA 126.248 4.632 . . . . 0.0 113.663 -168.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.3 m -58.54 -24.23 60.17 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 120.773 -1.204 . . . . 0.0 111.213 175.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.465 ' HD3' ' CD1' ' B' ' 58' ' ' LEU . 13.1 ttm-85 -70.72 -41.22 72.18 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 113.977 1.102 . . . . 0.0 113.977 -178.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 38.1 t -56.02 -42.62 76.76 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.84 1.2 . . . . 0.0 109.449 169.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -64.66 -33.87 76.95 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 116.936 -1.507 . . . . 0.0 113.179 174.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.5 mt -56.8 -62.75 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 CA-C-N 121.317 1.871 . . . . 0.0 108.419 168.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 41.2 mt -54.88 -43.13 72.9 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.155 -0.926 . . . . 0.0 112.204 -170.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.9 p -74.59 -19.49 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-N 119.535 1.061 . . . . 0.0 113.197 -178.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.57 -27.46 21.36 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.486 1.515 . . . . 0.0 112.629 172.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.82 -47.02 83.83 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 125.5 1.52 . . . . 0.0 109.523 170.43 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.36 -61.11 1.8 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 129.946 3.298 . . . . 0.0 112.252 179.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -95.53 34.73 1.43 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.929 2.492 . . . . 0.0 110.395 174.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -128.92 -80.75 0.27 Allowed Glycine 0 C--N 1.337 0.613 0 C-N-CA 125.281 1.42 . . . . 0.0 113.532 -173.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 27.5 m 27.79 24.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 N-CA-C 119.651 3.204 . . . . 0.0 119.651 -174.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 76.1 m -83.7 -67.28 0.8 Allowed 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 121.331 1.878 . . . . 0.0 112.138 -178.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -147.15 162.57 32.24 Favored Pre-proline 0 CA--C 1.54 0.566 0 CA-C-O 117.919 -1.039 . . . . 0.0 111.231 -173.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -55.65 -27.5 61.12 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 122.7 2.267 . . . . 0.0 112.983 169.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -83.83 -3.9 89.08 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 117.432 -1.76 . . . . 0.0 115.521 175.011 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . 0.443 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -76.62 -36.92 57.14 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.953 2.376 . . . . 0.0 112.856 -172.419 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 14.7 mt -62.45 -22.31 66.11 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 123.431 0.693 . . . . 0.0 111.458 -179.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.87 -38.34 64.63 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.553 0.741 . . . . 0.0 111.904 176.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -52.61 13.38 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.618 0.767 . . . . 0.0 111.198 176.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . 0.443 ' CD2' HE22 ' B' ' 39' ' ' GLN . 8.9 m-70 -57.41 -24.16 53.77 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 65.9 mt -108.44 -11.23 15.19 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.603 1.561 . . . . 0.0 113.245 -176.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.36 8.04 42.66 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.292 0.948 . . . . 0.0 113.803 -170.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 53.4 mt -103.81 164.56 11.6 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.773 1.229 . . . . 0.0 112.066 -171.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 68.0 p -70.58 146.42 50.1 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.286 -0.884 . . . . 0.0 109.992 174.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 39.8 ptt180 -60.75 -17.07 46.45 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 172.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 47.6 p -73.6 -61.03 1.98 Allowed 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 166.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -66.57 -25.26 66.55 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.425 1.011 . . . . 0.0 113.124 -170.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 74.7 t -68.95 -31.11 49.2 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 CA-C-N 118.687 0.676 . . . . 0.0 111.896 169.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 75.8 m -61.28 -30.3 70.39 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.989 -1.069 . . . . 0.0 112.351 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -57.0 -13.68 2.94 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 128.053 2.541 . . . . 0.0 114.717 173.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -119.23 -8.01 10.19 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 120.325 -1.484 . . . . 0.0 114.411 170.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 71.4 mt -81.13 -25.06 37.21 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.067 0.947 . . . . 0.0 111.542 168.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 4.4 p -55.63 -49.63 72.33 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . 0.425 ' HB3' ' NH1' ' B' ' 23' ' ' ARG . 7.3 t -72.76 -35.32 67.45 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.765 1.166 . . . . 0.0 111.889 176.301 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . 0.465 ' CD1' ' HD3' ' B' ' 23' ' ' ARG . 1.4 tp -56.91 -52.61 64.47 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.261 2.224 . . . . 0.0 111.726 -176.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 28.7 mtm105 -84.4 14.48 4.42 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.747 1.619 . . . . 0.0 111.863 178.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -110.17 -50.48 0.67 Allowed Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.712 1.149 . . . . 0.0 111.231 169.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 81.1 m -73.47 3.93 5.46 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 125.99 1.716 . . . . 0.0 113.748 -178.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.56 24.17 70.86 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 118.759 -1.023 . . . . 0.0 113.57 -176.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 63.3 mt -73.46 -21.57 60.4 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.545 1.672 . . . . 0.0 112.522 170.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -145.31 154.5 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 126.982 2.113 . . . . 0.0 110.109 175.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 89.8 t -135.23 141.89 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 127.118 2.167 . . . . 0.0 109.331 -177.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.12 155.21 22.73 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 123.102 1.429 . . . . 0.0 114.004 174.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 29.5 m -160.27 172.28 17.66 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.711 2.004 . . . . 0.0 107.082 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -92.51 152.39 19.68 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 119.958 1.254 . . . . 0.0 111.72 168.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -96.34 -4.69 41.55 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.151 0.981 . . . . 0.0 112.034 167.528 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 121.0 -34.81 3.89 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 127.14 2.305 . . . . 0.0 112.802 176.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 23.8 ttp180 -120.42 -29.92 4.68 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 130.419 3.487 . . . . 0.0 111.822 -176.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -135.38 171.96 13.7 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 128.425 2.69 . . . . 0.0 110.896 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 8.3 p -87.52 150.23 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.797 1.239 . . . . 0.0 110.283 169.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 31.3 ptt85 -137.25 172.27 13.24 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 126.552 1.941 . . . . 0.0 109.814 -174.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -114.69 171.98 7.31 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.534 0.734 . . . . 0.0 110.201 167.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -160.95 151.05 17.57 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 127.0 2.12 . . . . 0.0 107.919 179.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.3 tp -60.45 157.8 13.3 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.618 1.167 . . . . 0.0 113.193 172.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.84 -30.92 58.68 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 116.366 1.988 . . . . 0.0 116.366 -177.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 42.0 t0 173.49 153.12 0.09 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.345 2.258 . . . . 0.0 109.091 -166.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 90.8 p -44.23 -30.91 0.86 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.191 1.796 . . . . 0.0 112.917 166.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -53.55 -59.01 5.15 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 126.236 1.814 . . . . 0.0 113.763 171.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 21.6 mt -60.77 -44.96 96.11 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.482 1.037 . . . . 0.0 108.202 176.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.6 -33.7 64.2 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.766 1.226 . . . . 0.0 112.262 -172.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 7.6 mtt-85 -70.78 -56.81 5.52 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.352 1.061 . . . . 0.0 113.342 175.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.84 -37.08 83.79 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 120.005 1.275 . . . . 0.0 112.697 -178.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 36.1 tp -63.57 -34.76 78.52 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.424 1.89 . . . . 0.0 111.781 169.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.68 -29.4 29.57 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 126.845 2.164 . . . . 0.0 114.646 -174.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -11.24 60.26 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.126 1.463 . . . . 0.0 111.568 167.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.5 tp 73.77 133.79 0.05 OUTLIER 'General case' 0 C--N 1.347 0.482 0 C-N-CA 130.903 3.681 . . . . 0.0 106.54 -169.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 79.0 t -67.75 5.5 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 -167.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 86.91 -25.18 0.1 Allowed 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.032 -1.042 . . . . 0.0 111.615 138.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.416 HG23 ' HG ' ' A' ' 14' ' ' LEU . 7.2 p -52.85 25.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.83 1 C-N-CA 134.702 5.201 . . . . 0.0 115.264 166.804 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 62.37 14.22 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 126.305 1.842 . . . . 0.0 113.689 171.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 4.7 tt 91.65 104.27 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 128.349 2.659 . . . . 0.0 108.735 -168.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.554 1.103 0 N-CA-C 115.862 1.801 . . . . 0.0 115.862 176.888 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.93 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.64 -31.27 24.77 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.951 1.3 . . . . 0.0 112.332 166.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.7 mtm105 -84.18 -32.37 24.63 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.991 1.316 . . . . 0.0 113.458 173.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -54.72 -49.75 69.99 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.834 1.254 . . . . 0.0 109.992 172.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.82 -24.92 70.25 Favored Glycine 0 N--CA 1.473 1.158 0 O-C-N 121.202 -0.937 . . . . 0.0 113.476 176.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.86 1.27 15.49 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.896 1.278 . . . . 0.0 112.336 173.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -118.41 -38.59 3.14 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.234 1.414 . . . . 0.0 111.848 167.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mp -86.18 -8.76 57.58 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -175.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -128.09 35.53 4.43 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.337 1.455 . . . . 0.0 110.698 167.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -114.59 144.42 31.81 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 127.379 2.271 . . . . 0.0 106.38 176.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -54.29 -94.41 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.791 1 C-N-CA 126.15 4.567 . . . . 0.0 114.314 -166.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.3 t -60.25 -23.86 64.42 Favored 'General case' 0 C--O 1.223 -0.342 0 O-C-N 121.375 -0.828 . . . . 0.0 111.51 175.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -69.73 -34.87 74.44 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.253 1.388 . . . . 0.0 113.783 -178.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.6 t -70.05 -36.82 75.28 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 121.44 1.927 . . . . 0.0 110.53 169.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.1 mtm180 -59.35 -46.98 87.14 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-O 117.65 -1.166 . . . . 0.0 112.532 172.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.466 HG12 HD11 ' A' ' 44' ' ' LEU . 1.1 mt -44.89 -56.88 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 CA-C-N 121.137 1.789 . . . . 0.0 110.307 172.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 94.8 mt -61.8 -41.39 97.69 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 117.702 -1.142 . . . . 0.0 111.545 -175.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.8 p -75.21 -27.76 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-N 120.793 1.633 . . . . 0.0 112.833 176.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.37 -30.26 63.18 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.423 1.489 . . . . 0.0 112.441 173.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.447 ' O ' HG13 ' A' ' 34' ' ' VAL . 1.4 mp -63.44 -47.04 83.52 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.425 167.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.51 -45.89 56.81 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.112 1.765 . . . . 0.0 112.469 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -107.29 40.53 1.66 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.103 1.761 . . . . 0.0 111.102 174.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -150.56 -78.3 0.02 OUTLIER Glycine 0 C--N 1.339 0.731 0 O-C-N 120.555 -1.34 . . . . 0.0 115.267 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.447 HG13 ' O ' ' A' ' 30' ' ' LEU . 27.6 m 31.37 31.01 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 C-N-CA 128.055 2.542 . . . . 0.0 117.6 -168.075 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 36.1 m -84.65 -67.66 0.78 Allowed 'General case' 0 N--CA 1.469 0.481 0 O-C-N 120.551 -1.343 . . . . 0.0 113.933 -173.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -143.64 164.03 32.83 Favored Pre-proline 0 CA--C 1.54 0.565 0 CA-C-O 118.054 -0.974 . . . . 0.0 112.541 -171.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -66.19 -25.49 50.31 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 121.99 1.794 . . . . 0.0 113.061 -169.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.16 11.34 48.14 Favored Glycine 0 CA--C 1.53 0.979 0 CA-C-O 117.913 -1.493 . . . . 0.0 114.439 173.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.531 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -64.23 -34.27 77.72 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.501 2.151 . . . . 0.0 111.126 179.826 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 46.0 mt -56.36 -21.54 25.36 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 124.901 1.28 . . . . 0.0 112.647 175.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.43 -28.4 69.78 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.189 -0.944 . . . . 0.0 112.194 -178.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.2 -57.05 3.99 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.769 0.828 . . . . 0.0 111.099 169.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.531 ' CD2' HE22 ' A' ' 39' ' ' GLN . 5.7 m-70 -53.41 -31.48 45.25 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -179.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.466 HD11 HG12 ' A' ' 26' ' ' ILE . 70.4 mt -98.09 -22.93 15.97 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.147 0.979 . . . . 0.0 113.44 -175.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.56 -0.73 48.07 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 124.787 1.184 . . . . 0.0 113.484 -169.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.9 mt -97.32 149.21 22.34 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.276 1.43 . . . . 0.0 110.326 -176.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.7 p -66.2 152.05 45.68 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 121.233 -0.917 . . . . 0.0 110.975 -174.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -56.14 -44.05 78.86 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.495 0.718 . . . . 0.0 111.988 -178.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.6 m -64.24 -35.56 81.22 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.588 1.155 . . . . 0.0 112.782 173.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -73.89 -44.54 54.94 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 178.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 67.9 t -60.6 -30.65 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 119.409 1.004 . . . . 0.0 112.447 176.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.8 m -53.16 -38.54 62.85 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 119.825 1.193 . . . . 0.0 113.683 174.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 64.3 m-80 -58.63 -48.02 82.43 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.236 1.014 . . . . 0.0 111.718 175.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 34.6 m80 -65.79 -31.73 72.86 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.569 1.148 . . . . 0.0 112.343 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 60.1 mt -74.46 -32.48 62.61 Favored 'General case' 0 C--O 1.222 -0.395 0 C-N-CA 124.088 0.955 . . . . 0.0 112.767 169.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.3 m -61.97 -33.97 75.28 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 120.798 1.636 . . . . 0.0 115.375 -170.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 38.5 t -77.04 -34.12 57.27 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.717 1.144 . . . . 0.0 111.512 170.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.3 tp -64.14 -38.28 90.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.37 2.268 . . . . 0.0 112.271 -177.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 66.4 mtm-85 -75.23 -13.51 60.45 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.905 1.682 . . . . 0.0 113.059 174.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.89 -34.99 4.71 Favored Glycine 0 N--CA 1.473 1.153 0 C-N-CA 126.317 1.913 . . . . 0.0 113.548 175.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 56.1 m -76.51 7.69 4.24 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.422 1.489 . . . . 0.0 111.425 168.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.48 -20.03 1.78 Allowed Glycine 0 CA--C 1.533 1.171 0 C-N-CA 126.71 2.1 . . . . 0.0 116.095 175.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.3 mt -55.63 -24.99 36.54 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 127.367 2.267 . . . . 0.0 115.675 -170.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.44 HG12 ' CD2' ' A' ' 30' ' ' LEU . 2.7 m -121.64 127.53 75.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 C-N-CA 124.27 1.028 . . . . 0.0 112.937 171.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 90.4 t -115.7 132.91 63.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 125.792 1.637 . . . . 0.0 109.513 -176.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -91.13 155.17 18.83 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 122.242 1.02 . . . . 0.0 112.684 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 26.3 m -147.79 152.09 37.11 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.301 1.44 . . . . 0.0 109.001 177.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -98.98 110.48 23.08 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.051 1.34 . . . . 0.0 111.14 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -87.52 68.37 9.6 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.036 2.135 . . . . 0.0 111.177 -179.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 63.01 -1.43 1.84 Allowed Glycine 0 CA--C 1.538 1.504 0 N-CA-C 117.72 1.848 . . . . 0.0 117.72 168.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.6 mtm-85 154.7 -25.83 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 131.533 3.933 . . . . 0.0 111.363 -172.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -94.43 179.16 5.38 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 166.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 24.5 m -128.43 168.89 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 O-C-N 121.042 -1.036 . . . . 0.0 108.838 168.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -137.63 -176.11 4.3 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.777 1.631 . . . . 0.0 111.14 172.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -135.43 151.33 50.31 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.769 2.027 . . . . 0.0 109.01 169.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.438 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -152.39 151.62 31.05 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.017 1.327 . . . . 0.0 110.58 -173.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -57.3 143.77 38.36 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.568 1.147 . . . . 0.0 109.711 173.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.49 -10.75 60.0 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 116.806 2.15 . . . . 0.0 116.806 -169.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -176.17 161.59 2.36 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.235 2.214 . . . . 0.0 109.563 173.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 90.2 p -41.59 -32.76 0.38 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 128.247 2.619 . . . . 0.0 112.711 166.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -42.07 -60.71 1.34 Allowed 'General case' 0 C--N 1.343 0.291 0 C-N-CA 126.666 1.986 . . . . 0.0 112.801 168.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.434 ' H ' HD22 ' A' ' 82' ' ' LEU . 0.3 OUTLIER -80.37 -34.96 36.05 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -170.344 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.69 -38.4 69.61 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 118.62 0.645 . . . . 0.0 112.664 169.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -71.78 -63.74 1.07 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.946 0.898 . . . . 0.0 113.245 173.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.47 -25.99 67.6 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.88 -1.137 . . . . 0.0 113.548 -171.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.77 -40.47 22.58 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 123.268 0.627 . . . . 0.0 111.779 169.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.12 -60.12 5.41 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 127.059 2.266 . . . . 0.0 115.045 -176.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.6 pm0 -66.44 -21.67 66.21 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.676 1.738 . . . . 0.0 111.406 168.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.8 tt 80.38 132.68 0.06 Allowed 'General case' 0 C--N 1.343 0.294 0 C-N-CA 128.565 2.746 . . . . 0.0 112.225 166.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 29.4 m -63.29 16.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 126.797 2.039 . . . . 0.0 114.732 178.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 73.22 -11.0 0.94 Allowed 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 126.365 1.866 . . . . 0.0 113.212 169.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 2.9 p -55.73 22.78 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 C-N-CA 129.864 3.266 . . . . 0.0 117.698 175.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.9 t 68.7 9.75 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 126.771 2.028 . . . . 0.0 112.779 166.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 95.31 110.51 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 131.09 3.756 . . . . 0.0 107.665 -168.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.3 74.75 0.05 Allowed 'General case' 0 CA--C 1.553 1.089 0 O-C-N 121.446 -0.783 . . . . 0.0 113.05 169.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.8 t -70.77 146.59 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 126.082 1.753 . . . . 0.0 111.8 174.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.69 78.8 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 128.69 2.796 . . . . 0.0 112.401 170.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 19.7 p -141.02 121.67 14.26 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.036 1.335 . . . . 0.0 112.61 -172.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -111.84 134.41 53.42 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.858 1.263 . . . . 0.0 110.041 173.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -165.11 158.62 14.23 Favored Pre-proline 0 CA--C 1.548 0.866 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 -170.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -83.16 170.32 12.22 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.972 2.448 . . . . 0.0 113.203 -172.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.6 t . . . . . 0 CA--C 1.558 1.274 0 C-N-CA 125.395 1.478 . . . . 0.0 110.205 167.144 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.458 0 N-CA-C 114.882 1.438 . . . . 0.0 114.882 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.81 -21.4 11.07 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 120.671 -1.268 . . . . 0.0 112.691 168.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 38.0 mtm105 -83.6 -46.72 12.05 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.151 1.781 . . . . 0.0 111.798 169.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -51.17 -57.89 7.58 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.913 1.685 . . . . 0.0 110.262 173.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.5 -23.71 75.2 Favored Glycine 0 C--N 1.339 0.725 0 CA-C-O 117.908 -1.495 . . . . 0.0 112.757 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 25.8 ttm105 -63.99 -49.19 73.44 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 119.792 1.796 . . . . 0.0 110.386 169.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.19 -33.85 75.33 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 120.065 1.302 . . . . 0.0 114.093 175.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 7.6 mp -84.57 -2.04 56.8 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 178.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -119.87 -12.82 9.13 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 172.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.55 157.32 27.08 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 126.347 1.859 . . . . 0.0 111.384 169.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -65.23 -99.49 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 0.992 1 C-N-CA 126.009 4.473 . . . . 0.0 111.725 -176.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 12.1 t -58.48 -25.27 62.13 Favored 'General case' 0 N--CA 1.464 0.262 0 O-C-N 120.637 -1.29 . . . . 0.0 112.469 175.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.54 -39.91 85.0 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 119.707 1.14 . . . . 0.0 112.844 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 44.0 t -66.54 -37.19 84.47 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.72 1.6 . . . . 0.0 111.008 169.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 7.2 mtm180 -61.53 -35.88 78.99 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 172.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . 0.452 HG12 HD11 ' B' ' 44' ' ' LEU . 1.8 mt -52.59 -59.9 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 CA-C-N 120.334 1.425 . . . . 0.0 108.851 169.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 96.9 mt -57.24 -45.95 83.45 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.75 -171.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 5.7 p -75.06 -31.3 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.58 -30.81 57.17 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.131 0.878 . . . . 0.0 112.387 174.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 12.1 tp -64.42 -37.09 86.3 Favored 'General case' 0 C--N 1.339 0.152 0 O-C-N 120.926 -1.109 . . . . 0.0 112.768 175.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.05 -31.75 8.28 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 128.907 2.883 . . . . 0.0 114.237 175.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.84 -33.17 18.67 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.663 1.985 . . . . 0.0 113.152 174.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -99.22 -65.02 0.84 Allowed Glycine 0 C--N 1.338 0.687 0 N-CA-C 115.465 0.946 . . . . 0.0 115.465 -165.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 16.1 m 34.5 38.8 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 125.969 1.708 . . . . 0.0 114.075 -167.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 30.0 m -86.47 -86.65 0.14 Allowed 'General case' 0 C--O 1.225 -0.23 0 C-N-CA 124.028 0.931 . . . . 0.0 110.944 -176.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -133.69 162.89 54.92 Favored Pre-proline 0 CA--C 1.544 0.72 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -169.127 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -63.91 -25.53 67.21 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 122.64 2.226 . . . . 0.0 113.843 -167.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.66 7.81 50.42 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-O 117.114 -1.937 . . . . 0.0 114.918 172.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.99 -31.97 71.55 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 121.083 2.442 . . . . 0.0 111.409 -175.084 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 31.4 mt -63.13 -18.75 63.77 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 125.32 1.448 . . . . 0.0 112.215 -179.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.0 -32.18 70.61 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 119.731 1.15 . . . . 0.0 112.245 177.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.62 -54.88 6.08 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.491 0.716 . . . . 0.0 111.306 170.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -53.55 -31.37 46.21 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.452 HD11 HG12 ' B' ' 26' ' ' ILE . 70.3 mt -100.55 -27.13 13.58 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.558 1.143 . . . . 0.0 112.984 -174.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.56 4.97 88.0 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 124.998 1.285 . . . . 0.0 113.27 -169.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 96.6 mt -105.78 150.3 25.67 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.019 1.328 . . . . 0.0 111.207 -172.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 9.5 p -64.34 149.63 47.82 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.262 -0.899 . . . . 0.0 110.402 -175.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -58.57 -35.56 72.57 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.654 0.612 . . . . 0.0 112.654 -177.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.7 m -66.82 -44.01 82.3 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.356 -0.84 . . . . 0.0 112.018 170.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -65.81 -45.31 82.81 Favored 'General case' 0 CA--C 1.548 0.884 0 O-C-N 121.162 -0.961 . . . . 0.0 112.215 177.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 94.8 t -59.59 -31.72 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 120.335 -1.478 . . . . 0.0 111.692 169.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 69.7 m -65.13 -26.99 68.43 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.02 1.282 . . . . 0.0 113.728 175.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -62.97 -55.58 24.6 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.104 0.866 . . . . 0.0 109.557 169.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 33.9 m80 -59.04 -39.86 83.29 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.594 1.158 . . . . 0.0 113.18 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 56.0 mt -66.59 -33.75 76.36 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 124.59 1.156 . . . . 0.0 112.709 172.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 59.9 m -63.7 -35.55 80.94 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 120.484 1.493 . . . . 0.0 114.293 -169.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 34.1 t -72.05 -34.69 68.95 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.597 0.635 . . . . 0.0 112.07 169.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.4 tp -68.41 -32.05 71.83 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.556 2.342 . . . . 0.0 112.581 -175.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 51.3 mtm-85 -82.09 -19.64 39.76 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.39 1.476 . . . . 0.0 112.239 171.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -88.88 -37.85 7.14 Favored Glycine 0 N--CA 1.476 1.325 0 C-N-CA 124.811 1.196 . . . . 0.0 113.398 177.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 97.0 m -81.39 15.34 2.05 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 126.332 1.853 . . . . 0.0 111.364 169.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.93 -26.3 1.16 Allowed Glycine 0 CA--C 1.534 1.259 0 C-N-CA 126.265 1.888 . . . . 0.0 116.525 172.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 21.3 mt -50.86 -29.41 11.78 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 127.664 2.386 . . . . 0.0 116.592 -168.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -118.03 122.44 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 124.915 1.286 . . . . 0.0 111.301 169.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 80.4 t -107.45 130.65 59.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 125.507 1.523 . . . . 0.0 108.656 -176.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -96.86 146.46 24.91 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 124.624 1.17 . . . . 0.0 111.395 -177.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 96.4 m -154.09 147.35 24.81 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 124.432 1.093 . . . . 0.0 109.001 -172.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -97.62 93.23 6.3 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.36 1.064 . . . . 0.0 111.719 -176.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -69.3 74.88 0.36 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.815 1.646 . . . . 0.0 114.078 173.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 63.15 -5.69 0.56 Allowed Glycine 0 N--CA 1.475 1.257 0 C-N-CA 126.808 2.147 . . . . 0.0 118.313 167.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 4.1 mtm-85 161.04 -24.98 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 130.36 3.464 . . . . 0.0 111.759 -175.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -100.6 170.4 8.39 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 166.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 11.1 m -115.1 163.32 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 119.036 0.834 . . . . 0.0 109.134 168.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 10.3 ptt-85 -129.63 172.93 11.09 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 122.2 1.0 . . . . 0.0 110.784 170.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -127.93 140.34 52.06 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 167.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -146.52 154.75 41.9 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 123.753 0.821 . . . . 0.0 110.675 -178.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 1.2 mp -57.25 142.96 41.24 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.593 0.757 . . . . 0.0 110.614 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.13 0.44 1.97 Allowed 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 118.751 2.871 . . . . 0.0 118.751 -167.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 11.8 t70 169.02 158.33 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 129.835 3.254 . . . . 0.0 109.832 173.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 88.7 p -40.58 -35.39 0.46 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.806 2.442 . . . . 0.0 112.756 167.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -38.66 -63.16 0.53 Allowed 'General case' 0 C--N 1.342 0.278 0 C-N-CA 127.242 2.217 . . . . 0.0 113.013 167.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . 0.511 ' H ' HD22 ' B' ' 82' ' ' LEU . 0.4 OUTLIER -75.2 -34.16 61.49 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -170.981 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.17 -30.22 71.41 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.857 0.863 . . . . 0.0 112.3 177.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.8 mmt85 -71.17 -65.74 0.71 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.645 1.178 . . . . 0.0 110.905 168.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.97 -25.83 63.93 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.599 1.333 . . . . 0.0 114.599 -173.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -87.26 -34.3 18.97 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.374 -0.829 . . . . 0.0 112.647 169.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.35 -58.33 5.11 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 127.27 2.367 . . . . 0.0 113.645 -175.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 14.0 pm0 -70.21 -17.72 63.15 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 119.22 1.51 . . . . 0.0 111.165 166.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . 0.406 ' C ' ' H ' ' B' ' 91' ' ' GLN . 26.5 tp 82.07 146.44 0.08 Allowed 'General case' 0 C--N 1.343 0.321 0 C-N-CA 129.989 3.315 . . . . 0.0 112.904 167.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . 0.497 HG23 HG12 ' B' ' 92' ' ' VAL . 5.8 m -57.34 5.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 127.513 2.325 . . . . 0.0 114.122 168.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . 0.406 ' H ' ' C ' ' B' ' 89' ' ' LEU . 7.3 mm-40 69.0 -9.27 0.6 Allowed 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 127.111 2.164 . . . . 0.0 114.228 176.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.497 HG12 HG23 ' B' ' 90' ' ' VAL . 1.2 p -56.26 26.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 130.174 3.39 . . . . 0.0 117.765 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 73.05 10.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 126.672 1.989 . . . . 0.0 112.496 168.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 78.99 101.27 0.06 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 127.716 2.407 . . . . 0.0 108.986 -171.224 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.552 1.039 0 C-N-CA 125.14 1.376 . . . . 0.0 114.681 177.4 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 pp . . . . . 0 N--CA 1.471 0.593 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.44 1.26 8.29 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.372 1.469 . . . . 0.0 113.878 176.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -112.21 -21.18 11.58 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.967 1.307 . . . . 0.0 112.478 169.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.08 -59.71 4.98 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.705 1.138 . . . . 0.0 109.534 168.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.08 -27.56 72.45 Favored Glycine 0 CA--C 1.538 1.473 0 O-C-N 121.292 -0.88 . . . . 0.0 113.234 -178.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -51.93 28.7 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.287 1.035 . . . . 0.0 111.478 172.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.44 -25.11 59.22 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.125 -0.984 . . . . 0.0 112.524 -175.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.1 mp -82.83 -6.96 59.67 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 118.138 -0.934 . . . . 0.0 111.362 168.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -92.34 -35.62 13.63 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 119.995 1.271 . . . . 0.0 112.28 166.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -47.56 127.81 10.51 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 125.309 1.443 . . . . 0.0 108.697 173.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -50.06 -85.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 1 C-N-CA 127.621 5.547 . . . . 0.0 113.516 -165.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.36 -22.24 29.78 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 126.614 1.965 . . . . 0.0 113.747 174.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 37.8 mtt180 -74.19 -40.69 62.34 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 120.249 1.386 . . . . 0.0 112.215 178.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 6.9 t -60.18 -48.32 82.21 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.353 0.979 . . . . 0.0 110.09 169.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -62.18 -35.84 80.06 Favored 'General case' 0 CA--C 1.556 1.178 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 176.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -55.27 -53.47 34.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 CA-C-N 120.674 1.579 . . . . 0.0 108.719 167.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.693 HD22 HD21 ' A' ' 77' ' ' LEU . 25.0 mt -63.88 -45.61 88.63 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 117.483 -1.246 . . . . 0.0 112.664 -174.11 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.2 m -58.27 -27.22 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 CA-C-N 120.667 1.576 . . . . 0.0 112.378 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.482 ' HB1' ' CD2' ' A' ' 43' ' ' HIS . . . -95.63 -18.43 20.55 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.972 0.909 . . . . 0.0 113.312 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.503 HD23 ' HA ' ' A' ' 30' ' ' LEU . 8.9 mt -68.72 -41.28 79.25 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 118.247 -0.883 . . . . 0.0 112.482 168.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.8 tt -29.81 -62.32 0.14 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 130.4 3.48 . . . . 0.0 113.251 -178.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -98.55 -17.5 18.65 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.746 2.018 . . . . 0.0 112.684 174.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.39 -43.16 25.76 Favored Glycine 0 C--N 1.341 0.853 0 CA-C-O 116.153 -2.471 . . . . 0.0 115.833 -168.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.6 m 4.03 48.65 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 C-N-CA 131.125 3.77 . . . . 0.0 119.798 177.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 68.7 m -104.61 -63.17 1.24 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.975 1.71 . . . . 0.0 110.424 176.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -151.26 149.14 23.91 Favored Pre-proline 0 N--CA 1.474 0.762 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -173.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -55.99 -44.44 47.06 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 121.756 1.638 . . . . 0.0 111.082 175.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -69.04 -5.06 45.56 Favored Glycine 0 CA--C 1.535 1.288 0 CA-C-O 118.276 -1.291 . . . . 0.0 114.678 177.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -69.91 -34.97 74.19 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 118.965 1.382 . . . . 0.0 111.383 173.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.8 mt -64.56 -3.2 2.88 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 118.43 0.559 . . . . 0.0 111.9 -177.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.96 -44.3 85.41 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.724 -0.61 . . . . 0.0 110.264 172.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.58 -38.55 70.92 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.821 0.849 . . . . 0.0 111.813 173.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.482 ' CD2' ' HB1' ' A' ' 29' ' ' ALA . 6.5 m-70 -62.9 -20.03 64.77 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.606 HD12 HG22 ' A' ' 51' ' ' VAL . 75.5 mt -121.24 -19.37 7.1 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.996 1.718 . . . . 0.0 114.285 -172.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.49 17.29 78.95 Favored Glycine 0 CA--C 1.535 1.289 0 CA-C-N 118.673 0.669 . . . . 0.0 112.438 -168.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 87.1 mt -111.09 157.3 20.15 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.693 1.246 . . . . 0.0 112.749 -173.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.3 t -62.97 147.47 50.45 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.466 -0.771 . . . . 0.0 109.904 168.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 19.3 ptt-85 -61.58 -13.63 23.38 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 174.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.6 m -66.7 -51.18 58.99 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.033 -1.042 . . . . 0.0 111.71 169.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -65.14 -44.92 87.05 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.036 0.935 . . . . 0.0 110.142 177.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.606 HG22 HD12 ' A' ' 44' ' ' LEU . 13.0 t -52.72 -48.38 49.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.266 171.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 66.5 m -60.84 -39.58 89.62 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 118.954 0.797 . . . . 0.0 112.487 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -57.89 -44.54 86.8 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.074 0.949 . . . . 0.0 111.858 173.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 23.0 m170 -61.73 -41.59 97.84 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 120.895 -1.128 . . . . 0.0 112.149 172.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 54.8 mt -75.09 -20.5 59.46 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.2 t -49.81 -51.64 38.23 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.889 1.276 . . . . 0.0 113.508 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 40.0 t -77.87 -39.8 42.13 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.574 0.75 . . . . 0.0 111.904 175.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.7 tp -55.58 -36.61 67.07 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.456 1.503 . . . . 0.0 112.302 -176.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.431 ' HD3' ' CE2' ' A' ' 75' ' ' TYR . 69.0 mtm180 -74.13 -40.23 62.78 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 173.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.43 -39.03 31.7 Favored Glycine 0 N--CA 1.467 0.733 0 C-N-CA 123.798 0.713 . . . . 0.0 112.122 -170.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 67.6 m -81.18 12.33 3.55 Favored 'General case' 0 CA--C 1.562 1.417 0 C-N-CA 126.206 1.802 . . . . 0.0 112.315 171.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.88 -12.08 54.55 Favored Glycine 0 N--CA 1.473 1.133 0 C-N-CA 128.574 2.988 . . . . 0.0 118.946 167.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.7 mt -58.59 -29.82 66.73 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.45 1.5 . . . . 0.0 114.815 -175.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.6 m -132.0 132.33 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.7 t -118.85 135.23 59.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 127.871 2.468 . . . . 0.0 110.883 -168.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.68 126.55 31.42 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.29 0.636 . . . . 0.0 111.845 175.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -141.67 156.45 45.64 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.413 1.085 . . . . 0.0 109.395 174.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.35 124.43 28.41 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.55 1.068 . . . . 0.0 110.112 168.16 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.0 -32.57 57.3 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 121.28 -0.888 . . . . 0.0 112.758 173.488 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 166.33 -17.92 0.09 OUTLIER Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.569 1.557 . . . . 0.0 115.246 174.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.96 -16.65 0.26 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.16 2.184 . . . . 0.0 113.584 177.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.04 173.98 10.98 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.659 1.984 . . . . 0.0 109.729 175.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 8.4 p -81.26 136.95 22.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 C-N-CA 124.315 1.046 . . . . 0.0 111.072 169.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -110.24 160.4 16.55 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 126.553 1.941 . . . . 0.0 109.648 169.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.431 ' CE2' ' HD3' ' A' ' 59' ' ' ARG . 3.4 m-30 -107.99 100.76 10.08 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 107.027 -1.471 . . . . 0.0 107.027 170.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -93.61 142.15 27.67 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.32 1.048 . . . . 0.0 110.055 179.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.693 HD21 HD22 ' A' ' 27' ' ' LEU . 8.6 mt -55.33 153.19 7.46 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.667 0.787 . . . . 0.0 112.049 171.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.85 -32.89 66.25 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 115.054 1.502 . . . . 0.0 115.054 -169.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -167.35 161.69 14.31 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 125.071 1.348 . . . . 0.0 109.718 -175.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 68.6 m -48.35 -32.59 7.7 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.363 1.065 . . . . 0.0 112.332 168.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -47.84 -52.78 17.79 Favored 'General case' 0 C--N 1.345 0.397 0 C-N-CA 125.614 1.565 . . . . 0.0 112.829 171.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.3 mt -76.03 -46.08 31.13 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 117.926 -1.035 . . . . 0.0 108.808 -173.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.52 -33.69 46.38 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 172.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 -68.01 -67.36 0.47 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.982 1.713 . . . . 0.0 112.327 173.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.94 -30.14 71.25 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.74 1.155 . . . . 0.0 113.276 -174.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 47.1 tp -65.56 -38.82 90.65 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.249 1.42 . . . . 0.0 110.905 169.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.02 -51.52 6.89 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 128.548 2.975 . . . . 0.0 115.091 -175.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -71.53 -2.49 17.07 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.43 1.615 . . . . 0.0 113.23 172.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 32.9 tp 69.84 110.62 0.05 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 128.605 2.762 . . . . 0.0 113.288 167.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.489 HG23 HG12 ' A' ' 92' ' ' VAL . 29.5 m -64.9 17.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 127.097 2.159 . . . . 0.0 116.376 -169.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.512 ' C ' ' H ' ' A' ' 93' ' ' VAL . 43.1 mm-40 75.55 -11.01 1.16 Allowed 'General case' 0 C--O 1.216 -0.676 0 O-C-N 120.525 -1.359 . . . . 0.0 113.277 158.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.489 HG12 HG23 ' A' ' 90' ' ' VAL . 4.3 p -70.74 40.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 126.769 2.028 . . . . 0.0 111.271 166.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.512 ' H ' ' C ' ' A' ' 91' ' ' GLN . 2.2 t 72.0 -33.49 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 130.82 3.648 . . . . 0.0 114.657 176.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 51.4 tp 128.91 94.08 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.66 1 C-N-CA 132.044 4.138 . . . . 0.0 105.792 -166.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.14 138.61 37.65 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -174.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 25.5 t -114.0 154.26 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 126.556 1.943 . . . . 0.0 108.917 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.8 -4.76 0.49 Allowed 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 127.205 2.202 . . . . 0.0 114.885 173.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.1 p -84.73 109.85 18.35 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.857 1.663 . . . . 0.0 113.254 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -89.61 157.95 17.82 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.194 0.998 . . . . 0.0 108.89 166.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -160.21 147.34 12.42 Favored Pre-proline 0 CA--C 1.556 1.19 0 CA-C-O 117.365 -1.303 . . . . 0.0 109.362 -169.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -38.77 146.84 0.14 Allowed 'Trans proline' 0 C--N 1.357 1.017 1 C-N-CA 127.111 5.208 . . . . 0.0 121.349 -166.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.548 0.885 0 CA-C-O 123.021 1.391 . . . . 0.0 108.645 168.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . 0.272 1.8 pp . . . . . 0 N--CA 1.479 0.994 0 N-CA-C 117.248 2.314 . . . . 0.0 117.248 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.38 -23.63 63.76 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 120.398 1.454 . . . . 0.0 112.731 178.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -20.44 61.4 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 116.626 -1.654 . . . . 0.0 112.055 172.204 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.58 -67.77 0.3 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 120.778 1.626 . . . . 0.0 108.589 170.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -57.63 -38.7 88.96 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-O 119.512 -0.604 . . . . 0.0 112.721 -175.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -62.47 -50.99 69.25 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 118.105 0.952 . . . . 0.0 112.669 173.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.27 -11.71 60.83 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.364 0.983 . . . . 0.0 113.37 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.3 mp -96.42 -14.2 22.61 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.34 1.056 . . . . 0.0 112.145 168.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.95 -13.86 56.9 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.397 1.079 . . . . 0.0 112.282 166.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -79.98 133.05 58.65 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 128.414 2.686 . . . . 0.0 108.927 -177.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -52.88 -84.7 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.614 1 C-N-CA 126.819 5.013 . . . . 0.0 113.297 -167.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.03 -23.29 67.38 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 126.251 1.821 . . . . 0.0 112.508 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 47.0 mtt85 -73.84 -43.44 58.7 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 120.248 1.385 . . . . 0.0 112.663 176.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 4.5 t -58.32 -44.87 88.83 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.918 1.235 . . . . 0.0 110.023 170.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 19.5 tpt180 -61.31 -33.86 74.28 Favored 'General case' 0 CA--C 1.559 1.301 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 172.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -63.83 -52.15 60.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 O-C-N 119.601 -1.937 . . . . 0.0 108.957 168.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 88.5 mt -59.47 -44.7 92.96 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 117.674 -1.155 . . . . 0.0 112.437 -177.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 3.8 m -59.32 -23.89 26.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 CA-C-N 120.427 1.467 . . . . 0.0 112.734 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . 0.55 ' HB1' ' CD2' ' B' ' 43' ' ' HIS . . . -98.92 -8.18 25.97 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.4 1.08 . . . . 0.0 112.784 -179.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.8 mt -87.14 -25.17 24.23 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.005 1.322 . . . . 0.0 112.932 168.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.2 -30.17 10.93 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 127.991 2.516 . . . . 0.0 111.676 166.144 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -131.0 -37.72 1.27 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.436 1.894 . . . . 0.0 115.447 -170.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.26 -63.23 3.01 Favored Glycine 0 C--N 1.343 0.963 0 C-N-CA 125.022 1.296 . . . . 0.0 114.688 -165.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 4.3 m 41.01 36.2 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 173.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 60.0 m -98.76 -76.37 0.54 Allowed 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 125.587 1.555 . . . . 0.0 112.198 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -143.08 153.29 60.02 Favored Pre-proline 0 N--CA 1.478 0.933 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 -169.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -54.41 -35.52 84.89 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.253 2.635 . . . . 0.0 112.64 178.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -80.41 -8.84 87.17 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-O 117.849 -1.528 . . . . 0.0 115.102 175.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.17 -32.35 73.74 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 120.627 2.213 . . . . 0.0 112.879 -171.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 5.2 mt -67.71 -7.87 30.63 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 118.543 0.611 . . . . 0.0 111.634 -178.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.51 -39.15 89.97 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.299 -0.875 . . . . 0.0 111.162 169.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.81 -44.22 33.44 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.295 1.038 . . . . 0.0 112.187 175.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . 0.55 ' CD2' ' HB1' ' B' ' 29' ' ' ALA . 25.6 m-70 -57.45 -25.04 59.08 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 178.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.655 HD12 HG22 ' B' ' 51' ' ' VAL . 66.5 mt -115.21 -19.71 10.69 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.374 1.87 . . . . 0.0 114.251 -173.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.89 17.9 77.22 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-N 119.137 0.881 . . . . 0.0 113.065 -169.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 85.9 mt -110.27 162.05 15.0 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.563 1.182 . . . . 0.0 112.889 -174.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.9 t -68.67 148.91 49.74 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.123 -0.986 . . . . 0.0 110.092 168.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 22.8 ptt-85 -60.29 -15.34 24.26 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 174.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 1.8 m -67.35 -50.79 58.44 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.986 -1.071 . . . . 0.0 111.68 169.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -65.92 -43.22 88.79 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.68 0.792 . . . . 0.0 110.398 176.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . 0.655 HG22 HD12 ' B' ' 44' ' ' LEU . 16.6 t -54.6 -44.39 69.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 O-C-N 121.588 -0.695 . . . . 0.0 112.074 171.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.1 m -62.3 -39.91 94.57 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.51 1.05 . . . . 0.0 112.802 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -55.78 -44.8 78.09 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.45 1.1 . . . . 0.0 111.487 172.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 22.2 m80 -63.27 -40.6 97.86 Favored 'General case' 0 CA--C 1.549 0.906 0 O-C-N 121.179 -0.95 . . . . 0.0 112.305 172.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 82.7 mt -73.83 -28.36 61.57 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -176.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 68.1 m -50.68 -53.39 31.54 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 120.798 1.636 . . . . 0.0 113.785 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 36.2 t -68.87 -42.85 76.47 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 118.551 0.614 . . . . 0.0 112.525 179.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 mp -49.0 -41.88 35.96 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.552 1.941 . . . . 0.0 114.287 174.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 85.7 mtm180 -91.4 -20.85 21.36 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -177.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -86.52 -45.72 5.44 Favored Glycine 0 N--CA 1.472 1.054 0 CA-C-N 119.921 1.237 . . . . 0.0 112.122 176.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 84.8 m -74.29 9.08 1.81 Allowed 'General case' 0 CA--C 1.561 1.399 0 C-N-CA 126.083 1.753 . . . . 0.0 113.612 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 84.81 -5.67 81.3 Favored Glycine 0 C--N 1.341 0.853 0 C-N-CA 128.797 3.094 . . . . 0.0 116.713 168.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 12.0 mt -64.26 -22.56 66.99 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 119.007 1.404 . . . . 0.0 114.6 -173.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 31.9 t -137.91 134.8 45.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 125.533 1.533 . . . . 0.0 112.284 -171.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 15.7 t -118.6 132.62 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 126.843 2.057 . . . . 0.0 111.281 -169.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -82.36 129.93 34.99 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.878 0.871 . . . . 0.0 110.8 169.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.01 159.76 42.03 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.111 0.964 . . . . 0.0 110.42 174.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.38 128.74 34.17 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.457 0.571 . . . . 0.0 109.912 166.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.65 -28.65 30.54 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.443 -0.786 . . . . 0.0 112.731 170.005 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 159.77 -39.79 0.47 Allowed Glycine 0 CA--C 1.531 1.038 0 C-N-CA 124.556 1.074 . . . . 0.0 115.005 172.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.31 -19.23 11.34 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.689 1.596 . . . . 0.0 113.103 172.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.85 171.74 13.8 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.485 1.914 . . . . 0.0 110.588 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 7.1 p -80.68 152.4 4.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 C-N-CA 124.328 1.051 . . . . 0.0 109.682 168.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 22.0 ptt180 -132.04 173.96 10.68 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.52 2.328 . . . . 0.0 110.749 177.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -120.09 120.93 37.67 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.643 166.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -109.87 164.04 12.96 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.159 1.384 . . . . 0.0 109.165 172.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 64.8 mt -70.02 166.35 19.91 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.725 -0.609 . . . . 0.0 111.018 172.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.8 -48.88 66.59 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 -177.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -161.99 164.66 28.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.988 2.115 . . . . 0.0 109.377 -171.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 73.2 m -51.53 -26.83 9.21 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.918 0.887 . . . . 0.0 112.58 168.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -52.26 -58.38 6.82 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 125.024 1.329 . . . . 0.0 112.292 170.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 8.9 mt -70.22 -42.62 72.03 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.563 1.074 . . . . 0.0 109.774 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.25 -35.77 50.69 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.242 1.017 . . . . 0.0 113.237 173.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 -67.01 -64.66 0.81 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.704 1.201 . . . . 0.0 112.337 175.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.63 -17.97 64.98 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 -176.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 43.0 tp -82.58 -30.94 29.26 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 127.104 2.162 . . . . 0.0 112.352 169.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -87.23 -59.71 1.73 Allowed Glycine 0 N--CA 1.473 1.102 0 C-N-CA 128.776 3.084 . . . . 0.0 114.252 -172.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -71.81 -16.57 62.18 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 119.045 1.422 . . . . 0.0 110.708 167.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 23.5 tp 78.24 147.79 0.09 Allowed 'General case' 0 C--N 1.343 0.312 0 C-N-CA 129.16 2.984 . . . . 0.0 114.488 165.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . 0.545 HG23 HG12 ' B' ' 92' ' ' VAL . 15.6 m -59.05 10.39 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 127.366 2.266 . . . . 0.0 114.46 168.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 70.57 -17.2 0.29 Allowed 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 127.083 2.153 . . . . 0.0 115.571 172.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.545 HG12 HG23 ' B' ' 90' ' ' VAL . 2.5 p -59.06 31.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 C-N-CA 130.622 3.569 . . . . 0.0 116.803 -178.033 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.4 t 69.77 12.96 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 127.702 2.401 . . . . 0.0 113.086 168.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 46.6 tp 84.06 104.41 0.05 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 129.285 3.034 . . . . 0.0 108.743 -169.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.831 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.165 168.979 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 pp . . . . . 0 N--CA 1.475 0.776 0 N-CA-C 113.747 1.018 . . . . 0.0 113.747 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.34 -20.76 66.54 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.973 0.909 . . . . 0.0 113.111 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.8 mmt180 -87.77 -43.03 12.18 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.141 0.977 . . . . 0.0 110.564 173.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -59.17 -43.34 92.11 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.55 1.14 . . . . 0.0 112.095 -178.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -56.13 -30.98 58.6 Favored Glycine 0 CA--C 1.533 1.205 0 CA-C-N 118.963 0.801 . . . . 0.0 112.586 176.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.6 ttp85 -90.69 -13.77 33.53 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 174.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.1 -30.05 62.15 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 121.033 1.742 . . . . 0.0 111.108 169.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.8 mp -81.96 -45.89 14.76 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.137 0.975 . . . . 0.0 110.298 169.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.19 64.98 5.19 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-O 122.459 1.123 . . . . 0.0 112.874 170.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -136.55 138.52 26.84 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 128.876 2.87 . . . . 0.0 109.523 -177.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -52.18 -89.26 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.807 1 C-N-CA 126.22 4.614 . . . . 0.0 114.159 -168.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 m -67.72 -24.22 65.35 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.833 0.853 . . . . 0.0 110.734 -177.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.502 ' HG2' HD13 ' A' ' 58' ' ' LEU . 16.9 ttm105 -74.74 -37.82 62.42 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.849 1.204 . . . . 0.0 112.601 -177.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 14.0 t -55.75 -46.48 77.82 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 120.126 1.33 . . . . 0.0 109.982 166.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 58.0 mmt-85 -58.95 -44.7 91.51 Favored 'General case' 0 C--O 1.217 -0.652 0 CA-C-O 117.801 -1.095 . . . . 0.0 112.809 174.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mm -53.26 -48.93 54.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 CA-C-N 120.867 1.667 . . . . 0.0 110.763 173.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 89.3 mt -61.88 -42.39 99.01 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 118.538 -0.744 . . . . 0.0 111.44 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -77.19 -26.26 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -179.2 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.82 -31.67 59.49 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.289 1.436 . . . . 0.0 111.056 173.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 tp -65.1 -45.11 86.54 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 116.567 -1.682 . . . . 0.0 111.882 169.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 mt -47.59 -45.3 27.2 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.58 1.952 . . . . 0.0 113.677 -178.007 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -98.3 -1.81 40.95 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 125.97 1.708 . . . . 0.0 113.193 177.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -107.7 -76.52 0.98 Allowed Glycine 0 C--N 1.341 0.85 0 C-N-CA 126.561 2.029 . . . . 0.0 113.636 -174.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.2 m 36.45 34.7 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 C-N-CA 127.576 2.351 . . . . 0.0 115.362 -169.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.56 -62.33 1.61 Allowed 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.247 -0.908 . . . . 0.0 112.814 -172.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -164.63 155.89 13.34 Favored Pre-proline 0 N--CA 1.476 0.835 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -169.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -57.79 129.88 35.72 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.075 1.85 . . . . 0.0 108.682 169.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.17 -2.67 83.77 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 117.486 -1.73 . . . . 0.0 114.312 -173.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.519 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -60.86 -36.08 78.26 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 120.828 2.314 . . . . 0.0 110.323 169.96 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.96 -19.67 63.02 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.601 1.161 . . . . 0.0 112.221 179.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.59 -25.58 68.3 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 118.393 0.542 . . . . 0.0 111.839 178.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.08 -54.76 5.48 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.98 0.912 . . . . 0.0 111.377 169.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.519 ' CD2' HE22 ' A' ' 39' ' ' GLN . 5.4 m-70 -55.01 -26.38 36.65 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.436 HD12 HG22 ' A' ' 51' ' ' VAL . 57.0 mt -108.39 -12.79 14.98 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.26 1.424 . . . . 0.0 113.432 -176.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.45 6.11 32.82 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 124.202 0.906 . . . . 0.0 113.935 -171.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 57.5 mt -108.1 138.8 43.75 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.399 1.08 . . . . 0.0 111.39 -169.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.7 t -60.37 151.63 27.4 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.654 0.74 . . . . 0.0 112.324 -173.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -50.53 -35.91 31.76 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.374 1.469 . . . . 0.0 113.484 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.03 -45.74 80.37 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.373 1.069 . . . . 0.0 111.944 175.077 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -66.55 -45.5 79.19 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.36 -0.837 . . . . 0.0 111.569 175.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.436 HG22 HD12 ' A' ' 44' ' ' LEU . 2.6 t -63.39 -28.6 45.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 O-C-N 120.748 -1.22 . . . . 0.0 112.153 175.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.8 m -63.51 -41.53 98.51 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.007 0.821 . . . . 0.0 112.726 171.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -59.48 -34.03 72.06 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.912 0.885 . . . . 0.0 112.463 172.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -70.69 -45.75 64.42 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 121.105 -0.997 . . . . 0.0 112.849 172.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 83.2 mt -69.76 -18.58 63.51 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.312 1.445 . . . . 0.0 113.81 176.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 t -57.2 -55.56 33.13 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.97 1.259 . . . . 0.0 111.303 -178.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 16.0 t -69.6 -34.63 74.37 Favored 'General case' 0 C--O 1.219 -0.537 0 O-C-N 121.749 -0.594 . . . . 0.0 111.858 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.502 HD13 ' HG2' ' A' ' 23' ' ' ARG . 4.3 tp -64.76 -37.36 87.35 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.994 0.918 . . . . 0.0 112.514 -176.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.42 ' HG2' HG23 ' A' ' 64' ' ' VAL . 88.5 mtm180 -85.16 -30.4 23.97 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.884 1.273 . . . . 0.0 110.979 175.091 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.61 -44.55 81.78 Favored Glycine 0 N--CA 1.474 1.195 0 C-N-CA 123.915 0.769 . . . . 0.0 112.532 176.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 20.6 m -72.95 -10.2 59.55 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.376 1.47 . . . . 0.0 112.816 169.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.71 2.59 61.12 Favored Glycine 0 CA--C 1.533 1.187 0 O-C-N 120.531 -1.356 . . . . 0.0 115.127 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.5 mt -53.94 -25.94 23.0 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 120.092 1.946 . . . . 0.0 113.391 173.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.42 HG23 ' HG2' ' A' ' 59' ' ' ARG . 2.9 m -124.47 141.92 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.833 1.653 . . . . 0.0 113.881 169.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 65.6 t -133.92 137.8 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 126.186 1.795 . . . . 0.0 110.508 -175.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.468 ' HB2' ' CE1' ' A' ' 75' ' ' TYR . . . -91.28 154.43 19.26 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 174.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.8 m -143.06 135.34 27.26 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.332 1.853 . . . . 0.0 110.065 -173.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -79.63 105.36 10.87 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.827 0.851 . . . . 0.0 112.333 169.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.402 ' CG ' ' HD3' ' A' ' 74' ' ' ARG . 76.2 mm-40 -83.59 174.34 10.64 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.555 1.142 . . . . 0.0 110.76 167.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -69.57 24.16 0.38 Allowed Glycine 0 N--CA 1.481 1.649 0 N-CA-C 117.891 1.916 . . . . 0.0 117.891 -168.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.82 -14.04 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 128.174 2.59 . . . . 0.0 113.913 179.024 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -140.77 171.37 14.19 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 126.777 2.031 . . . . 0.0 108.191 -175.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 34.2 m -118.06 148.14 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 123.581 0.752 . . . . 0.0 109.004 170.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.402 ' HD3' ' CG ' ' A' ' 69' ' ' GLU . 9.2 ptt85 -117.21 -178.73 3.52 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.319 0.648 . . . . 0.0 112.499 174.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.468 ' CE1' ' HB2' ' A' ' 66' ' ' ALA . 12.0 m-85 -131.34 131.23 43.59 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.068 1.747 . . . . 0.0 106.886 166.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.88 163.73 25.7 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.673 1.589 . . . . 0.0 110.284 176.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.8 mp -59.3 146.25 40.23 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.763 0.825 . . . . 0.0 109.564 169.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -47.64 -40.86 20.76 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.808 1.243 . . . . 0.0 114.048 -178.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -167.92 167.24 12.97 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.737 1.615 . . . . 0.0 111.401 176.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -35.61 -35.79 0.06 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 130.399 3.479 . . . . 0.0 112.228 165.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -44.05 -61.23 1.54 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 126.587 1.955 . . . . 0.0 113.059 169.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.6 mt -74.75 -29.85 61.28 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.345 0.975 . . . . 0.0 110.24 -176.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.54 -26.83 68.88 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.633 -1.175 . . . . 0.0 111.69 178.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -67.67 -71.78 0.19 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 120.117 1.326 . . . . 0.0 111.688 172.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.48 -41.79 90.58 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.451 1.023 . . . . 0.0 112.262 -169.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.94 -35.42 74.52 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.846 1.259 . . . . 0.0 111.745 175.03 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.42 -45.6 94.57 Favored Glycine 0 CA--C 1.527 0.837 0 C-N-CA 126.064 1.792 . . . . 0.0 113.571 173.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . 0.328 16.4 pt-20 -85.25 21.12 1.78 Allowed 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.629 1.172 . . . . 0.0 112.953 169.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 33.9 tp 77.75 -43.71 0.4 Allowed 'General case' 0 N--CA 1.474 0.769 1 C-N-CA 131.856 4.062 . . . . 0.0 113.986 166.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.365 5.2 t 145.3 5.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.286 1 C-N-CA 134.787 5.235 . . . . 0.0 110.412 168.966 . . . . . . . . 3 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 87.47 -25.34 0.09 Allowed 'General case' 0 C--O 1.217 -0.658 0 O-C-N 120.119 -1.613 . . . . 0.0 111.115 137.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.32 48.1 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 130.391 3.476 . . . . 0.0 111.217 166.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER 68.54 -32.68 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 131.635 3.974 . . . . 0.0 115.145 175.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 50.1 tp 132.86 86.36 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.108 1 C-N-CA 132.417 4.287 . . . . 0.0 106.851 -167.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.22 16.22 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 118.708 2.855 . . . . 0.0 118.708 -168.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER 68.7 128.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 129.785 3.234 . . . . 0.0 114.508 176.2 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -72.8 2.52 6.54 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 127.333 2.253 . . . . 0.0 114.09 173.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 34.6 p -80.67 170.89 15.72 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.856 1.662 . . . . 0.0 111.446 172.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -134.61 126.69 29.7 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 165.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 48.1 mm-40 -151.05 170.06 8.35 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 126.968 2.107 . . . . 0.0 108.696 -167.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -73.6 -171.77 0.92 Allowed 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.657 2.238 . . . . 0.0 109.534 166.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 51.7 t . . . . . 0 CA--C 1.545 0.781 0 CA-C-O 123.352 1.548 . . . . 0.0 113.028 -177.945 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 pp . . . . . 0 N--CA 1.473 0.702 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.62 -25.55 68.01 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.398 1.079 . . . . 0.0 113.082 -178.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 15.9 mmt180 -84.0 -41.75 16.93 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.736 0.814 . . . . 0.0 110.498 176.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -57.95 -48.53 79.68 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.326 0.65 . . . . 0.0 111.523 177.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.75 -28.2 62.68 Favored Glycine 0 CA--C 1.533 1.165 0 CA-C-N 119.005 0.821 . . . . 0.0 113.046 -178.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -87.22 -21.53 25.79 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-O 118.028 -0.987 . . . . 0.0 113.651 171.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.45 -29.28 64.68 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 121.584 1.993 . . . . 0.0 112.205 172.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.2 mp -84.11 -44.74 13.73 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 118.089 -0.958 . . . . 0.0 110.489 169.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.68 66.68 5.23 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-O 122.804 1.288 . . . . 0.0 111.467 169.209 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -136.15 139.74 30.95 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 128.318 2.647 . . . . 0.0 109.242 -175.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -55.23 -79.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 125.179 3.92 . . . . 0.0 111.811 -171.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.88 -30.84 69.43 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 117.355 -1.307 . . . . 0.0 111.486 -178.046 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 64.5 mtt85 -72.95 -37.35 67.15 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 121.299 1.863 . . . . 0.0 112.715 -177.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 36.5 t -54.3 -48.69 71.0 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 121.438 1.926 . . . . 0.0 110.301 168.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 73.8 mmt-85 -58.59 -54.12 50.68 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.022 0.929 . . . . 0.0 112.949 175.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mm -49.78 -50.21 18.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 C-N-CA 125.939 1.696 . . . . 0.0 111.67 172.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 96.3 mt -65.56 -41.61 92.78 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.597 -175.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 p -78.08 -28.4 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 CA-C-N 119.102 0.865 . . . . 0.0 112.562 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.72 -31.73 69.9 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.494 1.118 . . . . 0.0 111.627 170.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.412 ' O ' HG13 ' B' ' 34' ' ' VAL . 3.6 tp -63.58 -45.51 90.12 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 117.087 -1.435 . . . . 0.0 112.466 169.434 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.1 mt -47.63 -45.62 27.93 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 127.311 2.244 . . . . 0.0 113.856 -176.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -106.9 18.1 22.26 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 126.171 1.789 . . . . 0.0 112.317 179.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.67 -75.07 0.23 Allowed Glycine 0 N--CA 1.47 0.937 0 C-N-CA 125.94 1.734 . . . . 0.0 113.554 -175.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . 0.588 ' HB ' ' HE ' ' B' ' 74' ' ' ARG . 26.7 m 36.71 34.61 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 127.047 2.139 . . . . 0.0 116.477 -171.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.6 -59.58 2.39 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 -171.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . 0.417 ' HA ' ' HA ' ' B' ' 74' ' ' ARG . 7.7 p90 -165.89 156.59 11.68 Favored Pre-proline 0 N--CA 1.473 0.684 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -170.17 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -57.51 129.97 36.57 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.209 1.939 . . . . 0.0 108.684 169.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.98 -0.83 81.94 Favored Glycine 0 CA--C 1.532 1.103 0 CA-C-O 117.252 -1.86 . . . . 0.0 114.559 -173.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . 0.569 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -61.1 -37.56 83.17 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 121.045 2.422 . . . . 0.0 109.818 169.546 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mt -60.59 -21.07 62.22 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 124.673 1.189 . . . . 0.0 111.948 179.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.75 -27.59 69.3 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.787 -0.57 . . . . 0.0 112.149 178.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.23 -52.53 7.62 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.177 0.991 . . . . 0.0 111.474 170.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . 0.569 ' CD2' HE22 ' B' ' 39' ' ' GLN . 2.6 m-70 -54.88 -27.55 43.64 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 179.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 53.1 mt -108.29 -14.92 14.59 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.967 1.307 . . . . 0.0 113.961 -174.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.57 5.26 49.67 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.309 0.957 . . . . 0.0 114.107 -170.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 75.7 mt -105.03 137.51 42.67 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.653 1.181 . . . . 0.0 111.309 -171.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 12.6 t -60.84 152.03 28.3 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.513 -0.742 . . . . 0.0 112.16 -173.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -50.45 -42.68 54.5 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.983 1.313 . . . . 0.0 112.81 -178.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 1.5 m -64.3 -38.95 92.85 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.138 -0.977 . . . . 0.0 112.547 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -70.48 -45.83 64.92 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.256 0.623 . . . . 0.0 111.308 174.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.2 t -63.13 -31.23 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 O-C-N 120.981 -1.075 . . . . 0.0 111.694 176.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 39.2 m -56.67 -44.39 81.36 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.956 1.253 . . . . 0.0 113.056 169.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -60.74 -28.13 68.46 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.228 0.922 . . . . 0.0 112.869 176.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -78.52 -41.76 31.38 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.878 -1.139 . . . . 0.0 112.616 173.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 89.5 mt -72.28 -17.64 61.86 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.747 1.219 . . . . 0.0 114.064 174.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.3 t -58.97 -58.54 8.18 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.449 1.022 . . . . 0.0 111.601 -177.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 9.1 t -64.59 -39.27 93.43 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.714 -0.616 . . . . 0.0 111.415 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 tp -55.8 -48.43 75.4 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.917 2.487 . . . . 0.0 113.1 -177.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -80.5 -12.53 59.53 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.118 0.967 . . . . 0.0 111.859 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -82.36 -47.05 6.23 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.205 0.907 . . . . 0.0 111.307 169.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 59.8 m -67.95 -3.26 9.37 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 127.358 2.263 . . . . 0.0 114.414 174.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 62.47 22.82 64.04 Favored Glycine 0 N--CA 1.471 0.999 0 CA-C-N 119.852 1.205 . . . . 0.0 114.006 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 85.1 mt -69.5 -24.32 63.74 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.188 1.494 . . . . 0.0 112.761 171.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 1.5 m -146.82 140.57 20.12 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 C-N-CA 126.223 1.809 . . . . 0.0 111.328 -169.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 9.3 t -138.25 140.64 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 O-C-N 124.115 0.884 . . . . 0.0 110.22 -169.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.94 147.74 26.1 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.852 1.261 . . . . 0.0 113.261 174.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 45.4 m -138.15 135.55 35.81 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.892 1.677 . . . . 0.0 109.544 -177.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -79.26 120.83 24.29 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 123.977 0.798 . . . . 0.0 110.525 168.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -106.05 173.73 6.19 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.003 1.721 . . . . 0.0 109.5 175.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -68.36 23.79 0.27 Allowed Glycine 0 N--CA 1.481 1.649 0 N-CA-C 118.366 2.107 . . . . 0.0 118.366 -168.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 170.15 -9.61 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 128.929 2.891 . . . . 0.0 114.076 177.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -142.77 172.89 12.08 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.169 1.788 . . . . 0.0 108.524 -177.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 35.6 m -116.39 148.02 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 169.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . 0.588 ' HE ' ' HB ' ' B' ' 34' ' ' VAL . 0.0 OUTLIER -122.38 -179.32 4.15 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.541 0.686 . . . . 0.0 111.871 178.558 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -128.88 136.27 50.2 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 166.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . 0.437 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -134.6 161.59 34.67 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 124.6 1.16 . . . . 0.0 109.445 177.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.27 148.89 49.19 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 167.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.96 -27.97 69.2 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 115.873 1.805 . . . . 0.0 115.873 -169.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -172.94 162.42 4.69 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.234 1.813 . . . . 0.0 112.286 177.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.3 m -33.84 -38.57 0.06 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 129.524 3.13 . . . . 0.0 112.885 164.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -50.06 -58.15 6.12 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.588 1.955 . . . . 0.0 113.161 173.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 14.3 mt -72.66 -38.15 67.72 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.878 -1.139 . . . . 0.0 110.668 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -56.18 -31.37 63.35 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.975 1.31 . . . . 0.0 112.999 176.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -66.89 -66.24 0.58 Allowed 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 120.25 1.386 . . . . 0.0 111.5 171.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.48 -41.33 76.41 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.146 0.979 . . . . 0.0 112.527 -173.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -78.12 -32.47 50.46 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.27 1.828 . . . . 0.0 111.717 176.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.91 -45.59 91.99 Favored Glycine 0 N--CA 1.469 0.849 0 C-N-CA 125.637 1.589 . . . . 0.0 112.205 177.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . 0.313 19.6 pt-20 -92.05 20.0 6.26 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 167.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . 0.551 ' O ' HG13 ' B' ' 90' ' ' VAL . 24.8 tp 70.79 -42.87 0.54 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 131.057 3.743 . . . . 0.0 115.692 167.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . 0.551 HG13 ' O ' ' B' ' 89' ' ' LEU . 2.6 m 168.38 -21.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.956 1 C-N-CA 131.928 4.091 . . . . 0.0 110.581 -171.372 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 71.04 -15.73 0.39 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.454 2.302 . . . . 0.0 114.276 174.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.505 HG13 ' O ' ' B' ' 92' ' ' VAL . 3.6 p -59.21 37.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 129.408 3.083 . . . . 0.0 115.51 170.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 80.38 -24.6 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 C-N-CA 127.909 2.484 . . . . 0.0 112.682 175.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 56.0 tp 117.05 95.04 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 131.347 3.859 . . . . 0.0 105.919 -167.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.665 0 O-C-N 121.422 -0.799 . . . . 0.0 108.891 171.801 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 25.9 tp . . . . . 0 N--CA 1.474 0.746 0 CA-C-O 120.253 0.073 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.81 -3.51 12.68 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 66.5 mtt-85 -124.46 -38.44 2.41 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.06 1.344 . . . . 0.0 111.265 178.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.431 ' C ' HD13 ' A' ' 14' ' ' LEU . 1.8 tm? -50.9 -58.2 6.59 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.784 1.633 . . . . 0.0 107.941 166.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.12 -22.7 77.39 Favored Glycine 0 C--O 1.218 -0.856 0 CA-C-O 118.392 -1.227 . . . . 0.0 111.627 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.438 HH11 ' HG3' ' A' ' 16' ' ' ARG . 2.6 ttm-85 -68.75 -39.31 80.38 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 119.514 1.657 . . . . 0.0 111.688 171.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.88 -35.3 79.71 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.072 -1.018 . . . . 0.0 111.658 175.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.27 6.9 mp -87.53 10.42 17.85 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 123.536 0.734 . . . . 0.0 111.639 171.533 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -111.55 2.23 17.27 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 126.105 1.762 . . . . 0.0 113.52 166.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.418 ' CG ' ' HE ' ' A' ' 23' ' ' ARG . 7.4 t70 -105.07 136.3 19.19 Favored Pre-proline 0 CA--C 1.538 0.511 0 C-N-CA 126.08 1.752 . . . . 0.0 109.904 -172.012 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.433 ' HG2' ' H ' ' A' ' 22' ' ' THR . 55.2 Cg_endo -55.86 -62.94 0.21 Allowed 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 125.226 3.951 . . . . 0.0 111.201 -172.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.433 ' H ' ' HG2' ' A' ' 21' ' ' PRO . 85.3 m -62.6 -44.12 97.11 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 117.558 -1.211 . . . . 0.0 109.832 -174.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.418 ' HE ' ' CG ' ' A' ' 20' ' ' ASP . 30.1 mtm180 -68.51 -38.39 80.9 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 117.128 -1.415 . . . . 0.0 112.491 -175.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 88.1 m -57.97 -50.0 74.88 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 120.244 1.384 . . . . 0.0 111.02 170.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.3 ttm180 -62.54 -37.45 86.14 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 118.758 -0.639 . . . . 0.0 112.266 177.049 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.4 mt -54.04 -61.63 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 C-N-CA 125.059 1.344 . . . . 0.0 110.055 169.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 92.3 mt -56.15 -41.15 74.94 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.811 0.844 . . . . 0.0 111.501 -169.224 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.2 p -77.52 -32.43 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 175.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.79 -30.27 68.82 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 119.29 0.95 . . . . 0.0 112.507 174.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.512 ' O ' HG13 ' A' ' 34' ' ' VAL . 7.0 tp -64.47 -43.46 94.16 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 121.094 -1.004 . . . . 0.0 112.244 177.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -44.28 -36.11 2.61 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.958 2.903 . . . . 0.0 113.916 174.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -90.9 -41.08 11.36 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.3 1.84 . . . . 0.0 112.723 176.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.38 -69.93 1.3 Allowed Glycine 0 C--N 1.337 0.587 0 C-N-CA 124.026 0.822 . . . . 0.0 112.449 -168.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.577 HG12 ' HA ' ' A' ' 76' ' ' ALA . 16.3 m 37.88 33.23 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 125.371 1.469 . . . . 0.0 114.692 -167.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -83.91 -64.46 1.16 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.016 -1.053 . . . . 0.0 112.177 -171.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -156.97 157.11 30.53 Favored Pre-proline 0 N--CA 1.473 0.688 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -169.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -58.98 118.97 5.95 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.24 1.96 . . . . 0.0 108.52 171.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 90.68 1.46 73.97 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 117.335 -1.814 . . . . 0.0 114.936 -175.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.45 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -61.47 -35.83 78.74 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 121.184 2.492 . . . . 0.0 110.468 169.429 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 33.7 mt -54.45 -22.53 12.95 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 126.135 1.774 . . . . 0.0 112.077 174.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.86 -27.26 69.05 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.348 -1.47 . . . . 0.0 112.2 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.54 -57.09 4.01 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 118.203 0.456 . . . . 0.0 110.267 169.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.45 ' CD2' HE22 ' A' ' 39' ' ' GLN . 3.0 m-70 -54.57 -31.0 55.9 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 -177.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 37.5 mt -103.05 -2.67 27.12 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.968 1.307 . . . . 0.0 113.417 -175.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.24 7.83 20.76 Favored Glycine 0 CA--C 1.535 1.324 0 CA-C-N 118.968 0.804 . . . . 0.0 114.441 -175.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 36.2 mt -107.25 160.19 15.78 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.61 1.164 . . . . 0.0 112.91 -171.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.564 HG23 ' H ' ' A' ' 50' ' ' ASN . 1.2 t -62.49 144.54 55.88 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.124 -0.985 . . . . 0.0 111.768 170.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -55.46 -29.21 58.28 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 127.007 2.123 . . . . 0.0 111.602 175.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 29.8 p -72.03 -57.33 4.37 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.431 -0.793 . . . . 0.0 111.739 169.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.564 ' H ' HG23 ' A' ' 47' ' ' THR . 14.8 t30 -66.09 -26.43 67.47 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 120.075 -1.641 . . . . 0.0 113.94 -175.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 75.9 t -66.54 -35.47 74.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 CA-C-N 120.402 1.456 . . . . 0.0 111.439 167.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.9 p -77.11 -22.29 52.94 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.697 -1.252 . . . . 0.0 114.137 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 -39.64 -44.94 1.58 Allowed 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 126.239 1.815 . . . . 0.0 111.198 167.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . 0.264 11.6 m-70 -104.33 -11.02 17.39 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -173.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 80.7 mt -71.64 -21.63 61.8 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.735 -1.228 . . . . 0.0 112.695 168.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.6 t -50.96 -42.59 60.01 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.576 1.08 . . . . 0.0 113.809 178.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 48.4 t -89.85 -32.15 17.03 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 118.79 0.723 . . . . 0.0 111.771 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 tp -56.58 -40.36 75.11 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.79 0.836 . . . . 0.0 111.311 176.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -78.32 -16.43 57.73 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 175.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -88.69 -56.19 2.03 Favored Glycine 0 N--CA 1.47 0.954 0 C-N-CA 125.931 1.729 . . . . 0.0 111.883 -177.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 52.0 m -64.27 -6.66 7.29 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 125.309 1.444 . . . . 0.0 111.942 168.052 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.49 6.62 84.52 Favored Glycine 0 C--N 1.341 0.849 0 C-N-CA 124.979 1.276 . . . . 0.0 114.176 171.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.7 mt -48.41 -28.73 3.42 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.262 1.425 . . . . 0.0 113.15 170.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.7 m -132.12 143.73 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 126.173 1.789 . . . . 0.0 112.23 173.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 45.4 t -126.5 143.3 40.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 127.154 2.182 . . . . 0.0 110.047 -175.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -89.54 154.03 20.32 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.111 1.364 . . . . 0.0 113.795 173.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.4 m -163.01 161.59 25.55 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.702 1.601 . . . . 0.0 108.471 -174.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.422 ' HA ' ' HA ' ' A' ' 73' ' ' VAL . 17.4 m-85 -80.47 156.63 26.49 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 119.672 1.124 . . . . 0.0 113.05 169.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -115.41 -152.5 0.5 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.04 1.336 . . . . 0.0 108.825 166.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.02 -22.19 60.07 Favored Glycine 0 CA--C 1.537 1.414 0 CA-C-N 121.01 1.732 . . . . 0.0 115.156 -175.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.74 -23.34 0.08 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.708 1.203 . . . . 0.0 113.871 169.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -95.14 -170.24 2.15 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.484 1.914 . . . . 0.0 109.982 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' A' ' 68' ' ' TYR . 35.1 m -109.9 166.09 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 124.61 1.164 . . . . 0.0 109.959 169.282 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.0 ptt180 -140.8 171.04 14.64 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 128.178 2.591 . . . . 0.0 110.319 -170.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -124.03 139.05 54.32 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.88 1.272 . . . . 0.0 108.008 167.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.577 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -131.98 161.4 33.22 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 126.314 1.846 . . . . 0.0 109.547 175.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.0 mt -60.77 159.53 10.87 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 118.732 0.696 . . . . 0.0 110.248 169.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -42.49 -44.37 4.05 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.436 1.494 . . . . 0.0 114.334 -176.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.411 ' CG ' ' H ' ' A' ' 80' ' ' SER . 17.4 t70 -177.55 -172.35 0.36 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 129.491 3.116 . . . . 0.0 109.576 169.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.411 ' H ' ' CG ' ' A' ' 79' ' ' ASP . 14.3 t -53.37 -20.92 5.0 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 127.32 2.248 . . . . 0.0 113.396 174.185 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -46.92 87.76 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.224 1.009 . . . . 0.0 111.692 176.406 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 8.8 mt -86.52 -31.99 20.98 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.193 0.906 . . . . 0.0 111.202 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.58 -28.6 65.69 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.036 0.835 . . . . 0.0 112.893 170.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.9 mmt180 -69.33 -65.68 0.68 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.256 1.422 . . . . 0.0 112.002 169.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.83 -19.54 64.18 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -175.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.34 -38.82 14.82 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.6 -1.312 . . . . 0.0 111.949 167.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.47 -52.71 20.16 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 126.361 1.934 . . . . 0.0 114.372 -177.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.26 -6.89 56.32 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.562 1.181 . . . . 0.0 112.56 169.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 18.8 tp 77.79 128.47 0.05 OUTLIER 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 129.393 3.077 . . . . 0.0 113.201 167.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.415 ' HB ' HG22 ' A' ' 92' ' ' VAL . 2.4 m -34.13 -21.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 131.129 3.771 . . . . 0.0 116.532 170.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 76.57 -9.9 1.41 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.287 1.835 . . . . 0.0 114.063 165.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.415 HG22 ' HB ' ' A' ' 90' ' ' VAL . 17.3 m -64.57 57.44 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.717 1 C-N-CA 132.497 4.319 . . . . 0.0 112.159 169.704 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . 0.396 0.5 OUTLIER 19.04 44.86 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.424 -1.762 0 CA-C-N 108.581 -3.918 . . . . 0.0 116.272 -162.805 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 50.8 tp 61.29 83.91 0.14 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.851 2.061 . . . . 0.0 111.674 -169.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.69 85.76 0.05 OUTLIER 'General case' 0 CA--C 1.55 0.948 0 O-C-N 121.057 -1.027 . . . . 0.0 111.712 170.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 89.9 t -59.04 153.94 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 127.829 2.452 . . . . 0.0 111.199 169.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -42.96 1.79 0.0 OUTLIER 'General case' 0 CA--C 1.565 1.524 1 C-N-CA 131.727 4.011 . . . . 0.0 117.162 169.885 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -97.17 146.82 24.7 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 128.23 2.612 . . . . 0.0 116.501 -169.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -89.21 73.29 8.11 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.967 1.707 . . . . 0.0 109.759 167.012 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -65.64 146.91 98.95 Favored Pre-proline 0 CA--C 1.549 0.907 0 O-C-N 120.845 -1.16 . . . . 0.0 109.93 169.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.67 97.17 0.78 Allowed 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.477 2.785 . . . . 0.0 112.746 -178.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.557 1.24 0 C-N-CA 129.452 3.101 . . . . 0.0 116.155 -178.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 19.0 tp . . . . . 0 N--CA 1.472 0.675 0 CA-C-O 120.504 0.192 . . . . 0.0 110.691 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.48 -3.07 3.87 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 116.416 2.006 . . . . 0.0 116.416 178.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 66.2 mtt-85 -124.29 -42.21 2.13 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.004 1.321 . . . . 0.0 110.757 -179.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.425 HD13 ' C ' ' B' ' 14' ' ' LEU . 0.9 OUTLIER -53.73 -52.89 58.67 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.94 1.696 . . . . 0.0 108.763 168.283 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.52 -23.19 78.34 Favored Glycine 0 C--O 1.222 -0.649 0 CA-C-O 118.645 -1.086 . . . . 0.0 111.392 -178.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.402 HH11 ' HG3' ' B' ' 16' ' ' ARG . 2.1 ttm-85 -68.37 -44.51 75.04 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.214 1.507 . . . . 0.0 110.515 168.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.99 -30.13 70.63 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.987 0.812 . . . . 0.0 112.511 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 5.9 mp -93.42 9.56 35.97 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 124.335 1.054 . . . . 0.0 113.095 169.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -111.6 1.63 16.91 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.625 1.57 . . . . 0.0 112.16 165.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -75.19 146.3 81.61 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 126.034 1.734 . . . . 0.0 112.371 -169.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -59.31 -19.3 49.92 Favored 'Trans proline' 0 C--N 1.349 0.571 1 C-N-CA 125.479 4.119 . . . . 0.0 116.073 179.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -143.09 -30.57 0.51 Allowed 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.121 -176.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.584 ' HG2' HD13 ' B' ' 58' ' ' LEU . 0.0 OUTLIER -61.11 -30.6 70.46 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.359 1.436 . . . . 0.0 112.744 176.974 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 88.0 m -53.4 -52.76 58.32 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.581 1.152 . . . . 0.0 111.134 168.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 12.5 ttm180 -61.53 -43.19 99.31 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.274 1.03 . . . . 0.0 112.413 173.288 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . 0.648 HG12 HD11 ' B' ' 44' ' ' LEU . 2.5 mt -51.36 -57.65 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 C-N-CA 124.734 1.214 . . . . 0.0 110.839 174.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 86.4 mt -55.81 -44.34 77.75 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.501 1.12 . . . . 0.0 111.817 -175.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 8.8 p -76.45 -31.41 20.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 CA-C-N 119.373 0.988 . . . . 0.0 113.1 178.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . 0.423 ' HB1' ' CD2' ' B' ' 43' ' ' HIS . . . -72.13 -31.51 66.07 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.716 -0.615 . . . . 0.0 111.985 174.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' B' ' 30' ' ' LEU . 10.7 tp -60.64 -41.27 94.6 Favored 'General case' 0 C--N 1.341 0.221 0 O-C-N 120.924 -1.11 . . . . 0.0 112.828 178.366 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -43.33 -36.74 1.98 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 129.377 3.071 . . . . 0.0 113.423 173.17 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -90.33 -34.17 15.81 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.447 1.899 . . . . 0.0 112.697 178.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -93.38 -68.27 1.09 Allowed Glycine 0 C--N 1.338 0.676 0 C-N-CA 123.706 0.669 . . . . 0.0 114.105 -168.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . 0.409 HG12 ' HA ' ' B' ' 76' ' ' ALA . 31.2 m 36.78 33.98 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 C-N-CA 126.47 1.908 . . . . 0.0 115.311 -167.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.04 -63.6 1.35 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.456 -0.778 . . . . 0.0 113.064 -169.022 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . 0.41 ' HA ' ' HA ' ' B' ' 74' ' ' ARG . 6.0 p90 -161.1 161.31 24.0 Favored Pre-proline 0 C--O 1.24 0.59 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 -169.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -58.65 127.16 23.52 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.288 1.992 . . . . 0.0 107.601 167.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.47 2.93 90.7 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-O 117.321 -1.822 . . . . 0.0 114.782 -175.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . 0.524 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -62.8 -41.07 99.12 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 121.279 2.539 . . . . 0.0 110.394 169.731 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 29.7 mt -54.66 -19.07 5.38 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 125.647 1.579 . . . . 0.0 112.958 176.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.89 -32.47 67.74 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.571 1.078 . . . . 0.0 112.553 172.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.81 -51.29 11.61 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.286 0.634 . . . . 0.0 111.96 170.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . 0.524 ' CD2' HE22 ' B' ' 39' ' ' GLN . 3.7 m-70 -56.03 -24.29 38.37 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.997 1.481 . . . . 0.0 114.997 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.648 HD11 HG12 ' B' ' 26' ' ' ILE . 56.4 mt -112.29 -4.16 14.39 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.845 1.658 . . . . 0.0 113.277 -177.067 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 61.05 7.81 9.62 Favored Glycine 0 CA--C 1.536 1.377 0 CA-C-O 119.013 -0.881 . . . . 0.0 114.818 -172.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 16.2 mt -102.04 162.44 12.91 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.703 1.601 . . . . 0.0 113.067 -169.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.494 HG23 ' H ' ' B' ' 50' ' ' ASN . 1.5 t -61.57 138.5 58.3 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 121.237 -0.914 . . . . 0.0 111.24 172.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 66.7 mtt180 -49.93 -31.62 12.84 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.561 1.945 . . . . 0.0 111.936 173.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 60.7 p -72.47 -52.39 15.99 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 118.664 0.665 . . . . 0.0 112.724 173.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . 0.494 ' H ' HG23 ' B' ' 47' ' ' THR . 44.2 t30 -69.5 -25.57 64.12 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 120.662 1.573 . . . . 0.0 113.259 -179.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . 0.543 HG22 HD12 ' B' ' 44' ' ' LEU . 37.2 t -61.1 -51.87 68.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 O-C-N 121.514 -0.741 . . . . 0.0 109.436 167.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 78.0 p -75.77 -27.56 58.09 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 115.741 1.756 . . . . 0.0 115.741 -176.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -36.86 -56.15 0.87 Allowed 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 123.984 1.85 . . . . 0.0 109.895 168.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 27.4 m-70 -90.43 -4.33 57.08 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -178.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 86.9 mt -72.19 -16.64 61.96 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.73 -1.231 . . . . 0.0 108.979 164.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 21.3 t -49.92 -42.11 47.5 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.911 1.232 . . . . 0.0 112.64 168.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 7.2 t -84.34 -44.84 13.4 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 119.478 1.035 . . . . 0.0 112.03 178.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . 0.584 HD13 ' HG2' ' B' ' 23' ' ' ARG . 6.9 tp -56.71 -34.61 67.64 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.382 0.673 . . . . 0.0 111.683 -176.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 38.3 mtm105 -81.68 -31.46 32.23 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.121 0.968 . . . . 0.0 113.551 174.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.5 -50.14 39.67 Favored Glycine 0 N--CA 1.473 1.116 0 CA-C-N 119.253 0.933 . . . . 0.0 111.931 177.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 56.9 m -65.95 -0.63 2.43 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 125.737 1.615 . . . . 0.0 113.115 172.013 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.04 -8.78 10.82 Favored Glycine 0 C--N 1.342 0.863 0 C-N-CA 125.67 1.605 . . . . 0.0 114.88 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 20.7 mt -52.33 -28.12 18.05 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.819 1.647 . . . . 0.0 113.59 -176.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.414 HG12 ' CD2' ' B' ' 30' ' ' LEU . 3.0 m -125.98 141.64 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 126.624 1.97 . . . . 0.0 112.036 167.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 64.7 t -132.58 141.73 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 127.376 2.27 . . . . 0.0 109.557 -174.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.67 164.43 22.83 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.971 1.309 . . . . 0.0 113.175 178.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.44 ' HB ' ' HG2' ' B' ' 74' ' ' ARG . 0.2 OUTLIER -165.89 173.1 10.88 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.325 1.05 . . . . 0.0 108.671 178.896 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -94.9 157.15 16.04 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.21 0.604 . . . . 0.0 110.196 164.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -120.92 -151.03 0.47 Allowed 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.282 1.433 . . . . 0.0 109.321 167.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.6 -24.61 59.91 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-N 120.719 1.599 . . . . 0.0 115.105 -174.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.79 -21.94 0.08 Allowed 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 118.628 1.214 . . . . 0.0 113.93 168.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -97.1 -174.21 2.9 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.307 1.843 . . . . 0.0 109.78 -178.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 34.6 m -105.46 162.02 4.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.514 1.125 . . . . 0.0 109.482 168.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . 0.44 ' HG2' ' HB ' ' B' ' 67' ' ' THR . 6.7 ptt180 -137.54 175.45 9.59 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 126.928 2.091 . . . . 0.0 111.039 -171.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -129.14 141.41 51.19 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.435 1.094 . . . . 0.0 109.032 166.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . 0.409 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -138.47 159.77 41.22 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 125.855 1.662 . . . . 0.0 110.113 178.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 50.0 mt -58.21 152.62 16.74 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 122.699 0.4 . . . . 0.0 111.362 172.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -46.89 -46.64 21.31 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.834 1.654 . . . . 0.0 114.01 -174.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -162.3 166.12 25.74 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 127.014 2.126 . . . . 0.0 108.58 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 8.0 t -52.12 -20.11 2.33 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.035 1.334 . . . . 0.0 113.322 168.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.54 -48.07 82.08 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.86 1.664 . . . . 0.0 113.428 170.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 18.2 mt -75.96 -35.37 59.69 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 119.578 1.081 . . . . 0.0 110.084 176.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.17 -28.59 66.75 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 118.848 0.749 . . . . 0.0 112.823 173.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 12.0 mmt180 -76.15 -64.31 1.13 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.679 1.591 . . . . 0.0 112.314 174.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.81 -22.46 64.18 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -178.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.35 -45.12 13.1 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.262 -0.899 . . . . 0.0 111.097 168.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.59 -49.21 45.4 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.895 1.712 . . . . 0.0 115.006 -173.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.9 -5.23 55.17 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.644 1.222 . . . . 0.0 112.292 169.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 17.9 tp 77.49 127.58 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 128.825 2.85 . . . . 0.0 113.294 168.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . 0.414 ' HB ' HG22 ' B' ' 92' ' ' VAL . 2.2 m -35.71 -19.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 131.234 3.814 . . . . 0.0 115.951 168.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 75.37 -7.48 1.77 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 127.272 2.229 . . . . 0.0 114.273 167.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.414 HG22 ' HB ' ' B' ' 90' ' ' VAL . 13.5 m -69.45 60.29 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.616 1 C-N-CA 131.715 4.006 . . . . 0.0 112.069 174.055 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.39 0.5 OUTLIER 21.79 38.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.425 -1.697 2 CA-C-N 107.302 -4.499 . . . . 0.0 116.461 -163.375 . . . . . . . . 4 3 . 1 . 017 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 37.8 tp 64.39 73.8 0.42 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.023 1.729 . . . . 0.0 111.511 -169.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.955 0 O-C-N 120.764 -1.21 . . . . 0.0 111.91 169.696 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.1 tt . . . . . 0 N--CA 1.471 0.579 0 CA-C-O 120.807 0.337 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.41 -9.28 32.25 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.2 mmp_? -96.2 -58.53 2.05 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.376 -0.828 . . . . 0.0 108.983 165.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.411 ' CD2' HD21 ' A' ' 63' ' ' LEU . 1.6 tm? -59.94 -54.49 45.5 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.246 1.418 . . . . 0.0 111.878 -173.12 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.91 -28.79 73.96 Favored Glycine 0 CA--C 1.528 0.864 0 O-C-N 121.647 -0.658 . . . . 0.0 113.015 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 54.8 ttt-85 -74.9 -26.93 60.0 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.119 0.967 . . . . 0.0 111.78 174.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -87.21 -3.92 59.08 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.293 1.037 . . . . 0.0 113.616 172.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.1 mt -99.42 -24.22 14.86 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.747 1.219 . . . . 0.0 110.857 168.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.38 82.78 3.17 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.205 1.402 . . . . 0.0 114.166 -174.032 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -150.82 154.26 34.49 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 125.743 1.617 . . . . 0.0 111.229 -176.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -57.74 -67.4 0.07 OUTLIER 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 124.103 3.202 . . . . 0.0 112.025 175.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 55.9 m -74.2 -43.71 56.13 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.386 1.074 . . . . 0.0 111.241 -177.012 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.535 ' CD ' HD13 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -60.17 -32.83 71.43 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 118.343 -0.837 . . . . 0.0 112.704 -175.486 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.5 t -56.54 -53.45 57.38 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.292 0.951 . . . . 0.0 111.072 168.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -57.76 -46.28 84.74 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.747 -0.596 . . . . 0.0 112.49 175.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.7 mt -45.33 -56.48 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-N 118.677 0.671 . . . . 0.0 110.075 173.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 27' ' ' LEU . 21.5 mt -65.77 -32.78 74.51 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -169.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.6 m -66.85 -34.63 71.24 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 CA-C-N 120.435 1.471 . . . . 0.0 111.62 170.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.52 -6.15 57.77 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.078 1.351 . . . . 0.0 113.766 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -80.5 -48.11 13.28 Favored 'General case' 0 CA--C 1.519 -0.242 0 C-N-CA 125.262 1.425 . . . . 0.0 109.219 -178.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.0 mt -48.38 -59.36 3.52 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.913 2.485 . . . . 0.0 110.873 172.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -85.95 26.67 0.97 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.636 1.575 . . . . 0.0 111.827 174.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.07 -87.28 0.7 Allowed Glycine 0 C--N 1.337 0.601 0 C-N-CA 125.469 1.509 . . . . 0.0 111.274 -173.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.467 HG12 ' HA ' ' A' ' 76' ' ' ALA . 26.9 m 36.6 22.5 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 N-CA-C 118.826 2.899 . . . . 0.0 118.826 -179.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 98.5 m -83.72 -67.08 0.82 Allowed 'General case' 0 N--CA 1.471 0.579 0 O-C-N 120.137 -1.602 . . . . 0.0 112.887 -177.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.4 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 45.4 p90 -156.57 162.15 28.11 Favored Pre-proline 0 CA--C 1.544 0.749 0 O-C-N 121.25 -0.906 . . . . 0.0 113.015 -172.283 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -56.79 109.98 0.52 Allowed 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.607 2.871 . . . . 0.0 111.304 175.357 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 90.99 7.75 65.62 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-O 117.464 -1.742 . . . . 0.0 115.532 -175.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.4 ' HG2' ' H ' ' A' ' 36' ' ' TYR . 0.0 OUTLIER -59.66 -37.22 78.15 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 120.582 2.191 . . . . 0.0 110.564 168.799 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 20.3 mt -50.76 -26.21 5.34 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 126.054 1.741 . . . . 0.0 112.562 173.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.64 -36.95 77.4 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.895 -0.574 . . . . 0.0 112.253 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -42.58 62.33 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.233 0.469 . . . . 0.0 111.527 175.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.4 m-70 -60.13 -32.58 71.15 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 176.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 16.8 mt -105.6 -21.28 13.23 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -172.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.79 2.51 64.98 Favored Glycine 0 CA--C 1.536 1.374 0 CA-C-N 119.323 0.965 . . . . 0.0 114.331 -171.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -98.13 142.28 30.02 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.282 1.433 . . . . 0.0 109.759 175.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.8 p -61.4 150.94 33.79 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.136 -0.977 . . . . 0.0 111.853 -173.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -59.43 -19.83 50.39 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 175.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -78.17 -46.25 21.04 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 118.937 0.79 . . . . 0.0 110.981 171.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -65.73 -45.08 83.99 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.363 1.065 . . . . 0.0 112.552 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 80.9 t -61.22 -39.17 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 CA-C-N 118.53 0.604 . . . . 0.0 111.504 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 69.6 m -66.26 -26.46 67.36 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -178.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -51.32 -37.27 46.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.902 1.281 . . . . 0.0 111.727 170.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -90.34 -12.38 37.86 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 176.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 95.0 mt -81.23 -27.71 35.14 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 117.922 -1.037 . . . . 0.0 111.675 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.42 -37.47 83.62 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 121.0 1.727 . . . . 0.0 113.467 -177.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 51.5 t -86.48 -15.33 40.47 Favored 'General case' 0 CA--C 1.558 1.265 0 O-C-N 120.827 -1.171 . . . . 0.0 111.718 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.535 HD13 ' CD ' ' A' ' 23' ' ' ARG . 7.4 tp -68.11 -41.79 81.23 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 119.579 -1.95 . . . . 0.0 108.895 167.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 45.5 mtm180 -78.44 -13.51 59.81 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.066 1.746 . . . . 0.0 112.292 176.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -96.07 -57.38 1.15 Allowed Glycine 0 N--CA 1.47 0.901 0 C-N-CA 125.97 1.748 . . . . 0.0 111.659 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.7 m -74.48 23.63 0.09 Allowed 'General case' 0 CA--C 1.566 1.58 0 C-N-CA 125.098 1.359 . . . . 0.0 112.854 173.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 59.2 28.73 64.61 Favored Glycine 0 N--CA 1.476 1.313 0 C-N-CA 127.152 2.31 . . . . 0.0 117.482 167.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.411 HD21 ' CD2' ' A' ' 14' ' ' LEU . 70.6 mt -82.21 -30.14 31.02 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.187 0.995 . . . . 0.0 113.324 177.225 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.0 m -133.33 144.93 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.951 1.7 . . . . 0.0 111.092 -178.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 72.0 t -129.09 139.95 50.51 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 126.295 1.838 . . . . 0.0 109.179 -175.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.94 142.92 52.83 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.577 1.151 . . . . 0.0 112.267 172.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 16.8 m -155.58 155.38 33.24 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.438 1.095 . . . . 0.0 108.233 176.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.23 125.71 31.25 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 119.379 0.99 . . . . 0.0 109.144 167.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.42 -16.32 63.87 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.525 1.057 . . . . 0.0 113.525 175.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 154.71 -32.89 0.68 Allowed Glycine 0 CA--C 1.531 1.087 0 C-N-CA 126.804 2.145 . . . . 0.0 112.153 -179.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.48 -21.45 0.2 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.346 1.458 . . . . 0.0 113.376 172.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -104.59 169.26 8.56 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.393 2.277 . . . . 0.0 110.028 174.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 10.0 p -92.58 145.52 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.621 0.768 . . . . 0.0 110.948 173.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -131.27 164.4 25.67 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.139 1.775 . . . . 0.0 110.855 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -115.93 120.02 37.83 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.265 1.026 . . . . 0.0 108.547 167.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.467 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -121.76 155.37 35.42 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 118.59 0.632 . . . . 0.0 112.191 175.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 tp -52.82 140.71 23.42 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.855 1.262 . . . . 0.0 109.626 173.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.57 -31.55 72.66 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -171.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -164.79 179.56 6.46 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 -178.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 20.1 m -55.89 -33.03 64.24 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.088 1.755 . . . . 0.0 114.208 171.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -68.74 -45.02 72.56 Favored 'General case' 0 C--N 1.344 0.333 0 CA-C-N 119.926 1.239 . . . . 0.0 112.467 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.9 mt -69.94 -40.65 75.37 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 120.13 1.332 . . . . 0.0 109.881 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.9 -35.15 75.92 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.455 0.702 . . . . 0.0 109.877 -178.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -71.95 -50.2 31.02 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 126.377 1.871 . . . . 0.0 112.649 172.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.94 -46.63 77.48 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 121.115 1.779 . . . . 0.0 111.593 -177.266 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.4 -51.27 70.22 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.715 0.806 . . . . 0.0 109.647 171.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -79.99 21.69 4.71 Favored Glycine 0 CA--C 1.537 1.462 0 C-N-CA 126.465 1.983 . . . . 0.0 114.699 -179.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 23.5 tp10 -101.8 -65.49 0.98 Allowed 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 126.427 1.891 . . . . 0.0 108.782 167.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 7.7 tp 165.85 -29.34 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.95 1.7 . . . . 0.0 112.021 -167.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.293 22.9 t 58.39 11.59 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 127.514 2.326 . . . . 0.0 111.837 -166.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.467 ' C ' ' H ' ' A' ' 93' ' ' VAL . 1.8 tp-100 88.01 -19.32 0.23 Allowed 'General case' 0 C--O 1.218 -0.575 0 O-C-N 120.315 -1.49 . . . . 0.0 109.452 135.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.9 p -75.01 37.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 127.338 2.255 . . . . 0.0 110.268 163.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.467 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.6 t 71.19 -8.9 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 C-N-CA 127.776 2.43 . . . . 0.0 114.106 174.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 99.02 102.75 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 131.112 3.765 . . . . 0.0 107.865 -169.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.13 137.6 58.23 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.251 1.821 . . . . 0.0 115.179 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 25.4 m -74.97 162.39 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 126.53 1.932 . . . . 0.0 113.906 171.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.03 -41.13 97.53 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 128.738 2.815 . . . . 0.0 115.235 178.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 23.6 p -71.26 76.77 0.72 Allowed 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.767 1.167 . . . . 0.0 111.007 170.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . 0.267 1.8 p-10 -71.43 80.3 0.77 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 123.799 1.762 . . . . 0.0 109.473 169.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -61.2 138.42 94.45 Favored Pre-proline 0 CA--C 1.545 0.762 0 CA-C-N 114.205 -1.362 . . . . 0.0 109.894 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.76 160.49 49.52 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 123.97 3.114 . . . . 0.0 116.077 -166.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 8.1 t . . . . . 0 C--N 1.347 0.476 0 C-N-CA 125.721 1.608 . . . . 0.0 111.303 -169.114 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 tt . . . . . 0 N--CA 1.473 0.709 0 CA-C-O 120.637 0.256 . . . . 0.0 111.235 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.28 -11.36 30.97 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 178.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 13.0 mmp_? -98.2 -56.2 2.55 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.227 1.011 . . . . 0.0 109.663 167.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -60.49 -51.58 68.84 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.369 1.468 . . . . 0.0 111.618 -173.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.97 -34.1 89.0 Favored Glycine 0 CA--C 1.529 0.952 0 C-N-CA 124.094 0.854 . . . . 0.0 112.976 175.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -70.19 -36.58 74.73 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.208 1.004 . . . . 0.0 111.109 175.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.3 -24.65 60.43 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.971 0.908 . . . . 0.0 112.745 175.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 11.7 mt -77.89 -29.87 50.48 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.414 1.086 . . . . 0.0 111.387 168.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -99.93 50.37 0.91 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.465 1.506 . . . . 0.0 114.436 -171.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -114.87 149.72 42.9 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 127.21 2.204 . . . . 0.0 108.593 174.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -61.48 -52.84 2.78 Favored 'Trans proline' 0 CA--C 1.534 0.485 0 C-N-CA 124.317 3.345 . . . . 0.0 111.888 -171.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.437 ' HB ' ' CD2' ' B' ' 54' ' ' HIS . 15.9 m -76.6 -41.63 45.43 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 117.866 -1.064 . . . . 0.0 110.759 177.124 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 22.3 mtm180 -59.51 -36.9 76.98 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 120.177 1.353 . . . . 0.0 112.963 -176.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 53.8 t -48.79 -55.92 10.17 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.547 0.739 . . . . 0.0 110.37 169.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . 0.493 ' HB3' HD22 ' B' ' 44' ' ' LEU . 7.9 mpt_? -57.93 -51.86 67.9 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 118.502 -0.761 . . . . 0.0 113.027 172.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 3.8 mt -44.7 -55.69 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 CA-C-N 119.387 0.994 . . . . 0.0 109.6 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 29.2 mt -64.26 -38.11 89.87 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 116.701 -1.618 . . . . 0.0 114.374 -169.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -65.92 -35.44 75.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 CA-C-N 120.88 1.673 . . . . 0.0 111.296 172.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.58 -13.44 56.54 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.793 1.237 . . . . 0.0 113.821 179.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.45 -47.08 28.84 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.045 0.938 . . . . 0.0 109.748 -175.279 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 mt -48.46 -48.35 37.66 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 128.735 2.814 . . . . 0.0 112.382 172.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -94.79 18.81 11.06 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.052 1.741 . . . . 0.0 111.968 175.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.73 -85.46 1.08 Allowed Glycine 0 C--O 1.222 -0.609 0 C-N-CA 125.343 1.449 . . . . 0.0 111.16 -172.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . 0.461 HG12 ' HA ' ' B' ' 76' ' ' ALA . 11.5 m 32.15 27.57 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 N-CA-C 118.761 2.874 . . . . 0.0 118.761 -174.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 73.1 m -81.82 -75.99 0.27 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 120.941 1.7 . . . . 0.0 111.497 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -155.72 166.52 16.13 Favored Pre-proline 0 CA--C 1.55 0.968 0 O-C-N 120.55 -1.344 . . . . 0.0 113.052 -170.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.18 89.73 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 124.756 3.637 . . . . 0.0 113.017 177.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 123.83 -4.97 9.14 Favored Glycine 0 C--O 1.221 -0.67 0 CA-C-O 117.309 -1.828 . . . . 0.0 115.624 -176.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . 0.486 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -57.75 -34.99 70.12 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 120.425 2.113 . . . . 0.0 112.426 175.563 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 23.2 mt -53.85 -22.68 10.32 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 124.669 1.188 . . . . 0.0 112.445 177.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.33 88.84 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 118.926 -0.559 . . . . 0.0 111.938 -177.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.3 -34.86 65.96 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 122.999 0.52 . . . . 0.0 112.02 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . 0.486 ' CD2' HE22 ' B' ' 39' ' ' GLN . 5.4 m-70 -65.54 -27.61 68.57 Favored 'General case' 0 CA--C 1.553 1.067 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 174.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.493 HD22 ' HB3' ' B' ' 25' ' ' ARG . 15.1 mt -114.7 -20.39 10.68 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.684 1.364 . . . . 0.0 114.684 -170.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.94 -2.1 61.19 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 125.204 1.383 . . . . 0.0 114.417 -171.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -93.96 143.72 26.1 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.693 1.197 . . . . 0.0 110.113 176.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.4 p -61.52 149.99 37.21 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 121.14 -0.975 . . . . 0.0 111.175 -177.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -60.8 -19.25 59.17 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 174.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 6.5 t -77.24 -37.66 52.74 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 118.752 0.705 . . . . 0.0 112.185 170.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -74.68 -47.91 29.03 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.751 0.821 . . . . 0.0 111.424 175.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 63.2 t -58.92 -38.1 71.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-N 119.643 1.11 . . . . 0.0 111.803 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 55.5 m -66.6 -21.52 66.13 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -56.38 -51.19 69.24 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 122.947 1.356 . . . . 0.0 109.835 174.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . 0.437 ' CD2' ' HB ' ' B' ' 22' ' ' THR . 55.4 m-70 -73.84 -8.92 57.89 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 172.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 95.6 mt -83.25 -22.69 33.0 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 117.358 -1.306 . . . . 0.0 112.285 173.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.34 -37.81 81.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 121.201 1.819 . . . . 0.0 112.627 178.243 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 48.5 t -91.06 -13.74 32.61 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 118.129 0.422 . . . . 0.0 111.32 176.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 4.9 tp -70.34 -42.99 71.14 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 119.461 -2.024 . . . . 0.0 109.286 167.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 37.1 mtm105 -83.07 -5.98 59.31 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.966 1.706 . . . . 0.0 112.519 174.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.22 -65.11 1.12 Allowed Glycine 0 C--N 1.336 0.536 0 N-CA-C 109.409 -1.477 . . . . 0.0 109.409 174.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 60.6 m -72.22 26.43 0.05 Allowed 'General case' 0 CA--C 1.564 1.482 0 C-N-CA 126.517 1.927 . . . . 0.0 113.287 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.95 20.76 58.07 Favored Glycine 0 N--CA 1.474 1.18 0 C-N-CA 127.515 2.483 . . . . 0.0 117.409 167.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 60.4 mt -77.65 -35.9 52.06 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.885 0.874 . . . . 0.0 113.205 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 1.7 m -126.64 142.07 44.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 126.273 1.829 . . . . 0.0 111.225 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 54.6 t -123.76 138.31 53.94 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 127.068 2.147 . . . . 0.0 108.85 -178.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.06 139.99 38.0 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 123.976 0.91 . . . . 0.0 111.317 176.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 41.1 m -152.48 159.58 43.33 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.584 1.554 . . . . 0.0 107.128 -174.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -87.86 135.69 33.28 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.497 1.499 . . . . 0.0 112.246 169.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -78.13 45.2 0.53 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.269 1.428 . . . . 0.0 109.808 167.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 76.51 -46.5 2.27 Favored Glycine 0 CA--C 1.534 1.262 0 O-C-N 120.204 -1.56 . . . . 0.0 113.011 -169.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -126.37 -46.43 1.62 Allowed 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.725 1.263 . . . . 0.0 114.073 -173.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -97.9 175.49 6.12 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.896 1.225 . . . . 0.0 110.504 173.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 14.9 p -93.34 141.29 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.255 1.022 . . . . 0.0 111.26 174.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 29.4 ptt180 -125.38 163.11 23.31 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 127.477 2.311 . . . . 0.0 110.853 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -113.19 118.82 35.76 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.993 0.917 . . . . 0.0 108.728 168.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . 0.461 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -119.09 152.26 36.8 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.077 0.951 . . . . 0.0 111.355 178.243 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 tp -52.77 141.69 20.69 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.95 0.9 . . . . 0.0 109.989 171.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.54 -32.28 72.1 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -172.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -164.94 176.1 8.95 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 22.5 m -52.23 -31.66 33.22 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.104 1.762 . . . . 0.0 114.501 171.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 7.9 m-70 -72.19 -44.37 63.1 Favored 'General case' 0 C--N 1.345 0.37 0 CA-C-O 117.286 -1.34 . . . . 0.0 112.822 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 9.5 mt -69.13 -40.28 78.38 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 120.665 1.575 . . . . 0.0 109.701 174.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.23 -38.7 84.19 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.612 0.765 . . . . 0.0 109.874 -179.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 4.8 tpm_? -71.36 -50.13 35.3 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.571 1.549 . . . . 0.0 112.776 171.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.61 -44.36 86.76 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 121.589 1.995 . . . . 0.0 111.657 -173.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.67 -53.26 58.48 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.616 1.167 . . . . 0.0 109.45 170.545 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.46 -7.86 83.25 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.175 1.369 . . . . 0.0 115.63 -172.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 28.1 tp10 -69.07 -63.51 1.05 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 126.387 1.875 . . . . 0.0 109.016 169.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 10.7 tp 163.22 -26.59 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.838 2.055 . . . . 0.0 113.232 -170.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . 0.305 42.1 t 58.17 11.97 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 126.827 2.051 . . . . 0.0 111.935 -164.065 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . 0.432 ' C ' ' H ' ' B' ' 93' ' ' VAL . 3.0 tp-100 86.34 -23.06 0.15 Allowed 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 125.136 1.374 . . . . 0.0 110.818 135.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.6 p -69.01 33.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 C-N-CA 129.068 2.947 . . . . 0.0 112.444 168.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . 0.432 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.3 OUTLIER 67.88 11.56 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 126.966 2.106 . . . . 0.0 113.402 176.0 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 tt 91.97 101.23 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 130.228 3.411 . . . . 0.0 109.709 -176.039 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.802 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -178.715 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.47 0.562 0 CA-C-O 118.698 -0.668 . . . . 0.0 111.482 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.82 -44.15 90.8 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.652 1.115 . . . . 0.0 112.569 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -64.58 -61.21 2.35 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.704 -0.622 . . . . 0.0 111.312 172.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -52.67 63.99 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.757 1.623 . . . . 0.0 110.272 -171.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.63 -32.49 71.01 Favored Glycine 0 CA--C 1.529 0.942 0 CA-C-O 118.672 -1.071 . . . . 0.0 113.411 -170.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -33.87 66.18 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.412 1.606 . . . . 0.0 111.19 175.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.13 -31.25 71.57 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 118.648 0.658 . . . . 0.0 111.754 176.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.7 mp -84.48 -30.31 25.31 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 118.567 -0.73 . . . . 0.0 111.496 174.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.12 60.65 1.05 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.374 1.47 . . . . 0.0 113.961 171.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -153.26 155.14 31.59 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 124.663 1.185 . . . . 0.0 109.042 174.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -59.76 -95.24 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.76 1 C-N-CA 126.156 4.571 . . . . 0.0 113.733 -166.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.6 p -44.92 -30.09 0.94 Allowed 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 127.386 2.274 . . . . 0.0 113.436 169.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.3 ttm105 -73.74 -43.16 59.89 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.076 0.853 . . . . 0.0 112.407 -175.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 8.2 t -54.21 -51.96 62.77 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.547 0.739 . . . . 0.0 109.346 166.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -52.17 -50.78 61.15 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.35 1.06 . . . . 0.0 113.2 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.7 mm -50.76 -48.12 28.19 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 124.049 0.94 . . . . 0.0 111.736 174.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 77.4 mt -65.22 -48.23 74.06 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 118.726 0.694 . . . . 0.0 112.278 -176.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.1 p -69.42 -27.42 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 123.483 0.713 . . . . 0.0 112.301 179.018 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.21 -38.46 66.08 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.75 0.82 . . . . 0.0 111.697 169.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.527 ' O ' HG13 ' A' ' 34' ' ' VAL . 3.3 tp -64.61 -28.75 69.84 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 120.308 1.413 . . . . 0.0 114.569 -175.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 mt -42.32 -30.02 0.29 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.88 1.672 . . . . 0.0 112.614 169.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -110.74 -32.43 6.86 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 126.987 2.115 . . . . 0.0 111.446 167.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.22 8.06 34.01 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 128.711 3.053 . . . . 0.0 116.034 -166.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.574 HG12 ' HA ' ' A' ' 76' ' ' ALA . 23.5 m -58.87 26.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.029 0 C-N-CA 127.215 2.206 . . . . 0.0 116.583 168.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 73.6 m -82.44 -81.86 0.15 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.425 1.09 . . . . 0.0 111.464 172.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.23 156.54 78.01 Favored Pre-proline 0 N--CA 1.47 0.568 0 CA-C-O 118.11 -0.948 . . . . 0.0 111.461 -172.112 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -56.92 -36.31 99.01 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.035 2.49 . . . . 0.0 113.448 -174.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -85.3 1.52 88.52 Favored Glycine 0 CA--C 1.533 1.217 0 CA-C-O 118.554 -1.137 . . . . 0.0 115.327 177.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.29 -30.4 66.22 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.807 1.804 . . . . 0.0 113.28 -170.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mt -60.3 -16.9 38.66 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.091 0.557 . . . . 0.0 111.81 -179.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.32 -36.87 76.42 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.812 0.845 . . . . 0.0 111.702 175.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -51.73 16.57 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.01 0.924 . . . . 0.0 111.313 175.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -55.94 -33.35 64.66 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 21.7 mt -105.37 -15.68 14.96 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -174.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.75 11.19 68.86 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-N 119.657 1.117 . . . . 0.0 114.035 -170.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.9 mp -95.11 155.63 16.65 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 117.996 0.898 . . . . 0.0 112.492 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.7 p -64.84 151.81 44.51 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.245 0.618 . . . . 0.0 110.308 170.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -40.84 81.58 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.941 -0.475 . . . . 0.0 111.148 176.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.1 m -63.38 -38.5 91.41 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.353 0.661 . . . . 0.0 112.219 176.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 44.4 t-20 -70.99 -49.26 47.23 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.807 -0.558 . . . . 0.0 111.199 176.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 1.3 t -55.98 -35.88 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 120.338 -1.476 . . . . 0.0 112.765 172.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 72.0 m -66.69 -32.78 74.31 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -57.64 -38.63 75.35 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.759 0.708 . . . . 0.0 111.616 171.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 23.3 m80 -69.72 -39.5 76.8 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.396 -0.815 . . . . 0.0 112.577 175.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.8 mt -75.28 -12.92 60.38 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.771 0.828 . . . . 0.0 113.137 177.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.6 t -60.4 -55.36 34.52 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.404 1.002 . . . . 0.0 110.675 168.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.8 t -67.69 -39.67 84.43 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.326 -0.859 . . . . 0.0 111.739 177.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.4 tp -62.02 -37.69 85.86 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -175.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.422 ' HG2' HG23 ' A' ' 64' ' ' VAL . 45.0 mtm105 -82.46 -7.3 59.64 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.865 0.866 . . . . 0.0 111.9 177.091 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -102.13 -45.24 1.76 Allowed Glycine 0 CA--C 1.535 1.283 0 C-N-CA 126.036 1.779 . . . . 0.0 114.685 178.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 7.2 m -67.36 4.41 1.0 Allowed 'General case' 0 CA--C 1.563 1.447 0 C-N-CA 126.008 1.723 . . . . 0.0 112.229 168.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.97 21.21 78.24 Favored Glycine 0 C--N 1.343 0.955 0 C-N-CA 126.018 1.771 . . . . 0.0 114.36 170.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.1 mt -85.13 -22.92 28.65 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.121 1.368 . . . . 0.0 113.61 -174.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.422 HG23 ' HG2' ' A' ' 59' ' ' ARG . 2.4 m -137.28 147.4 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 C-N-CA 125.795 1.638 . . . . 0.0 111.286 -178.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 88.5 t -130.37 144.63 37.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.82 1.648 . . . . 0.0 109.849 -179.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.59 134.36 34.81 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.91 0.884 . . . . 0.0 111.769 172.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.9 166.6 24.34 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.483 0.713 . . . . 0.0 109.596 171.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -80.39 127.48 32.45 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 165.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.265 0.0 OUTLIER -78.73 -16.22 57.5 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 120.038 1.29 . . . . 0.0 114.313 171.706 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 130.65 -21.74 4.71 Favored Glycine 0 N--CA 1.477 1.4 0 C-N-CA 125.602 1.572 . . . . 0.0 113.987 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.1 -19.78 1.49 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.558 2.743 . . . . 0.0 112.62 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 -148.28 173.14 13.32 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 129.564 3.146 . . . . 0.0 111.071 -177.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 14.1 p -88.97 145.13 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 167.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 -126.98 165.83 18.68 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.978 1.711 . . . . 0.0 111.224 -179.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 17.2 m-30 -112.49 120.75 42.71 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 164.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.574 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -121.44 154.36 36.66 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.932 1.293 . . . . 0.0 109.819 -178.299 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 81.6 mt -57.58 151.01 17.85 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.994 0.815 . . . . 0.0 110.226 169.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.51 -37.21 75.12 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 -168.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -162.18 167.8 23.52 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 126.288 1.835 . . . . 0.0 109.064 175.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 51.1 m -44.76 -32.16 1.44 Allowed 'General case' 0 C--O 1.214 -0.775 0 CA-C-O 117.604 -1.189 . . . . 0.0 110.998 167.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -37.58 -65.03 0.34 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.702 1.601 . . . . 0.0 114.026 169.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 15.3 mt -73.46 -41.0 63.72 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.749 1.613 . . . . 0.0 110.826 -176.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.67 -26.55 65.64 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 177.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -79.22 -59.79 2.63 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 126.793 2.037 . . . . 0.0 109.469 178.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.88 -37.72 85.6 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.83 -42.9 85.04 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.74 -0.6 . . . . 0.0 109.483 169.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.51 -34.17 73.3 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 126.296 1.903 . . . . 0.0 117.043 -174.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.77 -11.97 59.91 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 121.533 2.666 . . . . 0.0 112.261 167.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 41.2 tp 64.08 113.33 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 127.85 2.46 . . . . 0.0 109.225 -174.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 19.3 m -66.61 26.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 126.281 1.832 . . . . 0.0 114.907 -175.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.438 ' C ' ' H ' ' A' ' 93' ' ' VAL . 39.2 mm-40 79.98 -2.96 2.01 Favored 'General case' 0 N--CA 1.442 -0.856 0 O-C-N 119.911 -1.743 . . . . 0.0 111.271 157.371 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 13.5 p -60.63 31.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 131.153 3.781 . . . . 0.0 113.871 166.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.438 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.3 t 56.87 18.96 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 127.987 2.515 . . . . 0.0 113.99 169.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 tt 99.59 105.74 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 129.891 3.276 . . . . 0.0 107.099 -169.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.29 61.5 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.992 2.117 . . . . 0.0 116.078 -176.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.5 t -64.35 152.51 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 125.165 1.386 . . . . 0.0 108.427 167.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.93 -72.45 0.38 Allowed 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.796 1.638 . . . . 0.0 113.186 178.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.1 p 70.91 144.36 0.06 Allowed 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 129.596 3.158 . . . . 0.0 115.13 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -90.93 131.94 36.25 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 163.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -168.32 138.43 2.06 Favored Pre-proline 0 CA--C 1.541 0.597 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.46 -179.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -69.55 166.27 27.89 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 122.676 2.251 . . . . 0.0 111.626 174.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 5.7 t . . . . . 0 CA--C 1.553 1.061 0 C-N-CA 126.582 1.953 . . . . 0.0 111.151 -176.653 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.532 0.283 0 CA-C-O 118.05 -0.976 . . . . 0.0 112.645 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.75 -56.18 17.51 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.999 1.272 . . . . 0.0 111.752 171.051 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -59.03 -58.95 6.41 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.802 0.841 . . . . 0.0 111.828 175.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.72 -52.52 56.66 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 125.869 1.668 . . . . 0.0 109.945 -172.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.59 -39.25 96.62 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-O 118.358 -1.246 . . . . 0.0 112.247 -175.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -37.59 79.77 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.123 1.461 . . . . 0.0 110.923 174.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.86 -16.43 60.68 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 178.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 10.3 mp -90.62 -32.73 16.13 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 118.962 0.801 . . . . 0.0 110.031 168.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -74.85 56.0 0.71 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.392 1.877 . . . . 0.0 113.633 169.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -146.63 135.15 10.94 Favored Pre-proline 0 CA--C 1.544 0.714 0 C-N-CA 125.419 1.488 . . . . 0.0 107.167 178.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -46.89 -70.01 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.803 1 C-N-CA 125.628 4.218 . . . . 0.0 113.525 -166.219 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 12.1 p -70.18 -16.49 63.08 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 117.849 -1.072 . . . . 0.0 112.59 -178.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.535 ' HG3' HD13 ' B' ' 58' ' ' LEU . 0.0 OUTLIER -72.16 -46.3 56.96 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 116.551 -1.69 . . . . 0.0 112.252 -176.486 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 38.0 t -45.99 -52.34 11.93 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.454 1.025 . . . . 0.0 110.404 169.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -61.01 -50.37 73.64 Favored 'General case' 0 C--O 1.225 -0.221 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 179.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . 0.437 HG13 HH22 ' B' ' 23' ' ' ARG . 5.2 mm -51.37 -56.99 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.841 1.2 . . . . 0.0 110.526 171.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 59.7 mt -62.17 -42.76 99.57 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 118.699 -0.667 . . . . 0.0 111.906 -169.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 6.3 p -73.23 -32.64 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 123.614 0.765 . . . . 0.0 112.69 177.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . 0.434 ' HB1' ' CD2' ' B' ' 43' ' ' HIS . . . -75.33 -31.6 60.65 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.409 0.55 . . . . 0.0 111.891 176.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.403 ' O ' HG13 ' B' ' 34' ' ' VAL . 7.8 tp -62.0 -40.83 96.99 Favored 'General case' 0 C--N 1.341 0.235 0 O-C-N 121.093 -1.004 . . . . 0.0 112.536 -178.344 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.76 -31.0 1.81 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 130.023 3.329 . . . . 0.0 114.383 172.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -100.99 -14.06 18.01 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 127.032 2.133 . . . . 0.0 112.626 -178.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -114.68 -71.91 0.53 Allowed Glycine 0 C--N 1.344 1.006 0 C-N-CA 124.87 1.224 . . . . 0.0 115.642 -169.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . 0.51 HG12 ' HA ' ' B' ' 76' ' ' ALA . 35.0 m 32.6 34.48 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 N-CA-C 117.314 2.339 . . . . 0.0 117.314 -169.004 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 68.6 m -82.9 -84.08 0.13 Allowed 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 125.975 1.71 . . . . 0.0 112.326 176.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . 0.405 ' H ' ' HB3' ' B' ' 39' ' ' GLN . 0.1 OUTLIER -130.72 163.31 49.53 Favored Pre-proline 0 CA--C 1.543 0.701 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -172.459 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -57.81 -42.2 61.65 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.336 2.024 . . . . 0.0 111.943 178.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -72.11 -1.83 50.69 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 117.955 -1.47 . . . . 0.0 114.645 174.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . 0.405 ' HB3' ' H ' ' B' ' 36' ' ' TYR . 5.8 pt20 -64.17 -51.5 63.52 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.533 1.666 . . . . 0.0 111.322 -177.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 5.3 mt -66.48 -28.57 68.68 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 118.77 0.714 . . . . 0.0 109.248 -174.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -75.06 23.96 0.1 Allowed 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 172.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -143.43 -45.39 0.28 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.385 2.674 . . . . 0.0 108.111 168.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . 0.434 ' CD2' ' HB1' ' B' ' 29' ' ' ALA . 0.3 OUTLIER -53.13 -29.55 31.71 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 126.323 1.849 . . . . 0.0 113.819 170.756 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.7 mt -101.61 -18.59 15.82 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 126.045 1.738 . . . . 0.0 113.323 175.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.27 -2.47 52.0 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 124.285 0.945 . . . . 0.0 114.667 -170.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mp -92.84 144.84 24.88 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.052 1.426 . . . . 0.0 110.383 -178.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 21.2 p -58.86 156.35 11.52 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.065 0.946 . . . . 0.0 113.544 -169.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -37.39 79.14 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 121.465 -0.772 . . . . 0.0 111.314 178.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 26.6 m -63.3 -47.08 83.8 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.754 0.822 . . . . 0.0 111.933 170.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -62.78 -50.43 71.05 Favored 'General case' 0 CA--C 1.546 0.795 0 O-C-N 121.038 -1.039 . . . . 0.0 112.375 178.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 3.9 t -67.8 -19.57 25.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 O-C-N 121.007 -1.058 . . . . 0.0 111.739 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 61.2 m -72.2 -46.61 55.52 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.496 1.498 . . . . 0.0 113.674 171.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -49.74 -46.91 50.89 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 123.644 1.687 . . . . 0.0 111.208 173.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -59.46 -55.08 39.21 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 113.134 -1.848 . . . . 0.0 113.783 170.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 52.5 mt -67.59 -14.99 63.41 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 120.003 -1.686 . . . . 0.0 112.78 -178.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.2 t -50.69 -50.96 53.68 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 119.452 1.024 . . . . 0.0 111.065 168.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.95 -21.19 31.88 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.821 1.191 . . . . 0.0 112.875 -171.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . 0.535 HD13 ' HG3' ' B' ' 23' ' ' ARG . 4.7 tp -73.02 -47.17 47.35 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 121.659 -0.651 . . . . 0.0 111.69 176.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 43.3 mtm180 -72.35 -26.4 61.9 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.786 0.834 . . . . 0.0 110.94 174.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.3 -46.32 12.83 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-O 119.292 -0.727 . . . . 0.0 113.745 176.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 54.1 m -75.8 -15.93 60.18 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 119.161 1.481 . . . . 0.0 113.772 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 107.65 9.36 28.91 Favored Glycine 0 C--N 1.344 0.992 0 C-N-CA 125.259 1.409 . . . . 0.0 115.622 169.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 3.1 mt -85.12 -17.26 37.82 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 120.006 1.903 . . . . 0.0 114.55 -169.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.73 143.09 42.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 126.455 1.902 . . . . 0.0 110.455 177.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 98.1 t -131.1 141.2 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.304 1.041 . . . . 0.0 110.024 -176.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.49 136.87 33.24 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.496 1.119 . . . . 0.0 112.144 173.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -142.15 166.22 25.31 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.113 0.965 . . . . 0.0 109.506 172.235 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -77.36 127.38 32.47 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 165.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.254 0.0 OUTLIER -75.15 -21.13 59.01 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 172.757 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 135.21 -19.44 3.86 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.781 1.658 . . . . 0.0 114.02 -177.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 5.1 tmt_? -142.63 -25.48 0.63 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 129.503 3.121 . . . . 0.0 111.608 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -138.66 179.39 6.51 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 127.557 2.343 . . . . 0.0 110.8 -177.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 14.8 p -91.1 145.16 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.943 0.897 . . . . 0.0 108.865 166.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 20.2 ptt180 -128.92 164.29 23.44 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 126.295 1.838 . . . . 0.0 110.093 176.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -108.0 149.21 28.68 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 106.005 -1.85 . . . . 0.0 106.005 162.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . 0.51 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -146.56 158.3 43.88 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 125.227 1.411 . . . . 0.0 108.571 176.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 62.3 mt -59.28 152.91 19.83 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.385 0.993 . . . . 0.0 109.32 167.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.79 -34.99 76.88 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -168.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -159.62 167.56 28.18 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 123.121 1.439 . . . . 0.0 110.292 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 14.7 m -50.28 -30.62 12.25 Favored 'General case' 0 C--O 1.22 -0.473 0 C-N-CA 125.601 1.56 . . . . 0.0 110.337 167.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -46.73 -65.52 0.55 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.118 1.367 . . . . 0.0 113.789 171.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 11.9 mt -67.68 -41.09 84.25 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 121.075 1.761 . . . . 0.0 111.036 -177.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.02 -24.09 65.9 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 177.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -80.03 -64.52 1.17 Allowed 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 124.982 1.313 . . . . 0.0 110.707 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.54 -34.9 77.84 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.112 1.152 . . . . 0.0 114.112 -178.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tt -65.32 -41.57 93.84 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 121.4 -0.813 . . . . 0.0 109.459 169.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.86 -40.14 95.37 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 126.709 2.099 . . . . 0.0 115.835 -175.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.06 -15.23 62.53 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 120.88 2.34 . . . . 0.0 112.9 169.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 43.2 tp 67.78 111.41 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 127.603 2.361 . . . . 0.0 109.834 -169.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 20.1 m -61.41 28.21 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 128.207 2.603 . . . . 0.0 115.232 174.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 81.87 -15.17 0.73 Allowed 'General case' 0 CA--C 1.535 0.394 0 O-C-N 119.768 -1.832 . . . . 0.0 113.077 156.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.3 p -56.14 31.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.098 1 C-N-CA 132.854 4.461 . . . . 0.0 115.649 168.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 2.0 t 56.71 26.27 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 128.15 2.58 . . . . 0.0 113.415 167.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 tt 80.42 106.47 0.07 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 127.51 2.324 . . . . 0.0 105.109 -167.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.554 1.098 0 C-N-CA 126.156 1.783 . . . . 0.0 115.695 -169.48 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 tm? . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.449 ' HA ' ' HB1' ' B' ' 19' ' ' ALA . . . -64.58 -14.9 59.9 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 175.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -93.03 -43.57 8.84 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.376 1.07 . . . . 0.0 111.991 172.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.684 ' CD1' HG21 ' B' ' 92' ' ' VAL . 3.4 tm? -62.89 -37.63 87.71 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.635 1.574 . . . . 0.0 112.417 -177.125 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.18 -23.23 52.14 Favored Glycine 0 CA--C 1.536 1.389 0 CA-C-N 120.034 1.288 . . . . 0.0 112.741 170.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.9 ttp85 -100.24 -0.43 38.62 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.903 1.446 . . . . 0.0 114.903 171.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -86.64 -35.66 19.24 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.918 1.235 . . . . 0.0 109.248 167.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.6 mp -70.65 -38.01 73.78 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 167.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -92.54 35.45 1.02 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 171.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.73 149.17 74.0 Favored Pre-proline 0 CA--C 1.542 0.664 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 165.513 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -41.79 -89.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.351 0.659 1 C-N-CA 126.495 4.797 . . . . 0.0 113.793 -167.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.52 -31.14 72.04 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 124.997 1.319 . . . . 0.0 111.066 175.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 54.5 mtm-85 -58.69 -33.76 70.52 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 119.547 1.067 . . . . 0.0 113.746 -177.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 49.3 t -58.64 -54.29 48.73 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.295 0.952 . . . . 0.0 110.694 172.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -72.01 -34.26 68.72 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.356 -0.84 . . . . 0.0 112.295 -179.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.5 mm -52.14 -46.39 43.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 124.61 1.164 . . . . 0.0 109.222 167.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 41.7 mt -64.71 -46.06 83.92 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 117.298 -1.334 . . . . 0.0 111.969 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.4 m -64.29 -35.23 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 CA-C-N 121.391 1.905 . . . . 0.0 112.235 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.37 -1.74 46.63 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.978 1.311 . . . . 0.0 113.483 177.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.54 -52.72 7.28 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 124.87 1.268 . . . . 0.0 108.533 169.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -44.47 -60.31 2.02 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.823 2.849 . . . . 0.0 114.015 -171.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -101.16 18.09 20.77 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 126.324 1.849 . . . . 0.0 111.279 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.574 ' HA3' HE22 ' A' ' 39' ' ' GLN . . . -109.44 -80.01 1.15 Allowed Glycine 0 C--N 1.337 0.635 0 C-N-CA 127.718 2.58 . . . . 0.0 111.164 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.4 m 36.93 28.72 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 116.405 2.002 . . . . 0.0 116.405 -177.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 31.5 m -83.57 -72.12 0.47 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 120.506 1.503 . . . . 0.0 113.588 -173.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.43 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -137.36 160.8 64.1 Favored Pre-proline 0 N--CA 1.471 0.621 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -178.234 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -60.94 113.22 1.63 Allowed 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.234 1.956 . . . . 0.0 108.76 171.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.35 -2.33 60.97 Favored Glycine 0 CA--C 1.538 1.508 0 CA-C-O 118.099 -1.389 . . . . 0.0 116.042 -173.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.574 HE22 ' HA3' ' A' ' 33' ' ' GLY . 2.5 pp0? -58.13 -20.1 37.76 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 120.579 2.189 . . . . 0.0 114.597 176.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.5 HD12 ' H ' ' A' ' 40' ' ' LEU . 1.8 mp -71.87 -9.16 57.93 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-O 118.758 -0.639 . . . . 0.0 112.327 176.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.96 -44.09 94.63 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.668 0.667 . . . . 0.0 111.688 177.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.7 -50.91 63.16 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 123.458 0.703 . . . . 0.0 110.684 172.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 -59.1 -27.62 65.74 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -177.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.9 mt -113.39 -22.39 10.41 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -173.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.44 -3.19 33.99 Favored Glycine 0 CA--C 1.535 1.301 0 CA-C-N 119.545 1.066 . . . . 0.0 114.337 -169.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -84.31 139.21 32.46 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.44 1.12 . . . . 0.0 109.803 175.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.403 HG23 ' H ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER -55.16 147.82 15.51 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.545 -0.722 . . . . 0.0 111.053 -179.373 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -48.78 -27.75 3.19 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.483 1.113 . . . . 0.0 113.057 169.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.2 m -69.03 -46.35 68.18 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.1 0.96 . . . . 0.0 111.62 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.403 ' H ' HG23 ' A' ' 47' ' ' THR . 29.1 t-20 -74.41 -39.35 62.69 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.119 0.872 . . . . 0.0 111.978 177.049 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.2 t -55.87 -48.43 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 118.621 -0.704 . . . . 0.0 110.57 169.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 39.2 m -64.88 -40.01 94.44 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 120.087 1.312 . . . . 0.0 113.073 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -56.08 -51.79 66.62 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.476 1.11 . . . . 0.0 111.675 176.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 -70.74 -28.51 64.76 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 120.595 -1.316 . . . . 0.0 113.506 177.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.9 mt -70.26 -30.07 67.01 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 117.933 -1.032 . . . . 0.0 112.751 172.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.1 p -49.52 -44.26 46.19 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.346 1.43 . . . . 0.0 113.259 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.5 t -70.51 -42.09 71.74 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.615 1.966 . . . . 0.0 112.873 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.1 tp -63.4 -29.54 70.82 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.927 1.691 . . . . 0.0 112.03 -177.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 56.1 mtm180 -83.67 -12.38 55.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.474 1.509 . . . . 0.0 113.651 172.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -97.17 -48.38 2.06 Favored Glycine 0 N--CA 1.474 1.21 0 C-N-CA 124.446 1.022 . . . . 0.0 111.13 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 69.1 m -68.49 10.62 0.23 Allowed 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 127.836 2.454 . . . . 0.0 114.142 170.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 63.48 14.5 54.62 Favored Glycine 0 N--CA 1.474 1.171 0 C-N-CA 126.581 2.038 . . . . 0.0 116.583 174.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 86.1 mt -75.7 -28.72 58.73 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 120.619 -1.518 . . . . 0.0 113.427 -179.147 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -134.05 135.12 55.14 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 125.757 1.623 . . . . 0.0 112.834 176.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 87.0 t -124.89 138.88 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 125.817 1.647 . . . . 0.0 109.235 -175.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.19 152.22 36.68 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 122.624 1.202 . . . . 0.0 112.9 178.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.2 m -160.4 163.21 33.3 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.769 1.627 . . . . 0.0 108.103 -170.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -85.87 148.32 25.85 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 119.125 0.875 . . . . 0.0 111.248 167.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.93 -14.39 41.98 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 121.35 -0.844 . . . . 0.0 111.745 167.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 138.21 -14.92 3.49 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 126.976 2.227 . . . . 0.0 113.628 -176.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 65.3 ttt-85 -157.49 -43.91 0.07 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.038 2.135 . . . . 0.0 111.861 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -101.33 179.33 4.39 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.408 1.883 . . . . 0.0 110.459 169.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 25.9 m -105.6 160.11 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 123.793 0.837 . . . . 0.0 112.484 171.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.8 ptt85 -142.88 170.28 15.98 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 129.397 3.079 . . . . 0.0 109.788 -172.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -110.9 120.36 42.14 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.358 1.063 . . . . 0.0 108.703 167.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -108.71 146.15 33.95 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.491 1.516 . . . . 0.0 111.159 174.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 tp -56.83 135.28 55.65 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 118.238 -0.886 . . . . 0.0 108.837 170.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.47 -42.34 70.56 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -170.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -154.35 159.28 41.09 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.849 1.66 . . . . 0.0 112.796 176.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.56 -36.98 0.12 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 130.797 3.639 . . . . 0.0 113.468 165.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -56.37 -48.3 77.12 Favored 'General case' 0 C--N 1.342 0.252 0 C-N-CA 126.178 1.791 . . . . 0.0 113.336 174.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 11.0 mt -69.59 -41.63 75.52 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 175.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.57 -37.99 76.94 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.974 1.309 . . . . 0.0 111.027 -175.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 -68.04 -55.42 12.65 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-O 117.538 -1.22 . . . . 0.0 112.177 173.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.41 -40.2 95.75 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 121.895 2.134 . . . . 0.0 112.753 -177.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.0 tp -61.54 -43.99 97.86 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.65 1.98 . . . . 0.0 112.664 170.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -78.55 -32.56 41.57 Favored Glycine 0 N--CA 1.478 1.442 0 C-N-CA 126.882 2.182 . . . . 0.0 114.301 -176.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -66.99 -6.12 15.61 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.538 1.135 . . . . 0.0 110.084 166.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 32.1 tp 78.56 -34.65 0.17 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 130.661 3.584 . . . . 0.0 112.794 167.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 153.37 -21.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.021 1 C-N-CA 134.012 4.925 . . . . 0.0 111.423 173.19 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 46.2 mm-40 71.24 -23.99 0.18 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.866 2.066 . . . . 0.0 114.428 -178.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.8 p -71.51 42.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 126.59 1.956 . . . . 0.0 115.135 -172.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER 63.28 17.73 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 C-N-CA 126.996 2.119 . . . . 0.0 112.504 177.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 62.4 mt 84.6 107.51 0.05 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 129.976 3.31 . . . . 0.0 109.693 -171.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.75 76.1 0.85 Allowed 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.089 -1.007 . . . . 0.0 110.002 169.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.0 t -44.74 149.09 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 127.487 2.315 . . . . 0.0 114.652 -169.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.62 25.75 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 128.532 2.733 . . . . 0.0 114.937 171.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 44.0 p -104.53 170.61 7.79 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.655 -1.278 . . . . 0.0 112.723 175.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -99.94 2.95 44.1 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 128.83 2.852 . . . . 0.0 113.842 -176.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -53.43 141.7 42.36 Favored Pre-proline 0 CA--C 1.556 1.192 0 N-CA-C 116.151 1.908 . . . . 0.0 116.151 -167.113 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -72.97 -168.97 0.45 Allowed 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 125.236 3.957 . . . . 0.0 111.489 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 49.6 t . . . . . 0 CA--C 1.548 0.874 0 O-C-N 120.429 -1.42 . . . . 0.0 111.881 175.331 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 tm? . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.68 -5.7 39.4 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.933 1.457 . . . . 0.0 114.933 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -86.08 -46.64 10.28 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 118.658 -0.687 . . . . 0.0 110.464 168.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.96 -41.37 99.51 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.368 0.985 . . . . 0.0 112.104 -168.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.8 -6.3 11.63 Favored Glycine 0 CA--C 1.542 1.774 0 CA-C-O 119.004 -0.887 . . . . 0.0 114.432 173.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 49.6 ttp85 -115.4 -3.68 12.41 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 127.187 2.195 . . . . 0.0 113.851 172.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -92.65 -27.96 16.97 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.478 1.511 . . . . 0.0 110.906 167.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 3.8 mp -79.18 -44.58 21.61 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 168.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.449 ' HB1' ' HA ' ' A' ' 12' ' ' ALA . . . -87.69 32.57 0.72 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 125.299 1.44 . . . . 0.0 114.619 171.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -64.17 151.94 89.25 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 126.924 2.09 . . . . 0.0 111.977 172.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -44.67 -36.27 10.17 Favored 'Trans proline' 0 C--N 1.357 0.987 1 C-N-CA 125.579 4.186 . . . . 0.0 114.718 177.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.45 ' HB ' HH21 ' B' ' 23' ' ' ARG . 5.6 m -130.18 -34.89 1.62 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.824 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.618 ' HG2' HD13 ' B' ' 58' ' ' LEU . 0.0 OUTLIER -60.28 -26.94 66.89 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 117.211 -1.376 . . . . 0.0 112.091 -179.742 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 42.3 t -55.13 -65.43 0.59 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 120.14 1.336 . . . . 0.0 112.193 168.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 17.4 ttm180 -68.65 -33.2 73.6 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.152 -0.968 . . . . 0.0 111.713 -177.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.1 mm -48.92 -55.03 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 O-C-N 121.049 -1.032 . . . . 0.0 109.053 168.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.416 HD22 HD11 ' B' ' 77' ' ' LEU . 56.6 mt -62.82 -36.44 83.17 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 116.798 -1.572 . . . . 0.0 112.613 -174.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 3.6 m -64.27 -38.48 82.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 CA-C-N 120.849 1.659 . . . . 0.0 111.045 175.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.35 -7.1 59.14 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.307 1.043 . . . . 0.0 113.547 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.15 -55.3 6.25 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 170.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -44.05 -61.29 1.51 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 128.433 2.693 . . . . 0.0 112.558 177.586 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -86.97 5.19 38.47 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.051 1.34 . . . . 0.0 112.086 -176.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.53 -73.16 0.53 Allowed Glycine 0 C--N 1.341 0.833 0 C-N-CA 126.465 1.983 . . . . 0.0 113.657 -173.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 25.4 m 37.65 29.52 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 116.183 1.92 . . . . 0.0 116.183 -174.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 25.7 m -82.91 -73.37 0.41 Allowed 'General case' 0 C--N 1.342 0.251 0 CA-C-N 120.358 1.435 . . . . 0.0 114.218 -173.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . 0.469 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 1.0 OUTLIER -148.36 164.68 20.79 Favored Pre-proline 0 N--CA 1.47 0.526 0 N-CA-C 114.012 1.115 . . . . 0.0 114.012 -175.486 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -55.1 119.65 6.87 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.136 1.891 . . . . 0.0 108.768 169.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.43 -4.05 83.97 Favored Glycine 0 CA--C 1.535 1.339 0 CA-C-O 117.249 -1.861 . . . . 0.0 115.897 -174.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . 0.469 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 2.4 pp0? -57.22 -27.17 61.78 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 121.203 2.501 . . . . 0.0 112.948 176.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 3.4 mt -67.96 -22.7 65.02 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 124.509 1.124 . . . . 0.0 111.593 178.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.16 -43.49 98.79 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 118.549 0.613 . . . . 0.0 111.156 -173.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.94 -50.86 64.76 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.664 0.786 . . . . 0.0 111.571 173.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -54.75 -35.77 64.09 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 178.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 17.3 mt -103.21 -21.64 13.84 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -172.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.41 -1.69 33.96 Favored Glycine 0 CA--C 1.537 1.467 0 CA-C-N 119.177 0.899 . . . . 0.0 113.418 -168.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -90.08 121.85 32.52 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 125.386 1.474 . . . . 0.0 108.531 176.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.8 t -47.7 139.08 7.63 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.29 1.036 . . . . 0.0 112.548 -175.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.12 -28.35 4.19 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.816 1.647 . . . . 0.0 113.577 174.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 50.3 m -62.32 -58.28 8.26 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.002 0.921 . . . . 0.0 111.358 170.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -76.12 -34.91 59.47 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.427 1.012 . . . . 0.0 113.483 -178.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 1.5 t -50.2 -47.83 24.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.906 1.23 . . . . 0.0 109.648 169.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 5.2 m -83.22 -27.9 29.64 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -177.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -45.88 -34.8 4.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.27 1.428 . . . . 0.0 112.429 173.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -113.26 2.12 15.44 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 127.373 2.269 . . . . 0.0 114.311 -178.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 46.7 mt -72.58 -24.64 61.12 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 119.615 -1.928 . . . . 0.0 109.116 166.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 18.3 p -43.11 -42.74 4.15 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.092 1.357 . . . . 0.0 111.75 167.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 12.5 t -75.36 -43.03 52.6 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . 0.618 HD13 ' HG2' ' B' ' 23' ' ' ARG . 6.5 tp -62.85 -34.57 77.62 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.488 1.515 . . . . 0.0 110.967 -176.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.449 ' HG2' HG23 ' B' ' 64' ' ' VAL . 60.5 mtm180 -82.46 -7.56 59.64 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.164 1.385 . . . . 0.0 113.867 173.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -97.89 -49.37 1.78 Allowed Glycine 0 N--CA 1.474 1.174 0 CA-C-N 119.391 0.996 . . . . 0.0 111.778 175.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 99.5 m -72.02 13.46 0.3 Allowed 'General case' 0 CA--C 1.565 1.551 0 C-N-CA 126.741 2.016 . . . . 0.0 113.223 175.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.89 0.04 12.53 Favored Glycine 0 N--CA 1.471 1.025 0 C-N-CA 127.597 2.522 . . . . 0.0 116.59 176.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.556 HD12 HD12 ' B' ' 58' ' ' LEU . 41.6 mt -65.62 -30.29 70.98 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.654 1.727 . . . . 0.0 113.702 -171.037 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.449 HG23 ' HG2' ' B' ' 59' ' ' ARG . 0.7 OUTLIER -123.7 141.08 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 126.433 1.893 . . . . 0.0 111.771 170.842 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 74.3 t -123.7 138.15 54.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 125.538 1.535 . . . . 0.0 109.118 174.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.62 148.5 30.24 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.458 1.103 . . . . 0.0 113.013 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 8.7 m -160.48 162.87 33.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.144 1.378 . . . . 0.0 108.194 -168.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -81.75 147.28 29.52 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.842 1.201 . . . . 0.0 111.55 167.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.21 -14.62 43.38 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.169 0.895 . . . . 0.0 111.781 167.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 139.51 -18.01 3.06 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 126.851 2.167 . . . . 0.0 113.02 -177.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 58.5 ttt-85 -153.37 -46.09 0.09 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 127.326 2.251 . . . . 0.0 111.446 -176.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -97.61 -177.88 3.94 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.599 1.96 . . . . 0.0 109.975 170.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 33.8 m -109.09 158.74 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 123.869 0.868 . . . . 0.0 112.822 171.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 10.0 ptt85 -140.08 173.57 11.39 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 128.71 2.804 . . . . 0.0 110.12 -171.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -117.9 120.14 36.96 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.304 1.042 . . . . 0.0 108.476 167.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -103.96 151.43 23.19 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.901 1.28 . . . . 0.0 110.196 172.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.416 HD11 HD22 ' B' ' 27' ' ' LEU . 2.0 tp -60.43 143.81 52.48 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 168.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -42.66 -60.42 1.56 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.107 0.963 . . . . 0.0 112.612 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . 0.461 ' CG ' ' H ' ' B' ' 80' ' ' SER . 11.8 t70 -166.8 -174.83 2.87 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.42 1.488 . . . . 0.0 113.658 171.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.461 ' H ' ' CG ' ' B' ' 79' ' ' ASP . 4.2 m -35.65 -39.26 0.14 Allowed 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 130.196 3.398 . . . . 0.0 113.757 172.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -55.45 -52.41 63.71 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.344 1.057 . . . . 0.0 113.035 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 19.2 mt -75.1 -34.39 61.73 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.036 1.289 . . . . 0.0 110.08 175.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.31 -38.19 88.47 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.32 0.648 . . . . 0.0 110.729 -174.122 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -67.95 -55.04 14.21 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-O 117.425 -1.274 . . . . 0.0 111.816 169.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.99 -32.45 72.92 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 122.407 2.367 . . . . 0.0 113.977 -174.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.41 -43.37 50.28 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.245 1.418 . . . . 0.0 112.285 171.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -79.72 -26.35 56.56 Favored Glycine 0 CA--C 1.54 1.645 0 C-N-CA 124.809 1.195 . . . . 0.0 114.918 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -69.57 -10.6 58.83 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.704 1.202 . . . . 0.0 109.397 165.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 60.2 tp 80.87 -42.6 0.19 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 130.798 3.639 . . . . 0.0 110.574 171.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . 0.46 ' CG2' HG22 ' B' ' 92' ' ' VAL . 0.0 OUTLIER 160.54 -27.25 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.548 1 C-N-CA 133.057 4.543 . . . . 0.0 110.573 170.438 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 79.93 -12.2 1.08 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.323 2.249 . . . . 0.0 113.129 -178.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.684 HG21 ' CD1' ' A' ' 14' ' ' LEU . 27.2 m -80.34 70.02 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 CA-C-O 125.641 2.639 . . . . 0.0 114.749 -168.117 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.344 0.7 OUTLIER 34.38 27.47 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.432 -1.347 2 C-N-CA 133.825 4.85 . . . . 0.0 114.595 -167.312 . . . . . . . . 4 3 . 1 . 020 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 34.3 mt 74.61 71.32 0.1 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.497 2.319 . . . . 0.0 110.985 -168.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.72 0 O-C-N 121.063 -1.023 . . . . 0.0 111.731 169.47 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp . . . . . 0 N--CA 1.488 1.442 0 N-CA-C 116.876 2.176 . . . . 0.0 116.876 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.93 -36.88 64.71 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.302 0.955 . . . . 0.0 111.475 -169.352 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.7 ttm105 -58.55 -48.05 82.18 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 117.648 -1.168 . . . . 0.0 110.622 169.748 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.66 -51.5 69.68 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.11 1.364 . . . . 0.0 111.095 -179.051 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.22 -38.86 91.35 Favored Glycine 0 CA--C 1.533 1.213 0 CA-C-N 119.044 0.838 . . . . 0.0 112.372 177.262 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -87.11 10.14 17.64 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.249 1.42 . . . . 0.0 114.174 175.972 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -117.93 -2.48 11.3 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.761 2.424 . . . . 0.0 111.469 169.364 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.0 mp -105.13 -36.26 7.33 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.232 0.923 . . . . 0.0 109.734 165.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.44 86.14 2.57 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 168.12 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -130.69 156.3 80.03 Favored Pre-proline 0 CA--C 1.54 0.576 0 C-N-CA 127.489 2.315 . . . . 0.0 110.71 -173.335 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -77.64 -122.81 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.361 3.374 . . . . 0.0 109.575 -174.603 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 54.1 m -57.65 -17.38 14.37 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 119.924 -1.735 . . . . 0.0 113.003 170.707 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.46 -18.27 60.66 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 120.8 -1.188 . . . . 0.0 112.606 171.475 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.5 t -85.38 -29.43 24.43 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 120.351 -1.468 . . . . 0.0 110.911 166.077 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.2 -43.28 74.27 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.678 -0.639 . . . . 0.0 109.798 167.859 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.549 HG23 HD13 ' A' ' 40' ' ' LEU . 1.3 mm -52.14 -51.3 31.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 CA-C-N 118.94 0.791 . . . . 0.0 112.177 169.211 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 52.9 mt -62.88 -38.39 90.67 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.126 0.788 . . . . 0.0 113.126 -177.167 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.9 p -79.18 -28.83 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 CA-C-N 119.395 0.998 . . . . 0.0 113.195 175.701 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.41 3.15 13.96 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.654 1.182 . . . . 0.0 112.953 169.351 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.474 HD22 ' CE2' ' A' ' 75' ' ' TYR . 0.3 OUTLIER -83.62 -52.38 6.5 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.02 1.328 . . . . 0.0 108.603 168.163 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.46 -52.73 27.17 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 128.728 2.811 . . . . 0.0 111.94 178.144 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -90.85 36.97 0.91 Allowed 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.861 2.064 . . . . 0.0 111.358 174.163 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -147.28 -93.26 0.12 Allowed Glycine 0 C--N 1.338 0.667 0 C-N-CA 125.588 1.566 . . . . 0.0 113.331 -172.77 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 28.4 m 38.84 29.44 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 C-N-CA 127.356 2.262 . . . . 0.0 116.053 -170.805 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.432 ' HB2' ' HG2' ' A' ' 39' ' ' GLN . 69.4 m -68.44 -89.43 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 127.872 2.469 . . . . 0.0 113.489 176.166 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.426 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 17.7 m-85 -142.93 144.63 30.02 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 126.622 1.969 . . . . 0.0 110.72 -172.935 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -63.24 135.31 49.8 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 123.081 2.521 . . . . 0.0 111.162 -174.107 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.64 -3.13 56.44 Favored Glycine 0 CA--C 1.534 1.224 0 CA-C-O 118.628 -1.095 . . . . 0.0 114.589 -175.211 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.432 ' HG2' ' HB2' ' A' ' 35' ' ' CYS . 2.7 pp0? -70.17 -17.85 63.18 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.773 1.787 . . . . 0.0 112.841 176.198 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.549 HD13 HG23 ' A' ' 26' ' ' ILE . 5.8 mt -50.68 -22.02 1.87 Allowed 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.5 0.591 . . . . 0.0 111.525 171.227 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.39 -32.32 73.89 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.685 0.994 . . . . 0.0 113.685 178.468 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.8 -44.43 27.48 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.105 0.562 . . . . 0.0 110.448 169.118 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -63.65 -30.78 71.84 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.743 1.217 . . . . 0.0 114.081 -176.139 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 27.6 mt -101.41 -14.09 17.7 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.008 1.723 . . . . 0.0 113.71 176.223 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.57 0.39 31.32 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.43 1.014 . . . . 0.0 114.241 -170.612 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 88.8 mt -89.62 136.68 32.89 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.062 1.345 . . . . 0.0 109.732 -179.488 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.1 p -59.07 159.14 7.64 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -168.405 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 71.6 mtp85 -54.37 -30.4 51.65 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.836 176.634 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.4 m -69.09 -57.62 5.17 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.467 1.031 . . . . 0.0 111.225 169.56 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -54.9 -41.37 70.84 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.388 -0.82 . . . . 0.0 112.995 -178.797 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.4 t -71.95 -32.65 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 O-C-N 121.486 -0.759 . . . . 0.0 111.962 176.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 68.8 m -69.55 -33.75 73.22 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.364 0.984 . . . . 0.0 112.19 178.477 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -54.9 -48.81 72.56 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.729 0.695 . . . . 0.0 111.788 169.649 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 32.0 m80 -62.6 -40.28 96.43 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 177.538 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 84.1 mt -75.9 -17.86 59.62 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.54 1.536 . . . . 0.0 114.218 179.769 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 t -66.31 -41.84 89.16 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.858 1.208 . . . . 0.0 111.895 179.479 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 46.4 t -67.57 -48.28 67.36 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-O 122.8 1.286 . . . . 0.0 110.884 168.839 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.472 ' HB3' ' CG2' ' A' ' 64' ' ' VAL . 1.1 tp -62.45 -37.75 87.12 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.591 1.557 . . . . 0.0 114.362 -169.241 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.431 ' HG2' HG23 ' A' ' 64' ' ' VAL . 1.2 mtt85 -89.76 8.65 30.72 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 114.679 1.362 . . . . 0.0 114.679 173.808 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -108.38 -55.77 0.58 Allowed Glycine 0 N--CA 1.474 1.224 0 C-N-CA 124.959 1.266 . . . . 0.0 111.138 171.879 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 56.0 m -74.76 15.31 0.39 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 128.262 2.625 . . . . 0.0 112.863 179.409 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.97 -5.68 24.09 Favored Glycine 0 C--N 1.34 0.799 0 C-N-CA 128.415 2.912 . . . . 0.0 116.296 169.497 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.4 mt -60.93 -30.42 70.19 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.57 1.685 . . . . 0.0 114.106 -173.059 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.472 ' CG2' ' HB3' ' A' ' 58' ' ' LEU . 1.5 m -138.87 151.21 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 125.854 1.662 . . . . 0.0 111.115 169.395 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.2 t -149.86 144.7 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 123.234 0.614 . . . . 0.0 112.559 176.059 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -78.89 140.43 38.11 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.108 1.363 . . . . 0.0 113.092 178.527 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.5 m -143.07 134.07 25.6 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 126.062 1.745 . . . . 0.0 106.956 -168.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -61.78 127.04 29.54 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 121.18 1.809 . . . . 0.0 111.191 172.851 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.313 2.8 pp20? -85.34 -134.15 0.06 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 118.147 -0.93 . . . . 0.0 110.314 174.344 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -72.77 -37.77 57.12 Favored Glycine 0 CA--C 1.531 1.068 0 CA-C-N 120.892 1.678 . . . . 0.0 113.408 176.27 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.0 ttp85 -154.9 -9.38 0.13 Allowed 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -179.524 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -111.8 -173.08 2.17 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.618 2.367 . . . . 0.0 107.707 171.37 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 4.3 m -104.8 146.42 12.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 124.017 0.927 . . . . 0.0 108.916 166.768 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -111.27 -162.66 0.81 Allowed 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 127.279 2.231 . . . . 0.0 109.713 172.752 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.474 ' CE2' HD22 ' A' ' 30' ' ' LEU . 1.1 p90 -159.24 96.87 1.33 Allowed 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 127.107 2.163 . . . . 0.0 106.557 -172.092 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -94.23 156.16 16.68 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.701 1.6 . . . . 0.0 111.233 -177.466 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.1 mt -62.7 160.13 14.84 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 165.471 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -42.44 -47.04 4.94 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.545 1.138 . . . . 0.0 114.056 -177.932 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -169.02 172.37 7.59 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 126.309 1.843 . . . . 0.0 108.63 176.728 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -34.33 -36.67 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 128.762 2.825 . . . . 0.0 111.226 162.836 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -38.96 -67.83 0.19 Allowed 'General case' 0 C--N 1.344 0.35 0 C-N-CA 128.552 2.741 . . . . 0.0 113.542 168.662 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 17.4 mt -79.07 -36.01 41.56 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 118.673 -0.679 . . . . 0.0 109.757 -173.16 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.77 -34.19 62.29 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.924 0.784 . . . . 0.0 112.597 170.096 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 -83.14 -59.73 2.38 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.738 178.738 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.35 -32.36 73.76 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -176.232 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.77 -35.98 59.96 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 121.417 -0.802 . . . . 0.0 110.656 169.846 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.58 -42.87 62.29 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 125.403 1.478 . . . . 0.0 114.44 -173.76 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -77.83 -23.61 48.95 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.734 1.267 . . . . 0.0 111.96 169.352 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 22.1 tp 80.74 146.38 0.09 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 129.583 3.153 . . . . 0.0 113.859 166.19 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.9 m -48.9 -7.39 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 129.142 2.977 . . . . 0.0 117.14 -178.387 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 74.89 -44.01 0.53 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 128.147 2.579 . . . . 0.0 113.008 172.893 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.8 p -50.94 44.68 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.34 1 C-N-CA 133.793 4.837 . . . . 0.0 118.435 -169.804 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 59.25 10.35 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 128.896 2.878 . . . . 0.0 112.756 -172.622 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.2 tt 75.28 113.9 0.06 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.821 2.448 . . . . 0.0 106.056 -165.503 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.51 77.94 0.11 Allowed 'General case' 0 CA--C 1.551 1.013 0 O-C-N 121.137 -0.977 . . . . 0.0 112.477 -177.274 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.0 m -57.98 140.81 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 125.743 1.617 . . . . 0.0 114.468 -174.948 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.79 104.0 0.07 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.94 2.496 . . . . 0.0 110.216 171.544 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 11.9 p -153.18 -72.3 0.14 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.458 1.103 . . . . 0.0 111.041 -169.157 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . 0.251 30.9 m-20 64.21 43.49 4.88 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 127.377 2.271 . . . . 0.0 112.996 171.591 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -66.39 158.12 79.29 Favored Pre-proline 0 CA--C 1.544 0.735 0 CA-C-N 113.769 -1.56 . . . . 0.0 110.413 168.028 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -59.8 161.8 17.47 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.463 2.776 . . . . 0.0 111.357 169.412 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.812 0 CA-C-O 121.29 0.566 . . . . 0.0 111.004 -178.408 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 27.2 tp . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 116.708 2.114 . . . . 0.0 116.708 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.09 -33.67 63.71 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 119.217 0.917 . . . . 0.0 111.041 -169.339 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 7.0 ttm105 -55.23 -46.81 76.0 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 118.521 -0.752 . . . . 0.0 110.719 169.267 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.34 -50.0 74.34 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.906 1.282 . . . . 0.0 111.063 -179.666 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -59.07 -31.3 68.52 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-N 119.323 0.965 . . . . 0.0 112.831 177.624 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.6 3.08 55.09 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 174.436 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.09 -17.49 14.31 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 127.587 2.355 . . . . 0.0 111.706 172.701 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 4.3 mp -93.8 -44.91 7.89 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.416 0.687 . . . . 0.0 110.853 168.151 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.71 70.55 7.49 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.734 0.778 . . . . 0.0 110.807 172.675 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -127.12 132.97 24.57 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 128.066 2.546 . . . . 0.0 106.105 176.404 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -52.89 -94.01 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.862 1 C-N-CA 126.603 4.868 . . . . 0.0 115.806 -165.936 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 5.3 m -58.19 -25.37 61.49 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.623 1.569 . . . . 0.0 111.214 178.517 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 13.4 ttp180 -73.91 -34.69 64.47 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 179.635 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 52.8 t -63.03 -36.97 85.35 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.573 1.533 . . . . 0.0 109.572 167.605 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.1 mtm180 -61.78 -41.41 97.68 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.949 0.9 . . . . 0.0 112.354 169.823 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mm -61.41 -47.47 93.3 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 CA-C-N 120.235 1.38 . . . . 0.0 111.48 170.284 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 52.8 mt -62.47 -40.9 98.13 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.814 0.845 . . . . 0.0 112.101 -179.301 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 3.7 p -77.59 -28.2 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 177.462 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.17 -12.23 59.67 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 121.138 -0.976 . . . . 0.0 113.183 170.208 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.08 -54.07 16.97 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.292 1.037 . . . . 0.0 108.806 169.263 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 2.6 mt -41.3 -66.7 0.31 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 128.164 2.586 . . . . 0.0 111.201 173.273 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -79.75 32.05 0.25 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.667 1.987 . . . . 0.0 112.403 177.836 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -143.74 -80.91 0.05 OUTLIER Glycine 0 C--N 1.338 0.693 0 C-N-CA 125.002 1.287 . . . . 0.0 113.832 -173.867 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 23.6 m 37.43 22.83 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 N-CA-C 118.447 2.758 . . . . 0.0 118.447 -175.289 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 91.3 m -76.11 -69.66 0.49 Allowed 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.979 1.718 . . . . 0.0 113.274 179.87 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -144.14 159.12 53.75 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 123.684 0.794 . . . . 0.0 112.785 -168.629 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -60.79 138.18 77.67 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 123.748 2.965 . . . . 0.0 111.757 173.892 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 66.39 0.0 7.27 Favored Glycine 0 CA--C 1.533 1.204 0 CA-C-O 119.099 -0.834 . . . . 0.0 114.578 177.79 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -67.51 -29.16 68.5 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 119.077 1.439 . . . . 0.0 111.217 -178.154 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.7 mp -56.07 -15.16 3.24 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 124.23 1.012 . . . . 0.0 112.892 177.591 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.0 -46.04 78.85 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.635 0.774 . . . . 0.0 111.739 170.75 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.25 -42.24 75.88 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.096 0.862 . . . . 0.0 111.417 174.494 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -63.57 -31.05 72.1 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.103 1.361 . . . . 0.0 113.751 -177.48 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 29.9 mt -99.18 -10.38 22.54 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.55 1.54 . . . . 0.0 113.485 175.391 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.63 8.11 55.72 Favored Glycine 0 CA--C 1.537 1.428 0 CA-C-N 118.984 0.811 . . . . 0.0 113.737 -169.303 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 91.3 mt -88.83 162.82 15.96 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 118.615 1.208 . . . . 0.0 111.742 -177.232 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.5 p -70.67 154.81 41.5 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.634 -1.291 . . . . 0.0 110.287 175.26 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 68.0 mtp85 -54.03 -40.47 67.09 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.096 172.019 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 5.6 m -59.2 -49.39 78.04 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.172 0.989 . . . . 0.0 112.877 173.163 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -61.6 -46.62 89.05 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.595 -0.691 . . . . 0.0 110.934 178.657 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 19.3 t -67.18 -37.1 78.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.047 -179.204 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 56.6 m -58.86 -42.91 90.52 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 119.825 1.193 . . . . 0.0 112.855 170.984 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 34.9 m-20 -56.52 -46.57 80.5 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.05 0.841 . . . . 0.0 111.269 176.374 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -66.26 -40.65 90.3 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 121.719 -0.613 . . . . 0.0 112.32 176.759 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 88.2 mt -68.5 -18.49 64.4 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.908 0.883 . . . . 0.0 113.054 175.24 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.03 -53.74 54.28 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.229 1.377 . . . . 0.0 112.225 -179.16 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 17.5 t -65.99 -44.51 84.64 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.244 0.545 . . . . 0.0 110.326 173.86 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 2.5 tp -55.54 -40.53 71.99 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.092 1.757 . . . . 0.0 113.796 -172.816 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 64.5 mtm180 -83.53 -11.86 56.9 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.057 1.343 . . . . 0.0 113.367 176.447 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -85.62 -54.34 2.82 Favored Glycine 0 N--CA 1.47 0.949 0 C-N-CA 124.466 1.031 . . . . 0.0 110.673 170.828 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 31.2 m -58.45 -6.06 0.63 Allowed 'General case' 0 CA--C 1.56 1.356 0 C-N-CA 126.583 1.953 . . . . 0.0 114.519 174.708 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.87 -2.18 42.88 Favored Glycine 0 CA--C 1.531 1.08 0 C-N-CA 124.65 1.119 . . . . 0.0 114.065 -175.396 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 79.6 mt -57.24 -26.4 60.69 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.387 1.875 . . . . 0.0 113.386 -177.281 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -132.43 143.75 38.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 127.276 2.23 . . . . 0.0 110.177 168.508 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 22.1 t -143.3 139.09 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 125.726 1.61 . . . . 0.0 109.624 -172.54 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.7 153.59 40.01 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 178.108 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 93.7 m -162.01 139.67 8.69 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.36 1.464 . . . . 0.0 108.639 -178.828 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -71.12 123.39 22.04 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 119.946 1.248 . . . . 0.0 109.489 169.037 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.296 0.0 OUTLIER -69.97 -76.35 0.1 Allowed 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.711 1.141 . . . . 0.0 110.351 179.251 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -142.29 -29.98 0.14 Allowed Glycine 0 CA--C 1.534 1.277 0 C-N-CA 127.408 2.432 . . . . 0.0 113.282 169.714 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 6.4 ttp85 -145.93 -10.21 0.52 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.703 1.601 . . . . 0.0 113.914 179.067 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -117.56 172.07 7.59 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 127.0 2.12 . . . . 0.0 109.413 170.012 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 27.8 m -97.88 145.88 8.79 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 164.439 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -126.51 175.49 7.87 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 126.864 2.066 . . . . 0.0 109.718 -176.008 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -120.65 117.03 26.47 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 164.349 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -93.03 166.05 12.55 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.488 1.515 . . . . 0.0 109.123 169.525 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -66.93 166.67 13.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.857 0.863 . . . . 0.0 109.428 167.363 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -47.68 -47.52 29.56 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.538 1.135 . . . . 0.0 113.649 174.77 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -176.72 170.36 2.39 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 126.638 1.975 . . . . 0.0 109.427 -179.442 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -34.65 -36.96 0.05 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 129.373 3.069 . . . . 0.0 111.491 162.723 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -43.25 -69.39 0.14 Allowed 'General case' 0 C--N 1.341 0.205 0 C-N-CA 128.698 2.799 . . . . 0.0 113.295 169.626 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 19.0 mt -70.55 -28.76 65.16 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.22 0.918 . . . . 0.0 111.237 177.528 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -66.49 -34.54 78.14 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.001 0.818 . . . . 0.0 111.388 -176.81 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -79.57 -55.51 4.98 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 117.273 -1.346 . . . . 0.0 110.134 171.611 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.92 -32.17 67.51 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -176.019 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.63 -43.89 15.15 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.386 -0.822 . . . . 0.0 110.939 169.796 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.47 -29.51 71.58 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 125.106 1.336 . . . . 0.0 114.776 -170.134 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -82.88 -25.0 32.94 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.827 1.251 . . . . 0.0 112.451 168.556 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 21.4 tp 71.22 142.71 0.06 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 129.962 3.305 . . . . 0.0 112.238 -177.754 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . 0.477 HG23 HG12 ' B' ' 92' ' ' VAL . 12.1 m -42.62 -4.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 C-N-CA 129.487 3.115 . . . . 0.0 117.187 168.606 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 71.68 -29.55 0.2 Allowed 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 128.969 2.908 . . . . 0.0 114.565 173.29 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.477 HG12 HG23 ' B' ' 90' ' ' VAL . 4.5 p -58.8 39.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 131.619 3.968 . . . . 0.0 116.488 -175.736 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 60.83 11.63 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 128.779 2.832 . . . . 0.0 113.259 -177.13 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.0 tt 78.85 113.68 0.07 Allowed 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 128.74 2.816 . . . . 0.0 106.35 -166.905 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.887 0 O-C-N 121.045 -1.035 . . . . 0.0 111.868 175.721 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 mm? . . . . . 0 CA--C 1.545 0.762 0 N-CA-C 110.624 -0.139 . . . . 0.0 110.624 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.11 -42.29 96.92 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 120.661 -1.274 . . . . 0.0 113.363 168.962 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.5 mmt180 -59.93 -43.93 94.64 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 121.461 -0.774 . . . . 0.0 110.367 173.129 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -58.93 -42.26 89.3 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.421 1.888 . . . . 0.0 112.551 176.25 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.7 -30.11 76.59 Favored Glycine 0 N--CA 1.47 0.904 0 O-C-N 120.689 -1.257 . . . . 0.0 112.999 177.199 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.7 ttt-85 -73.44 -41.3 63.39 Favored 'General case' 0 C--O 1.221 -0.395 0 O-C-N 121.725 -0.867 . . . . 0.0 110.817 169.991 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.83 -32.65 65.97 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 176.554 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.5 mt -75.15 -44.93 44.15 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.344 1.058 . . . . 0.0 112.772 172.122 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -84.28 -14.24 50.35 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 116.56 2.059 . . . . 0.0 116.56 -175.507 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -50.94 148.7 7.21 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 126.74 2.016 . . . . 0.0 115.082 -170.843 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -49.41 -64.97 0.18 Allowed 'Trans proline' 0 C--N 1.351 0.666 1 C-N-CA 125.889 4.393 . . . . 0.0 112.652 -173.538 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 52.8 m -82.39 -31.58 29.61 Favored 'General case' 0 C--O 1.226 -0.145 0 CA-C-O 118.452 -0.785 . . . . 0.0 111.756 175.054 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.514 ' CD ' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -72.89 -32.06 65.12 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 120.313 1.415 . . . . 0.0 114.406 -171.304 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.8 t -61.46 -50.38 73.02 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.0 0.818 . . . . 0.0 110.39 170.438 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -57.63 -45.48 85.36 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.812 1.245 . . . . 0.0 113.044 174.363 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 mm -51.6 -53.39 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.388 1.075 . . . . 0.0 110.607 169.515 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.6 mt -56.28 -51.91 66.43 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 117.617 -1.183 . . . . 0.0 111.74 178.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -61.21 -38.18 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 CA-C-N 119.532 1.06 . . . . 0.0 112.404 -178.645 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.83 -15.41 61.17 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 176.327 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.0 tp -74.12 -40.16 62.85 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 120.778 1.626 . . . . 0.0 112.806 175.487 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.434 HD12 HD22 ' A' ' 86' ' ' LEU . 3.4 mt -51.56 -46.61 63.47 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.596 1.559 . . . . 0.0 110.978 175.116 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -86.12 11.98 10.64 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 126.533 1.933 . . . . 0.0 113.277 176.305 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.41 -92.79 0.92 Allowed Glycine 0 N--CA 1.468 0.794 0 C-N-CA 126.848 2.166 . . . . 0.0 114.447 -174.345 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.465 HG12 ' HA ' ' A' ' 76' ' ' ALA . 30.4 m 36.04 41.12 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 127.182 2.193 . . . . 0.0 114.75 -167.326 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 98.9 m -87.38 -102.99 0.07 Allowed 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 124.14 0.976 . . . . 0.0 110.679 175.761 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -112.52 168.87 7.03 Favored Pre-proline 0 CA--C 1.55 0.976 0 O-C-N 120.034 -1.666 . . . . 0.0 114.356 -170.17 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.25 111.4 2.26 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.14 1.893 . . . . 0.0 109.899 -176.002 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.54 7.21 76.05 Favored Glycine 0 CA--C 1.532 1.096 0 CA-C-O 119.166 -0.797 . . . . 0.0 114.354 -175.974 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.01 -21.79 23.4 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 119.45 1.625 . . . . 0.0 115.076 177.97 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.7 mp -63.72 -17.04 62.6 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 123.384 0.674 . . . . 0.0 111.845 175.971 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.33 -25.2 67.76 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.915 0.78 . . . . 0.0 112.992 173.607 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.55 -50.17 14.58 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.656 0.662 . . . . 0.0 110.146 168.706 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -56.29 -38.78 71.68 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 179.752 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.4 mt -99.36 -19.83 16.81 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.42 1.088 . . . . 0.0 113.438 -172.515 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.64 -11.03 3.51 Favored Glycine 0 CA--C 1.539 1.544 0 C-N-CA 124.525 1.059 . . . . 0.0 113.254 -168.303 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.38 128.15 34.81 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 125.147 1.379 . . . . 0.0 108.051 175.461 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.2 t -56.33 154.99 7.42 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 122.29 1.043 . . . . 0.0 112.019 -176.649 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.6 ptt-85 -54.93 -16.53 2.78 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.129 0.971 . . . . 0.0 113.316 175.02 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.6 t -65.32 -67.79 0.41 Allowed 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.404 1.002 . . . . 0.0 109.48 167.766 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -54.5 -42.81 71.22 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.604 1.093 . . . . 0.0 112.836 176.947 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.3 t -63.4 -45.48 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-O 118.389 -0.815 . . . . 0.0 111.41 177.005 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 26.0 m -71.57 -35.4 70.56 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.793 1.633 . . . . 0.0 112.837 178.311 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -56.15 -56.79 16.56 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.595 1.558 . . . . 0.0 110.094 173.746 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -73.0 -28.65 62.5 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -179.87 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 44.0 mt -64.3 -33.9 76.89 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.895 1.225 . . . . 0.0 111.72 169.671 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 66.7 m -62.04 -45.31 94.13 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.368 1.44 . . . . 0.0 113.683 -170.795 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 17.6 t -72.14 -21.07 61.52 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 119.432 1.015 . . . . 0.0 112.293 170.816 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.514 HD13 ' CD ' ' A' ' 23' ' ' ARG . 8.2 tp -67.31 -38.12 84.45 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 120.525 1.511 . . . . 0.0 110.439 171.528 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.423 ' HG2' HG23 ' A' ' 64' ' ' VAL . 90.9 mtm-85 -73.78 -15.24 61.2 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.078 1.351 . . . . 0.0 112.305 172.889 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.18 -58.51 1.56 Allowed Glycine 0 C--N 1.338 0.69 0 N-CA-C 109.323 -1.511 . . . . 0.0 109.323 179.499 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 69.7 m -60.89 10.82 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 128.113 2.565 . . . . 0.0 114.375 173.191 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 62.87 16.12 56.3 Favored Glycine 0 N--CA 1.469 0.864 0 C-N-CA 127.229 2.347 . . . . 0.0 115.631 173.668 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 82.6 mt -78.45 -26.91 46.3 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.532 1.166 . . . . 0.0 112.941 -179.566 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.423 HG23 ' HG2' ' A' ' 59' ' ' ARG . 2.8 m -132.54 142.81 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.771 1.228 . . . . 0.0 113.686 178.249 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 20.5 t -129.78 139.88 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.979 2.112 . . . . 0.0 109.893 -177.987 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.03 138.16 43.88 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.272 0.629 . . . . 0.0 112.272 170.726 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.98 161.51 35.47 Favored 'General case' 0 CA--C 1.509 -0.604 0 CA-C-O 121.706 0.765 . . . . 0.0 110.191 170.503 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -73.69 122.66 22.7 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 105.893 -1.892 . . . . 0.0 105.893 165.152 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -75.39 -22.99 57.02 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.773 1.169 . . . . 0.0 112.542 169.804 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 118.69 105.32 2.21 Favored Glycine 0 C--N 1.337 0.584 0 N-CA-C 106.798 -2.521 . . . . 0.0 106.798 -168.344 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 13.8 ttt85 76.01 -57.33 0.57 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.615 1.966 . . . . 0.0 111.621 -169.209 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -98.14 -166.95 1.44 Allowed 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 119.13 0.877 . . . . 0.0 111.249 -179.426 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 10.4 p -128.67 149.63 33.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 126.255 1.822 . . . . 0.0 108.649 -176.797 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.5 ptt180 -136.0 169.73 17.14 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 126.268 1.827 . . . . 0.0 110.998 -177.732 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -112.34 139.5 47.85 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 164.012 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.465 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -139.81 150.86 45.21 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.533 1.133 . . . . 0.0 110.394 -178.142 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.05 129.41 20.72 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.28 1.032 . . . . 0.0 108.302 170.031 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.9 -24.34 66.83 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -170.533 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -161.09 156.61 24.76 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 123.217 1.484 . . . . 0.0 112.9 -179.817 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 91.2 p -43.04 -36.48 1.61 Allowed 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 128.809 2.844 . . . . 0.0 114.87 168.519 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 -58.5 -42.88 88.62 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.08 -1.012 . . . . 0.0 112.559 175.904 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.3 mt -73.06 -38.3 66.51 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 118.685 0.675 . . . . 0.0 109.389 179.062 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.55 89.05 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.469 0.708 . . . . 0.0 109.23 -179.53 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -70.98 -51.97 22.47 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.951 1.7 . . . . 0.0 113.495 175.581 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.2 -45.19 95.62 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.734 1.152 . . . . 0.0 112.736 -179.654 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.434 HD22 HD12 ' A' ' 31' ' ' LEU . 2.0 tt -56.49 -55.59 31.88 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.836 0.855 . . . . 0.0 108.99 169.468 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.78 -17.54 78.32 Favored Glycine 0 CA--C 1.543 1.835 0 C-N-CA 125.601 1.572 . . . . 0.0 115.603 -167.93 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -73.58 -23.25 59.92 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 119.36 1.58 . . . . 0.0 110.361 166.998 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 52.7 tp 72.81 117.83 0.05 OUTLIER 'General case' 0 C--N 1.343 0.314 0 C-N-CA 129.261 3.024 . . . . 0.0 107.68 -171.872 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 21.7 t -69.1 18.78 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 125.902 1.681 . . . . 0.0 113.591 -169.078 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 91.19 -21.64 0.1 Allowed 'General case' 0 C--O 1.221 -0.446 0 O-C-N 119.494 -2.004 . . . . 0.0 110.349 126.319 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.413 ' C ' ' H ' ' A' ' 94' ' ' LEU . 7.7 p -72.44 41.61 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 127.628 2.371 . . . . 0.0 111.43 165.376 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER 68.6 -27.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 C-N-CA 129.608 3.163 . . . . 0.0 113.57 -173.162 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.413 ' H ' ' C ' ' A' ' 92' ' ' VAL . 45.8 tp 138.28 112.67 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.35 1 C-N-CA 133.116 4.566 . . . . 0.0 106.032 -169.644 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.41 106.84 0.27 Allowed 'General case' 0 CA--C 1.546 0.813 0 O-C-N 121.603 -0.686 . . . . 0.0 111.356 169.432 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.2 t -58.87 158.8 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 127.494 2.317 . . . . 0.0 110.916 169.89 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -85.85 18.83 2.76 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.261 1.824 . . . . 0.0 115.015 -179.568 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.485 ' HG1' ' N ' ' B' ' 11' ' ' LEU . 9.4 p -75.36 96.99 3.5 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.198 0.999 . . . . 0.0 111.906 -178.347 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.79 49.34 1.77 Allowed 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 126.662 1.985 . . . . 0.0 110.534 170.503 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . 0.422 ' HB3' ' HD2' ' A' ' 101' ' ' PRO . 66.6 mm-40 -103.1 -174.41 0.34 Allowed Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 127.674 2.389 . . . . 0.0 112.43 -169.738 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.422 ' HD2' ' HB3' ' A' ' 100' ' ' GLN . 36.9 Cg_endo -65.28 149.7 88.2 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.988 2.459 . . . . 0.0 110.495 164.207 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.9 t . . . . . 0 CA--C 1.535 0.39 0 CA-C-O 124.303 2.002 . . . . 0.0 114.994 -170.339 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.485 ' N ' ' HG1' ' A' ' 98' ' ' THR . 4.4 mm? . . . . . 0 CA--C 1.545 0.75 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.62 -29.08 69.82 Favored 'General case' 0 CA--C 1.546 0.793 0 O-C-N 119.605 -1.934 . . . . 0.0 112.45 170.44 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 11.8 mmt-85 -66.04 -39.52 90.24 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.94 0.896 . . . . 0.0 111.691 170.39 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -57.32 -41.29 79.67 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.146 1.378 . . . . 0.0 111.879 -178.55 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -61.77 -37.24 93.97 Favored Glycine 0 N--CA 1.476 1.305 0 CA-C-N 120.339 1.427 . . . . 0.0 113.535 -178.391 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 9.2 ttt-85 -80.58 -24.11 39.41 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 118.054 0.927 . . . . 0.0 111.937 170.611 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.39 -33.94 74.51 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.138 -1.601 . . . . 0.0 112.498 170.289 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 17.5 mt -83.62 -42.14 17.04 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.163 0.985 . . . . 0.0 111.242 174.409 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -100.08 65.23 1.26 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.833 1.253 . . . . 0.0 112.746 173.307 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -120.81 149.56 50.96 Favored Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 126.082 1.753 . . . . 0.0 108.974 176.881 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -59.74 -63.73 0.12 Allowed 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 124.601 3.534 . . . . 0.0 112.725 -171.839 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.3 m -77.99 -37.75 46.49 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-O 118.709 -0.662 . . . . 0.0 110.066 174.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.666 ' CD ' HD13 ' B' ' 58' ' ' LEU . 0.5 OUTLIER -67.0 -37.2 83.77 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -169.6 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 22.2 t -62.7 -49.53 74.74 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.644 1.111 . . . . 0.0 111.139 171.811 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 64.5 mtt180 -53.81 -46.67 71.18 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.243 1.017 . . . . 0.0 112.982 172.841 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 11.3 mm -51.9 -53.27 18.36 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 C-N-CA 124.63 1.172 . . . . 0.0 110.787 170.47 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 78.2 mt -57.85 -47.38 82.86 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 117.837 -1.077 . . . . 0.0 111.667 179.131 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.5 m -64.29 -39.52 85.81 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 119.914 1.233 . . . . 0.0 112.813 -179.995 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.32 -8.64 59.78 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -179.274 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' B' ' 30' ' ' LEU . 13.2 mt -69.42 -45.17 69.8 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 118.279 -0.867 . . . . 0.0 112.907 169.207 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . 0.409 HD12 HD22 ' B' ' 86' ' ' LEU . 0.9 OUTLIER -44.48 -63.29 0.92 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.27 2.628 . . . . 0.0 112.569 -176.525 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -95.63 8.31 43.76 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 126.53 1.932 . . . . 0.0 112.788 -177.365 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.14 -85.88 1.83 Allowed Glycine 0 C--N 1.338 0.66 0 C-N-CA 127.818 2.628 . . . . 0.0 110.435 173.185 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 34.11 44.53 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.754 1.621 . . . . 0.0 113.552 -167.728 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 88.6 m -105.18 -145.54 0.38 Allowed 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 123.571 1.653 . . . . 0.0 109.655 170.038 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.79 166.03 13.42 Favored Pre-proline 0 C--N 1.317 -0.847 0 N-CA-C 117.609 2.448 . . . . 0.0 117.609 -160.47 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -72.32 110.9 3.07 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 122.25 1.966 . . . . 0.0 107.797 -175.996 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.81 13.27 75.61 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-O 118.227 -1.319 . . . . 0.0 114.908 -171.676 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.59 -36.82 64.83 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.603 1.701 . . . . 0.0 111.297 171.013 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.5 mp -56.14 -15.8 4.26 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 124.634 1.174 . . . . 0.0 113.926 -179.756 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.16 -43.74 92.09 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 119.233 0.924 . . . . 0.0 111.507 172.933 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.43 -25.04 54.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.764 0.826 . . . . 0.0 113.125 175.347 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -70.26 -32.71 70.67 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.422 -0.799 . . . . 0.0 112.813 172.288 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 12.8 mt -111.0 -20.18 12.51 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -169.426 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.88 4.83 78.12 Favored Glycine 0 CA--C 1.535 1.285 0 CA-C-N 119.926 1.239 . . . . 0.0 113.75 -169.731 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -100.24 135.67 41.32 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 125.065 1.346 . . . . 0.0 110.82 178.503 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 6.2 t -55.9 154.47 7.24 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.385 -0.822 . . . . 0.0 112.544 177.796 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 32.9 ptt-85 -51.57 -23.76 4.57 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.251 1.42 . . . . 0.0 113.539 174.88 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 25.7 t -63.66 -67.08 0.46 Allowed 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 118.526 0.603 . . . . 0.0 110.751 169.484 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -58.07 -35.73 71.79 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.209 1.003 . . . . 0.0 113.455 -179.892 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 15.4 t -59.43 -47.96 88.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 118.767 0.712 . . . . 0.0 111.793 169.899 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 35.7 m -78.31 -32.54 49.36 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -175.638 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -60.15 -49.85 76.01 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.053 0.941 . . . . 0.0 110.176 176.477 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -72.95 -34.36 66.47 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 117.981 -1.009 . . . . 0.0 113.68 175.363 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 28.3 mt -56.38 -30.72 63.06 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 120.643 1.565 . . . . 0.0 112.526 169.571 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 67.7 m -69.54 -49.8 51.0 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 120.144 1.338 . . . . 0.0 114.571 -170.79 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 16.6 t -63.19 -27.55 69.44 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 119.708 1.14 . . . . 0.0 111.678 171.599 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . 0.666 HD13 ' CD ' ' B' ' 23' ' ' ARG . 11.8 tp -66.36 -39.98 89.47 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.108 2.163 . . . . 0.0 112.35 177.271 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.472 ' HG2' HG23 ' B' ' 64' ' ' VAL . 82.2 mtm-85 -67.65 -33.52 75.11 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 119.145 0.884 . . . . 0.0 110.327 173.228 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -71.46 -53.64 9.87 Favored Glycine 0 N--CA 1.466 0.634 0 N-CA-C 110.251 -1.14 . . . . 0.0 110.251 179.226 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 57.1 m -55.98 -4.6 0.13 Allowed 'General case' 0 CA--C 1.56 1.332 0 C-N-CA 128.112 2.565 . . . . 0.0 113.961 173.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.78 16.66 67.47 Favored Glycine 0 C--N 1.343 0.953 0 C-N-CA 127.347 2.403 . . . . 0.0 113.645 170.083 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.618 HD12 HD12 ' B' ' 58' ' ' LEU . 90.7 mt -94.52 -21.11 19.08 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 -169.648 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.472 HG23 ' HG2' ' B' ' 59' ' ' ARG . 4.5 m -140.44 156.17 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -173.77 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 96.2 t -147.21 149.48 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 125.702 1.601 . . . . 0.0 111.019 -173.144 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.4 125.2 41.89 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.012 0.925 . . . . 0.0 111.906 169.168 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.15 165.85 16.84 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.254 1.021 . . . . 0.0 110.313 -176.154 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -76.04 122.57 24.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.817 168.675 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -85.78 -24.97 26.63 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 118.316 0.507 . . . . 0.0 111.357 167.067 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 125.96 105.33 1.47 Allowed Glycine 0 C--N 1.34 0.778 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -174.191 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 71.15 -52.1 0.69 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.999 2.12 . . . . 0.0 111.403 -169.639 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -91.45 -178.04 4.99 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.643 1.177 . . . . 0.0 110.444 177.568 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 11.2 p -125.61 138.24 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 125.976 1.71 . . . . 0.0 108.884 179.896 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 38.1 ptt180 -115.17 166.28 12.0 Favored 'General case' 0 CA--C 1.509 -0.628 0 C-N-CA 124.708 1.203 . . . . 0.0 109.415 -176.78 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -115.75 135.94 53.54 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 168.979 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -141.77 160.91 39.22 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.88 1.672 . . . . 0.0 112.055 -169.098 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 49.7 mt -68.19 152.67 45.13 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.803 0.841 . . . . 0.0 109.271 167.421 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.22 -22.35 38.86 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 -169.5 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -167.07 158.14 12.0 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.383 1.473 . . . . 0.0 112.76 179.068 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 89.5 p -40.01 -39.84 0.94 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 128.811 2.845 . . . . 0.0 114.949 168.221 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -55.97 -43.81 77.92 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.701 0.8 . . . . 0.0 111.571 175.9 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 1.9 mt -78.0 -42.14 33.61 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.408 1.004 . . . . 0.0 110.194 -176.471 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.12 -38.9 63.06 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.852 0.861 . . . . 0.0 111.043 171.777 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 18.5 tpt180 -70.95 -52.72 18.15 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.574 1.55 . . . . 0.0 113.659 177.041 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.94 -40.38 88.73 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 118.89 0.768 . . . . 0.0 112.43 177.622 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.409 HD22 HD12 ' B' ' 31' ' ' LEU . 0.8 OUTLIER -57.88 -49.32 77.13 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.971 1.308 . . . . 0.0 109.883 169.564 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.05 -29.95 63.94 Favored Glycine 0 CA--C 1.536 1.384 0 C-N-CA 125.636 1.588 . . . . 0.0 114.768 -169.552 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -73.75 -14.63 61.15 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 118.971 1.385 . . . . 0.0 111.128 167.197 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 28.2 tp 70.78 157.08 0.16 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 129.001 2.921 . . . . 0.0 107.922 -166.861 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . 0.535 HG21 ' H ' ' B' ' 95' ' ' ALA . 27.8 m -53.91 -11.84 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 O-C-N 121.055 -1.028 . . . . 0.0 112.654 167.397 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . 0.427 ' C ' ' H ' ' B' ' 93' ' ' VAL . 3.6 tp-100 76.5 -20.04 0.39 Allowed 'General case' 0 C--N 1.345 0.376 0 C-N-CA 127.742 2.417 . . . . 0.0 112.287 161.487 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.412 HG13 ' O ' ' B' ' 92' ' ' VAL . 3.9 p -68.05 38.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 128.593 2.757 . . . . 0.0 113.903 169.515 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . 0.427 ' H ' ' C ' ' B' ' 91' ' ' GLN . 2.3 t 74.72 -34.42 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 C-N-CA 130.039 3.336 . . . . 0.0 112.301 -178.718 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 38.3 tp 155.3 111.12 0.0 OUTLIER 'General case' 0 C--N 1.341 0.236 0 C-N-CA 131.664 3.986 . . . . 0.0 108.123 178.073 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . 0.535 ' H ' HG21 ' B' ' 90' ' ' VAL . . . . . . . . 0 CA--C 1.546 0.82 0 O-C-N 121.638 -0.664 . . . . 0.0 109.557 165.943 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . 0.258 4.0 pp . . . . . 0 N--CA 1.469 0.49 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.53 -46.75 89.01 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.465 1.03 . . . . 0.0 111.004 168.613 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -59.11 -38.31 79.26 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 120.452 1.478 . . . . 0.0 112.679 174.705 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -63.36 -57.47 10.23 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.036 0.834 . . . . 0.0 110.853 177.366 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -61.15 -32.34 80.12 Favored Glycine 0 CA--C 1.533 1.178 0 O-C-N 121.335 -0.853 . . . . 0.0 113.007 178.267 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -68.15 -4.04 12.47 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.295 1.548 . . . . 0.0 114.144 -178.807 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -128.31 -15.87 4.54 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 167.898 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.6 mp -101.39 -15.76 17.1 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 178.641 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.23 75.09 4.62 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.571 1.548 . . . . 0.0 107.329 167.281 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -164.46 147.92 7.69 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 123.757 0.823 . . . . 0.0 113.125 -168.441 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -63.63 -96.87 0.0 OUTLIER 'Trans proline' 0 CA--C 1.547 1.145 1 C-N-CA 125.45 4.1 . . . . 0.0 111.512 174.065 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.3 p -47.98 -35.6 11.17 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 128.12 2.568 . . . . 0.0 112.912 169.677 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.552 ' CG ' HD11 ' A' ' 58' ' ' LEU . 5.5 ttm180 -75.96 -46.71 28.33 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 121.532 1.969 . . . . 0.0 113.94 -169.17 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 37.3 t -59.17 -42.42 90.76 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.93 0.786 . . . . 0.0 109.514 169.943 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -54.66 -43.37 72.34 Favored 'General case' 0 CA--C 1.555 1.163 0 CA-C-O 117.93 -1.033 . . . . 0.0 112.641 171.251 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.1 mt -56.28 -51.7 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 CA-C-N 121.858 2.117 . . . . 0.0 110.338 172.338 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.17 -40.05 88.56 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 118.486 -0.769 . . . . 0.0 112.796 -177.165 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.6 p -81.67 -24.62 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 CA-C-N 119.637 1.108 . . . . 0.0 113.067 178.324 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.75 -31.03 63.14 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.638 1.175 . . . . 0.0 111.972 172.844 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.587 ' O ' HG13 ' A' ' 34' ' ' VAL . 1.1 tp -64.64 -39.68 94.12 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 120.787 -1.196 . . . . 0.0 113.513 170.441 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -44.6 -44.41 8.87 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.626 2.37 . . . . 0.0 114.283 -174.753 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -103.56 -19.31 14.41 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.36 1.064 . . . . 0.0 112.978 169.089 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.71 -2.28 57.41 Favored Glycine 0 C--O 1.218 -0.871 0 CA-C-O 114.992 -3.115 . . . . 0.0 117.257 -165.076 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.587 HG13 ' O ' ' A' ' 30' ' ' LEU . 19.7 m -32.99 54.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 N-CA-C 119.668 3.21 . . . . 0.0 119.668 169.418 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.9 m -109.42 -67.47 0.98 Allowed 'General case' 0 C--O 1.224 -0.287 0 O-C-N 119.828 -1.795 . . . . 0.0 110.728 -174.167 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -148.78 157.14 41.13 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-O 117.901 -1.047 . . . . 0.0 110.976 -174.456 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -55.98 -31.93 83.94 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.166 2.578 . . . . 0.0 113.827 179.121 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -81.33 -8.26 87.36 Favored Glycine 0 CA--C 1.532 1.135 0 CA-C-O 118.352 -1.249 . . . . 0.0 114.851 176.338 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.85 -37.58 84.73 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 119.554 1.677 . . . . 0.0 111.531 -170.881 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.5 mt -58.5 -24.58 60.84 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 123.699 0.8 . . . . 0.0 111.33 178.996 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.59 -36.67 67.14 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 119.265 0.938 . . . . 0.0 111.427 -175.366 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.39 -51.94 10.88 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.933 0.893 . . . . 0.0 112.529 172.756 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -53.57 -32.92 52.89 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 178.239 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.485 HD12 HG22 ' A' ' 51' ' ' VAL . 55.6 mt -97.33 -11.31 24.19 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 126.442 1.897 . . . . 0.0 112.617 -179.104 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 61.69 18.42 56.41 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-O 118.598 -1.112 . . . . 0.0 113.867 -170.812 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.8 mt -122.19 148.17 45.28 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 119.277 1.539 . . . . 0.0 113.733 -169.661 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.3 t -58.79 138.12 57.35 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.074 178.572 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.4 -24.82 65.44 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -171.325 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.7 m -63.8 -47.89 79.06 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.4 1.08 . . . . 0.0 112.687 170.196 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -75.2 -32.83 61.31 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 118.76 0.709 . . . . 0.0 111.712 178.341 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.485 HG22 HD12 ' A' ' 44' ' ' LEU . 24.9 t -58.89 -41.52 83.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 120.982 -1.074 . . . . 0.0 110.343 167.848 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 57.8 m -63.1 -40.29 97.19 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 177.844 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -51.07 -50.52 58.53 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.488 1.115 . . . . 0.0 111.572 173.405 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -69.87 -37.23 76.01 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 115.4 -2.238 . . . . 0.0 113.598 176.205 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.445 ' HA ' HD13 ' A' ' 58' ' ' LEU . 37.7 mt -61.25 -34.09 74.58 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 121.437 1.926 . . . . 0.0 113.279 175.464 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.4 m -53.12 -39.26 63.34 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.184 -0.947 . . . . 0.0 113.441 -177.797 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 3.2 t -66.99 -51.08 59.45 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 118.878 0.763 . . . . 0.0 111.085 176.603 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.618 ' H ' HD12 ' A' ' 58' ' ' LEU . 2.6 mp -59.64 -36.2 75.9 Favored 'General case' 0 N--CA 1.484 1.259 0 O-C-N 120.792 -1.192 . . . . 0.0 111.885 -175.394 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 90.4 mtm180 -76.17 -21.7 56.22 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.336 1.055 . . . . 0.0 112.71 -176.721 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.3 -36.11 4.5 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.893 1.235 . . . . 0.0 114.49 176.991 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 59.9 m -70.63 -17.03 62.88 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 125.003 1.321 . . . . 0.0 112.441 173.396 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 95.17 20.14 28.7 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 128.137 2.78 . . . . 0.0 115.782 172.295 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.1 mt -83.4 -20.38 34.27 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 119.333 1.567 . . . . 0.0 114.499 177.091 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.531 HG23 ' HB3' ' A' ' 58' ' ' LEU . 61.9 t -134.33 140.74 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 124.637 1.175 . . . . 0.0 110.612 -179.057 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.6 t -135.31 135.93 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 126.273 1.829 . . . . 0.0 108.672 -170.977 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.09 157.57 37.52 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 122.628 1.204 . . . . 0.0 112.214 172.399 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 30.3 m -153.54 154.34 34.11 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.842 1.657 . . . . 0.0 106.587 175.301 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -74.23 162.44 28.93 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.936 0.789 . . . . 0.0 112.379 169.758 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -139.91 171.32 14.38 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 126.309 1.844 . . . . 0.0 111.911 178.246 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -68.14 75.42 0.26 Allowed Glycine 0 CA--C 1.527 0.834 0 C-N-CA 125.837 1.684 . . . . 0.0 112.525 179.366 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 95.9 18.96 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 129.945 3.298 . . . . 0.0 111.987 179.7 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -158.06 -178.63 7.44 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 120.972 -1.08 . . . . 0.0 110.551 -175.17 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 32.5 m -121.76 156.48 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 124.148 0.979 . . . . 0.0 109.198 167.257 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -132.51 178.3 6.95 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 124.767 1.227 . . . . 0.0 110.452 -170.23 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -129.54 134.92 48.01 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.525 168.862 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.583 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -130.09 151.64 50.4 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 126.414 1.886 . . . . 0.0 108.834 179.596 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.12 157.76 15.22 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.257 0.48 . . . . 0.0 110.708 175.536 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -43.04 -54.61 4.23 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.748 1.619 . . . . 0.0 113.544 -178.201 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -165.7 165.66 18.47 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.834 1.653 . . . . 0.0 110.137 -173.843 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.16 -35.72 0.08 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 129.687 3.195 . . . . 0.0 111.642 165.803 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -46.53 -69.2 0.14 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.307 1.843 . . . . 0.0 113.145 169.172 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.4 mt -71.57 -34.01 69.57 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.083 0.856 . . . . 0.0 110.771 -174.487 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.65 -45.91 90.61 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 118.673 -0.68 . . . . 0.0 111.923 175.612 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.03 -43.28 71.63 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 117.318 -1.325 . . . . 0.0 111.651 176.416 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.37 -47.86 80.53 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.785 1.175 . . . . 0.0 113.238 177.063 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.25 -39.62 74.92 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.763 -0.585 . . . . 0.0 111.136 178.472 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.69 -36.79 61.83 Favored Glycine 0 CA--C 1.531 1.059 0 C-N-CA 125.311 1.434 . . . . 0.0 114.565 -176.7 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -72.68 -5.96 41.15 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.651 1.226 . . . . 0.0 112.521 172.655 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 52.0 tp 75.01 107.62 0.07 Allowed 'General case' 0 C--N 1.345 0.392 0 C-N-CA 129.764 3.226 . . . . 0.0 112.459 166.349 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.81 32.67 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 125.81 1.644 . . . . 0.0 112.328 -169.756 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 79.93 -10.8 1.25 Allowed 'General case' 0 C--O 1.221 -0.433 0 O-C-N 120.387 -1.445 . . . . 0.0 113.824 122.123 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.427 HG13 ' O ' ' A' ' 92' ' ' VAL . 12.3 p -71.94 54.08 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 C-N-CA 130.218 3.407 . . . . 0.0 109.963 166.647 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 71.92 -10.87 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 126.632 1.973 . . . . 0.0 114.355 178.268 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.3 tt 117.47 103.67 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 131.291 3.836 . . . . 0.0 106.755 -169.355 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.81 76.72 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.173 0 C-N-CA 125.115 1.366 . . . . 0.0 114.383 174.269 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.1 t -82.08 145.4 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 125.686 1.594 . . . . 0.0 107.728 167.269 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -69.82 13.99 0.12 Allowed 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 178.137 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.82 34.48 0.12 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.966 1.306 . . . . 0.0 109.771 166.74 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -57.83 130.54 46.92 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 125.254 1.422 . . . . 0.0 109.245 -166.742 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -132.31 132.78 23.1 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.958 -160.693 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -53.39 150.71 25.56 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 125.142 3.894 . . . . 0.0 117.968 -163.499 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 41.5 t . . . . . 0 CA--C 1.551 1.016 0 C-N-CA 127.066 2.146 . . . . 0.0 112.727 177.171 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 pp . . . . . 0 N--CA 1.472 0.63 0 N-CA-C 116.827 2.158 . . . . 0.0 116.827 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.01 -30.21 62.33 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 121.048 1.749 . . . . 0.0 112.404 174.0 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -57.57 -51.23 70.34 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.369 0.986 . . . . 0.0 109.69 171.305 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -58.9 -63.36 1.32 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.827 0.851 . . . . 0.0 109.563 175.797 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -59.98 -40.84 97.49 Favored Glycine 0 C--O 1.219 -0.825 0 CA-C-O 117.64 -1.644 . . . . 0.0 112.831 -169.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -87.07 -12.31 47.59 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.212 2.006 . . . . 0.0 114.085 -179.428 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -86.95 -31.56 20.59 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.773 1.17 . . . . 0.0 111.467 168.103 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.6 mp -83.77 -19.12 35.64 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.616 0.766 . . . . 0.0 111.207 171.899 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.16 63.73 1.89 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.29 1.836 . . . . 0.0 110.597 167.713 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -144.22 137.39 13.96 Favored Pre-proline 0 CA--C 1.547 0.841 0 N-CA-C 104.19 -2.522 . . . . 0.0 104.19 167.831 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . 0.406 ' HG2' ' H ' ' B' ' 22' ' ' THR . 57.1 Cg_endo -52.13 -77.42 0.02 OUTLIER 'Trans proline' 0 CA--C 1.548 1.183 1 C-N-CA 125.816 4.344 . . . . 0.0 112.703 -175.853 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.406 ' H ' ' HG2' ' B' ' 21' ' ' PRO . 2.0 p -41.19 -49.89 3.56 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 129.605 3.162 . . . . 0.0 112.586 168.251 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 37.6 ttt180 -72.95 -34.83 66.77 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.12 0.968 . . . . 0.0 111.979 -168.076 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 46.8 t -63.09 -51.48 66.46 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.19 0.905 . . . . 0.0 109.802 167.595 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -57.99 -35.01 70.61 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.034 1.334 . . . . 0.0 112.364 178.729 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . 0.402 HD13 HD11 ' B' ' 44' ' ' LEU . 5.3 mm -56.1 -61.87 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 125.629 1.571 . . . . 0.0 108.644 169.085 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 82.1 mt -64.36 -40.2 95.37 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.585 0.754 . . . . 0.0 111.997 -169.366 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 8.6 p -70.96 -23.97 24.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 177.311 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . 0.544 ' HB1' ' CD2' ' B' ' 43' ' ' HIS . . . -92.38 -21.0 20.47 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 175.32 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.469 ' O ' HG13 ' B' ' 34' ' ' VAL . 11.6 mt -58.2 -46.37 85.95 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.112 -0.993 . . . . 0.0 110.021 168.664 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.7 mt -44.66 -36.62 3.19 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 129.355 3.062 . . . . 0.0 114.484 175.193 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -100.01 -18.79 16.86 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.276 1.831 . . . . 0.0 112.751 -177.963 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -108.32 -66.97 0.6 Allowed Glycine 0 C--N 1.341 0.861 0 C-N-CA 125.203 1.382 . . . . 0.0 115.033 -170.509 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . 0.469 HG13 ' O ' ' B' ' 30' ' ' LEU . 15.7 m 34.3 36.1 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 C-N-CA 127.069 2.147 . . . . 0.0 115.815 -169.182 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 72.7 m -85.02 -72.63 0.47 Allowed 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.066 0.947 . . . . 0.0 112.68 -176.587 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -148.29 153.08 40.41 Favored Pre-proline 0 N--CA 1.474 0.769 0 CA-C-O 117.767 -1.111 . . . . 0.0 112.306 -169.932 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -54.39 -31.31 67.44 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 123.127 2.551 . . . . 0.0 113.783 -178.063 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -84.46 -7.04 85.25 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-O 117.868 -1.518 . . . . 0.0 115.301 175.53 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -30.4 70.9 Favored 'General case' 0 C--N 1.347 0.498 0 CA-C-N 120.534 2.167 . . . . 0.0 112.224 -170.704 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.4 mt -67.09 -13.33 61.83 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 119.082 -0.485 . . . . 0.0 111.567 -175.444 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.63 -31.71 66.53 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.286 0.948 . . . . 0.0 112.358 171.473 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.84 -48.91 13.83 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.312 0.645 . . . . 0.0 111.422 171.533 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . 0.544 ' CD2' ' HB1' ' B' ' 29' ' ' ALA . 5.5 m-70 -55.05 -32.38 61.84 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.731 HD12 HG22 ' B' ' 51' ' ' VAL . 67.0 mt -104.16 -23.43 13.27 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.751 1.62 . . . . 0.0 112.095 -176.077 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.65 8.63 72.6 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 124.271 0.938 . . . . 0.0 113.402 -169.073 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 92.0 mt -111.1 148.95 31.56 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 125.48 1.512 . . . . 0.0 110.674 -170.554 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.3 t -59.57 150.79 26.18 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -177.862 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -21.77 64.72 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -174.993 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 9.4 m -73.7 -41.26 62.85 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 120.952 -1.093 . . . . 0.0 112.526 169.164 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -68.82 -39.72 79.89 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.599 0.76 . . . . 0.0 110.955 174.781 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . 0.731 HG22 HD12 ' B' ' 44' ' ' LEU . 43.7 t -54.3 -50.46 56.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.896 0.878 . . . . 0.0 109.725 167.09 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 68.6 m -60.56 -40.38 91.44 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -178.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -53.99 -50.56 66.29 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.265 1.026 . . . . 0.0 112.217 -178.788 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 73.1 m-70 -79.04 -10.91 59.96 Favored 'General case' 0 CA--C 1.552 1.025 0 O-C-N 120.847 -1.158 . . . . 0.0 114.044 175.865 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 81.2 mt -80.26 -28.84 38.35 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.592 1.542 . . . . 0.0 111.651 167.422 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 68.9 m -53.74 -46.1 70.76 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 117.754 -1.117 . . . . 0.0 113.064 -176.65 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 4.0 t -72.16 -44.5 62.98 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.803 1.183 . . . . 0.0 109.579 176.91 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 3.6 tp -50.82 -38.23 47.52 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.873 2.469 . . . . 0.0 114.572 -173.26 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 47.3 mtp180 -80.74 -9.93 59.77 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.318 1.847 . . . . 0.0 112.604 -179.785 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -105.68 -32.93 3.71 Favored Glycine 0 CA--C 1.539 1.592 0 C-N-CA 127.166 2.317 . . . . 0.0 113.825 169.212 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 86.9 m -55.72 -27.68 51.76 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 126.389 1.876 . . . . 0.0 112.052 169.387 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.95 25.17 58.47 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 126.089 1.804 . . . . 0.0 112.488 -173.398 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 91.4 mt -86.83 -25.32 24.61 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.19 1.495 . . . . 0.0 113.279 175.562 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.1 m -127.61 131.85 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 124.772 1.229 . . . . 0.0 112.544 179.074 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 49.6 t -121.0 136.48 57.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.493 1.517 . . . . 0.0 109.83 -179.863 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.06 155.73 28.67 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.13 1.372 . . . . 0.0 113.35 170.571 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 87.3 m -155.15 151.55 28.38 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.853 1.661 . . . . 0.0 107.435 178.728 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -76.84 150.58 36.08 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.792 0.723 . . . . 0.0 112.25 173.886 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -125.12 170.76 10.89 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 127.001 2.12 . . . . 0.0 112.377 178.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -67.46 78.86 0.17 Allowed Glycine 0 CA--C 1.528 0.846 0 C-N-CA 125.221 1.391 . . . . 0.0 112.209 177.16 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 93.62 17.43 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 129.418 3.087 . . . . 0.0 112.359 178.802 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -157.07 -179.67 8.43 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.806 1.242 . . . . 0.0 109.974 -176.727 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 27.2 m -117.68 158.61 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.122 0.969 . . . . 0.0 109.328 166.608 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -131.83 176.93 7.93 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 124.851 1.26 . . . . 0.0 110.653 -175.082 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -136.34 153.88 51.01 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 125.193 1.397 . . . . 0.0 109.236 170.607 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -157.3 154.91 29.81 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 124.278 1.031 . . . . 0.0 110.871 -172.742 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -50.71 129.47 22.87 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.02 1.328 . . . . 0.0 107.581 168.362 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.18 -38.89 74.28 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 -169.563 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -151.13 163.68 38.25 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 123.1 1.428 . . . . 0.0 111.775 174.892 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.53 -36.79 0.11 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 129.761 3.225 . . . . 0.0 111.603 165.867 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -47.75 -63.94 0.92 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.198 1.799 . . . . 0.0 112.468 169.835 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 9.4 mt -71.59 -38.74 70.85 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.201 0.91 . . . . 0.0 110.369 -177.828 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.73 -47.13 77.45 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.307 0.643 . . . . 0.0 112.198 177.538 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 4.8 ppt_? -71.58 -47.54 54.14 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 117.868 -1.063 . . . . 0.0 111.589 178.706 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.62 -44.23 72.95 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.484 1.038 . . . . 0.0 113.387 176.776 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.82 -40.05 66.13 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.451 -0.781 . . . . 0.0 111.804 177.003 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.34 -36.38 50.22 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 124.935 1.255 . . . . 0.0 114.348 -174.727 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -74.01 -5.38 41.04 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 118.632 1.216 . . . . 0.0 112.548 169.855 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 50.3 tp 72.27 112.56 0.06 Allowed 'General case' 0 C--N 1.343 0.303 0 C-N-CA 129.582 3.153 . . . . 0.0 112.751 166.891 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.6 t -70.93 23.8 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 127.272 2.229 . . . . 0.0 113.186 -175.38 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 84.78 -14.89 0.58 Allowed 'General case' 0 N--CA 1.472 0.656 0 O-C-N 119.726 -1.859 . . . . 0.0 114.314 121.697 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.425 HG13 ' O ' ' B' ' 92' ' ' VAL . 8.1 p -64.34 49.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 130.492 3.517 . . . . 0.0 112.058 167.741 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 63.38 13.41 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 126.682 1.993 . . . . 0.0 114.306 -176.388 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt 100.73 108.35 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 130.004 3.322 . . . . 0.0 107.686 -169.519 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.08 0 C-N-CA 125.226 1.41 . . . . 0.0 113.022 171.181 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.8 mt . . . . . 0 CA--C 1.542 0.663 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.23 9.94 4.11 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -178.472 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.42 -35.26 6.82 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.378 0.671 . . . . 0.0 111.781 167.339 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -61.05 -51.92 67.16 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.213 1.405 . . . . 0.0 110.254 176.921 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.67 -23.83 69.2 Favored Glycine 0 CA--C 1.534 1.255 0 O-C-N 121.136 -0.977 . . . . 0.0 113.058 173.489 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.18 -33.62 65.52 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 118.872 1.336 . . . . 0.0 110.761 172.714 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -79.99 -34.46 38.54 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.637 1.175 . . . . 0.0 113.542 177.846 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 mt -63.82 -41.88 97.76 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.705 0.802 . . . . 0.0 112.486 174.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -94.28 -10.01 34.2 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -173.474 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.429 ' CG ' ' HD2' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -51.76 147.22 12.14 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.006 1.722 . . . . 0.0 111.344 -178.845 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.429 ' HD2' ' CG ' ' A' ' 20' ' ' ASP . 55.8 Cg_endo -35.57 -79.13 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.709 1 C-N-CA 127.864 5.71 . . . . 0.0 113.112 -166.804 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.9 p -81.24 -22.26 38.89 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 116.42 -1.752 . . . . 0.0 113.23 178.385 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.4 mtm-85 -63.33 -45.6 90.55 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 121.531 1.968 . . . . 0.0 111.67 175.98 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 25.1 t -50.8 -48.63 59.51 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.611 1.096 . . . . 0.0 110.749 169.545 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.1 mtm-85 -62.41 -47.75 82.72 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.467 1.107 . . . . 0.0 113.521 176.997 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.1 mm -53.13 -47.11 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.613 1.565 . . . . 0.0 110.863 170.319 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.567 HD22 HD21 ' A' ' 77' ' ' LEU . 48.8 mt -70.15 -43.02 71.74 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 117.746 -1.121 . . . . 0.0 112.769 -177.711 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.4 p -73.0 -25.99 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 119.95 1.25 . . . . 0.0 111.195 179.21 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.49 -12.95 59.48 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.743 1.217 . . . . 0.0 113.014 169.473 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.496 ' O ' HG13 ' A' ' 34' ' ' VAL . 13.1 tp -82.42 -36.49 26.61 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 116.948 -1.501 . . . . 0.0 112.139 169.223 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -43.48 -58.17 2.73 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.005 2.122 . . . . 0.0 112.881 -175.463 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -98.22 9.28 43.33 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.662 1.585 . . . . 0.0 112.403 172.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -108.54 -33.89 2.79 Favored Glycine 0 C--N 1.342 0.865 0 CA-C-O 114.585 -3.342 . . . . 0.0 117.92 -168.344 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.496 HG13 ' O ' ' A' ' 30' ' ' LEU . 33.9 m -15.59 43.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.069 2 C-N-CA 132.251 4.22 . . . . 0.0 122.122 175.801 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.8 m -95.78 -60.39 1.66 Allowed 'General case' 0 C--N 1.327 -0.386 0 O-C-N 118.763 -2.461 . . . . 0.0 111.514 178.205 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -146.41 151.55 43.9 Favored Pre-proline 0 N--CA 1.476 0.845 0 N-CA-C 116.633 2.086 . . . . 0.0 116.633 -169.214 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -63.83 133.1 37.45 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 123.479 2.786 . . . . 0.0 110.744 178.321 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.5 -2.62 52.52 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-O 118.753 -1.026 . . . . 0.0 114.444 -176.882 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -58.52 -28.91 65.88 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.344 1.572 . . . . 0.0 112.882 179.272 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mp -69.25 -2.52 10.81 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 122.481 0.312 . . . . 0.0 111.499 -172.067 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.99 -38.16 90.05 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.13 0.572 . . . . 0.0 110.541 169.091 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.94 -36.06 64.63 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.441 0.697 . . . . 0.0 111.999 170.708 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -66.73 -36.52 82.67 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 177.301 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.1 mt -105.03 -20.72 13.44 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -172.563 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.79 11.22 83.49 Favored Glycine 0 CA--C 1.537 1.416 0 CA-C-N 119.46 1.027 . . . . 0.0 113.091 -168.451 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.5 mt -100.75 148.18 25.19 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.697 1.199 . . . . 0.0 111.46 -176.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.435 HG23 ' H ' ' A' ' 50' ' ' ASN . 4.2 t -61.15 144.04 54.38 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 122.16 0.981 . . . . 0.0 111.891 -172.84 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.78 -20.15 54.91 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.222 1.009 . . . . 0.0 113.589 179.468 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.5 p -70.78 -60.12 2.42 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.442 1.019 . . . . 0.0 109.414 167.083 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.435 ' H ' HG23 ' A' ' 47' ' ' THR . 18.5 t-20 -54.32 -42.08 69.76 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.71 1.604 . . . . 0.0 114.684 178.481 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 5.0 t -64.32 -41.21 91.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 O-C-N 119.876 -1.765 . . . . 0.0 111.813 171.898 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 55.0 m -62.45 -43.36 99.01 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 119.159 0.89 . . . . 0.0 112.071 173.612 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -55.74 -45.36 78.02 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 127.004 2.121 . . . . 0.0 112.261 175.678 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 23.6 m170 -64.33 -40.51 96.04 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.149 -0.969 . . . . 0.0 112.863 171.693 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.6 mt -67.36 -25.32 65.92 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 118.691 0.678 . . . . 0.0 112.349 178.068 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.3 m -62.08 -44.76 95.97 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.213 1.37 . . . . 0.0 114.364 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 42.8 t -60.37 -54.0 50.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.975 1.31 . . . . 0.0 110.482 169.508 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.437 ' HG ' HD21 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -51.22 -42.59 61.06 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 128.535 2.734 . . . . 0.0 113.677 -177.668 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 9.1 mtm-85 -83.26 -4.4 58.39 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.538 1.535 . . . . 0.0 113.143 178.802 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -110.05 -26.31 5.0 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 126.236 1.874 . . . . 0.0 114.107 174.092 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 2.6 m -74.51 -1.46 21.44 Favored 'General case' 0 CA--C 1.564 1.504 0 C-N-CA 129.928 3.291 . . . . 0.0 111.724 168.86 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.82 14.45 37.37 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 126.184 1.849 . . . . 0.0 113.571 -175.122 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.9 mt -69.07 -30.23 68.51 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.458 -1.025 . . . . 0.0 111.676 172.777 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.8 t -134.43 132.44 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.902 0.881 . . . . 0.0 112.814 -167.472 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 89.0 t -126.61 141.13 46.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 126.058 1.743 . . . . 0.0 111.098 -168.074 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -93.68 148.7 21.86 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.202 1.401 . . . . 0.0 113.045 173.99 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.8 m -169.61 152.77 4.78 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.649 1.98 . . . . 0.0 107.119 -175.713 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -79.91 141.42 36.1 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 119.853 1.206 . . . . 0.0 112.895 174.788 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.263 0.0 OUTLIER -89.47 -17.94 27.7 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 122.603 0.361 . . . . 0.0 111.444 166.588 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 123.0 -30.26 5.1 Favored Glycine 0 N--CA 1.474 1.208 0 C-N-CA 126.592 2.044 . . . . 0.0 114.24 169.444 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.38 -15.96 14.88 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 128.226 2.611 . . . . 0.0 112.08 172.919 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -158.6 167.0 30.75 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 129.397 3.079 . . . . 0.0 109.469 -176.256 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 6.0 p -91.96 150.62 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.221 1.009 . . . . 0.0 109.908 168.543 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 12.3 ptt85 -126.49 163.93 22.28 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.95 0.881 . . . . 0.0 111.405 -176.422 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -111.28 156.41 21.55 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 114.294 -1.321 . . . . 0.0 107.584 164.519 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.474 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -163.19 151.22 13.57 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.143 0.977 . . . . 0.0 109.902 -176.413 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.567 HD21 HD22 ' A' ' 27' ' ' LEU . 14.5 mt -57.44 152.14 15.11 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 119.009 0.822 . . . . 0.0 109.02 167.314 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.14 -33.11 73.87 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -170.065 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -169.85 163.21 9.66 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.396 1.478 . . . . 0.0 112.684 -174.243 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 98.3 p -42.69 -33.81 0.79 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 128.491 2.717 . . . . 0.0 114.34 166.931 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -52.98 -52.09 59.42 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.864 1.666 . . . . 0.0 112.25 170.494 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 35.2 mt -73.0 -39.66 65.85 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 118.934 -0.555 . . . . 0.0 109.794 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.46 -44.52 72.61 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.441 1.096 . . . . 0.0 113.295 178.905 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -65.71 -49.8 67.18 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 120.007 1.276 . . . . 0.0 112.615 178.865 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.81 -44.99 83.98 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.46 1.027 . . . . 0.0 112.471 -179.46 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -64.84 -37.88 89.09 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.879 0.872 . . . . 0.0 110.714 176.605 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.9 -22.06 64.11 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 126.118 1.818 . . . . 0.0 114.102 176.996 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -115.75 23.5 12.25 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.129 1.372 . . . . 0.0 112.659 170.098 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.536 ' O ' HG13 ' A' ' 90' ' ' VAL . 30.6 tp 76.53 -38.85 0.33 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 128.969 2.908 . . . . 0.0 112.92 171.205 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.536 HG13 ' O ' ' A' ' 89' ' ' LEU . 2.6 m 160.96 -19.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.262 1 C-N-CA 132.312 4.245 . . . . 0.0 111.207 -170.389 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 93.59 -8.18 0.14 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 129.486 3.115 . . . . 0.0 113.533 175.96 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.1 p -66.85 41.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 C-N-CA 128.105 2.562 . . . . 0.0 116.646 -172.339 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER 71.09 13.5 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 C-N-CA 126.56 1.944 . . . . 0.0 112.371 174.138 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 88.91 95.13 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 130.111 3.364 . . . . 0.0 108.883 179.521 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.4 139.8 49.88 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.155 179.156 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.4 m -85.34 152.87 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 122.378 1.085 . . . . 0.0 111.492 179.239 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -79.84 12.35 2.72 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.472 1.509 . . . . 0.0 114.925 -168.749 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.9 m -104.29 47.35 0.88 Allowed 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.587 1.555 . . . . 0.0 109.863 -176.243 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -49.93 88.57 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 129.123 2.969 . . . . 0.0 113.14 -167.734 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -106.96 152.88 41.11 Favored Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 113.998 1.111 . . . . 0.0 113.998 -164.985 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -88.58 117.94 0.98 Allowed 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 122.087 1.858 . . . . 0.0 113.746 -175.24 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . 0.558 3.3 t . . . . . 0 N--CA 1.438 -1.045 0 CA-C-N 111.344 -2.662 . . . . 0.0 113.854 -161.302 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 87.8 mt . . . . . 0 CA--C 1.536 0.43 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.28 -4.24 13.59 Favored 'General case' 0 CA--C 1.549 0.904 0 O-C-N 120.71 -1.244 . . . . 0.0 114.104 172.525 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.74 -43.74 13.11 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 120.597 -1.314 . . . . 0.0 109.038 163.078 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.12 -49.1 73.51 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.148 1.779 . . . . 0.0 111.21 -174.539 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.56 -7.27 46.34 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 123.866 0.746 . . . . 0.0 114.443 172.618 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.38 -45.22 9.63 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.158 1.383 . . . . 0.0 108.75 168.143 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.16 -42.35 76.03 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.187 1.795 . . . . 0.0 114.446 -176.867 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -39.54 94.49 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.147 0.979 . . . . 0.0 111.29 178.59 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -98.37 -2.99 37.97 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.929 1.291 . . . . 0.0 114.449 -173.415 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . 0.481 ' CG ' ' HD2' ' B' ' 21' ' ' PRO . 0.3 OUTLIER -55.12 147.72 33.45 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 125.623 1.569 . . . . 0.0 112.525 177.882 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . 0.481 ' HD2' ' CG ' ' B' ' 20' ' ' ASP . 41.0 Cg_endo -37.66 -69.89 0.07 OUTLIER 'Trans proline' 0 C--N 1.354 0.824 1 C-N-CA 127.416 5.411 . . . . 0.0 113.407 -167.629 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.407 ' H ' ' HG2' ' B' ' 21' ' ' PRO . 2.2 p -90.65 -20.7 22.22 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 125.863 1.665 . . . . 0.0 112.95 179.731 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 9.3 mtm-85 -66.34 -42.85 87.56 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 121.493 1.951 . . . . 0.0 111.848 177.266 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 40.5 t -54.61 -49.67 69.91 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.36 0.982 . . . . 0.0 110.97 169.88 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -58.05 -54.23 49.34 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.157 0.983 . . . . 0.0 112.65 177.178 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 4.4 mm -45.76 -54.02 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 126.221 1.808 . . . . 0.0 111.175 169.87 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.592 HD22 HD21 ' B' ' 77' ' ' LEU . 42.5 mt -68.3 -37.44 80.61 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 117.806 -1.093 . . . . 0.0 113.434 -173.72 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.1 p -76.2 -27.4 17.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 CA-C-N 119.731 1.151 . . . . 0.0 111.434 176.961 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.97 -23.06 52.34 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.107 0.963 . . . . 0.0 112.858 173.075 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.435 ' O ' HG13 ' B' ' 34' ' ' VAL . 5.5 tp -73.5 -33.51 64.83 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 119.807 1.185 . . . . 0.0 113.76 171.187 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -45.52 -54.51 7.4 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.03 2.132 . . . . 0.0 113.299 -168.781 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -97.2 -11.42 24.26 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.415 1.486 . . . . 0.0 112.138 169.507 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -97.61 2.51 60.61 Favored Glycine 0 C--N 1.342 0.889 0 CA-C-O 116.64 -2.2 . . . . 0.0 118.235 -167.907 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . 0.435 HG13 ' O ' ' B' ' 30' ' ' LEU . 29.7 m -38.49 40.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.059 1 C-N-CA 131.81 4.044 . . . . 0.0 119.014 167.537 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 51.2 m -83.78 -74.5 0.37 Allowed 'General case' 0 C--O 1.223 -0.318 0 O-C-N 119.713 -1.867 . . . . 0.0 111.309 179.173 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.51 163.39 50.21 Favored Pre-proline 0 CA--C 1.547 0.829 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -169.889 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -63.1 130.18 28.12 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.158 1.906 . . . . 0.0 110.104 178.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.35 5.62 67.59 Favored Glycine 0 CA--C 1.538 1.49 0 CA-C-O 118.133 -1.371 . . . . 0.0 115.708 -178.304 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -25.2 64.43 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 120.124 1.962 . . . . 0.0 113.24 -177.457 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.8 mt -52.96 -20.1 3.13 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 125.946 1.698 . . . . 0.0 112.01 176.712 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.36 -30.44 70.53 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.312 0.645 . . . . 0.0 112.532 177.738 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.99 -50.82 11.38 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.39 0.676 . . . . 0.0 110.791 169.43 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -55.37 -38.38 68.76 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 -177.798 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.2 mt -96.83 -19.65 18.73 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.707 1.603 . . . . 0.0 112.756 -177.125 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.07 11.66 67.32 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-N 119.205 0.911 . . . . 0.0 113.2 -168.997 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 97.0 mt -102.13 141.11 35.5 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.115 1.366 . . . . 0.0 110.973 -174.276 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.401 HG23 ' H ' ' B' ' 50' ' ' ASN . 4.0 t -57.69 143.09 42.94 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.158 0.98 . . . . 0.0 112.186 -171.23 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.94 -19.13 39.96 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.755 1.222 . . . . 0.0 113.634 -179.463 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 7.5 p -72.29 -62.8 1.31 Allowed 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.656 1.116 . . . . 0.0 109.255 166.904 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . 0.401 ' H ' HG23 ' B' ' 47' ' ' THR . 10.1 t-20 -46.99 -46.84 21.95 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.433 1.493 . . . . 0.0 113.658 176.091 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.87 -40.52 89.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 O-C-N 120.474 -1.391 . . . . 0.0 112.661 175.507 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.0 m -66.74 -37.81 85.38 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 118.588 0.631 . . . . 0.0 111.645 176.156 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 9.5 m-20 -58.96 -45.03 91.51 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.0 1.72 . . . . 0.0 112.19 173.322 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -64.63 -40.93 96.33 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 120.403 -1.435 . . . . 0.0 112.967 172.129 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 49.6 mt -67.3 -31.32 71.53 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 179.291 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 37.6 m -61.22 -28.11 68.92 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -178.569 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 47.8 t -71.36 -51.31 24.89 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.075 0.95 . . . . 0.0 110.747 169.379 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . 0.412 ' HB3' HG22 ' B' ' 64' ' ' VAL . 4.5 mp -63.43 -40.3 96.81 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.389 2.275 . . . . 0.0 112.746 -171.957 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 60.7 mtm-85 -75.06 -5.7 45.53 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.593 1.157 . . . . 0.0 112.965 174.321 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -104.53 -38.07 2.68 Favored Glycine 0 N--CA 1.472 1.07 0 C-N-CA 124.718 1.151 . . . . 0.0 112.146 171.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 7.3 m -61.51 -6.94 2.69 Favored 'General case' 0 CA--C 1.56 1.353 0 C-N-CA 128.349 2.66 . . . . 0.0 113.409 169.471 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.02 13.66 62.21 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 125.217 1.389 . . . . 0.0 113.716 -175.561 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 83.6 mt -70.94 -26.12 63.04 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.593 1.196 . . . . 0.0 112.632 178.003 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.412 HG22 ' HB3' ' B' ' 58' ' ' LEU . 2.6 m -141.41 142.8 28.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.353 1.461 . . . . 0.0 111.558 -174.595 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 68.9 t -122.83 140.19 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 127.433 2.293 . . . . 0.0 109.253 -174.335 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -92.97 146.5 23.57 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.343 1.057 . . . . 0.0 112.425 170.126 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 2.4 m -167.47 168.42 12.97 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.079 2.151 . . . . 0.0 107.534 -172.888 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.44 ' HA ' ' HA ' ' B' ' 73' ' ' VAL . 13.0 m-85 -81.19 155.35 26.2 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 174.746 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.04 -26.58 14.19 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.629 0.772 . . . . 0.0 109.144 162.28 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 141.19 -31.74 2.14 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 127.575 2.512 . . . . 0.0 113.738 171.412 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.58 -18.9 11.82 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 129.518 3.127 . . . . 0.0 112.503 178.604 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -150.72 167.71 26.55 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 129.696 3.198 . . . . 0.0 109.026 -179.576 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . 0.44 ' HA ' ' HA ' ' B' ' 68' ' ' TYR . 14.3 m -85.1 165.31 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 O-C-N 121.666 -0.646 . . . . 0.0 111.087 167.544 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 21.6 ptt85 -138.11 167.91 20.82 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 127.07 2.148 . . . . 0.0 109.872 -179.438 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -119.02 133.03 56.07 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.738 1.215 . . . . 0.0 108.326 168.167 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . 0.432 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -136.25 151.25 49.47 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.479 1.112 . . . . 0.0 109.82 179.097 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.592 HD21 HD22 ' B' ' 27' ' ' LEU . 13.0 mt -55.5 149.0 14.32 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 168.735 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.43 -36.59 82.89 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -169.903 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -162.34 163.37 27.95 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.624 1.57 . . . . 0.0 112.23 178.366 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 95.6 p -44.22 -32.47 1.27 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.109 2.564 . . . . 0.0 113.546 167.643 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -52.89 -49.71 65.34 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 125.245 1.418 . . . . 0.0 112.507 170.512 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 21.4 mt -72.47 -46.94 52.48 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.964 0.802 . . . . 0.0 109.636 179.11 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.17 -40.2 64.18 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 117.776 -1.107 . . . . 0.0 113.738 -177.041 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -69.48 -47.35 64.18 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 120.408 1.458 . . . . 0.0 113.385 178.248 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.1 -43.26 95.89 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 118.928 0.785 . . . . 0.0 111.192 -179.267 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.54 -52.3 64.18 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.776 1.63 . . . . 0.0 110.374 170.919 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.94 -14.03 58.1 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.812 1.196 . . . . 0.0 114.567 -176.048 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . 0.257 20.7 pt-20 -114.91 18.48 16.42 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 169.876 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 21.4 tp 63.66 2.12 1.2 Allowed 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 128.522 2.729 . . . . 0.0 115.361 167.269 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 1.7 t 74.31 33.47 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 126.586 1.954 . . . . 0.0 110.37 -171.511 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . 0.405 ' C ' ' H ' ' B' ' 93' ' ' VAL . 0.8 OUTLIER 81.68 -14.07 0.83 Allowed 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 115.241 1.571 . . . . 0.0 115.241 118.417 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 13.1 p -67.46 39.09 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 129.558 3.143 . . . . 0.0 113.415 174.103 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . 0.405 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.2 OUTLIER 72.44 26.67 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 128.063 2.545 . . . . 0.0 113.182 177.001 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 84.36 90.15 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.77 2.028 . . . . 0.0 109.368 -177.724 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.613 0 CA-C-N 114.521 -1.218 . . . . 0.0 113.421 178.517 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.684 0 CA-C-O 120.376 0.131 . . . . 0.0 111.317 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.79 -18.22 60.5 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.281 1.832 . . . . 0.0 113.946 179.504 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.31 -57.23 3.46 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.464 1.105 . . . . 0.0 109.195 167.402 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -55.25 -63.53 1.13 Allowed 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 126.645 1.978 . . . . 0.0 110.331 -174.225 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -60.81 -36.21 91.5 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.641 -0.583 . . . . 0.0 111.641 -172.281 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 16.3 ttt85 -67.33 -50.97 57.88 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.839 0.856 . . . . 0.0 111.226 179.761 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.85 -27.02 67.79 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 176.641 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.4 mp -90.98 -12.47 35.81 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.447 1.099 . . . . 0.0 113.567 174.282 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.56 -20.15 40.52 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.7 1.2 . . . . 0.0 114.058 169.888 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -72.63 140.41 81.57 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 126.835 2.054 . . . . 0.0 109.424 174.261 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -53.03 -84.89 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.647 1 C-N-CA 126.696 4.931 . . . . 0.0 113.738 -166.621 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 52.1 m -70.3 -15.43 62.89 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 124.551 1.141 . . . . 0.0 111.134 -179.701 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -68.63 -40.2 80.42 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 120.378 -1.452 . . . . 0.0 113.312 -177.854 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 13.2 t -59.28 -40.21 85.38 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 121.806 0.812 . . . . 0.0 110.806 169.432 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.484 ' HB3' HD22 ' A' ' 44' ' ' LEU . 12.4 mmp_? -66.64 -41.27 88.54 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 172.879 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.424 HD11 ' HA ' ' A' ' 51' ' ' VAL . 5.1 mm -50.63 -44.38 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 120.077 -1.639 . . . . 0.0 111.412 171.328 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.26 -24.95 67.46 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 175.28 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -78.66 -29.51 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 124.77 1.228 . . . . 0.0 112.729 171.25 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.89 -32.46 63.6 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.494 0.717 . . . . 0.0 112.717 178.855 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.471 HD23 HG11 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -85.92 -10.42 55.26 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 173.226 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.07 -23.52 63.83 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-O 119.505 -0.283 . . . . 0.0 111.401 165.622 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -124.19 -59.52 1.48 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 127.768 2.427 . . . . 0.0 114.564 -171.92 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.05 -74.77 0.63 Allowed Glycine 0 N--CA 1.468 0.818 0 C-N-CA 125.354 1.455 . . . . 0.0 113.226 -165.86 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.9 m 45.88 33.66 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 C-N-CA 125.851 1.66 . . . . 0.0 113.815 -179.001 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.2 m -82.61 -51.63 7.57 Favored 'General case' 0 C--O 1.226 -0.157 0 O-C-N 120.932 -1.105 . . . . 0.0 112.046 -175.56 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 50.3 p90 -165.69 157.2 12.42 Favored Pre-proline 0 N--CA 1.477 0.894 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -169.78 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -61.73 104.43 0.32 Allowed 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 123.868 3.045 . . . . 0.0 110.128 173.937 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 113.86 -11.5 22.87 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-O 118.021 -1.433 . . . . 0.0 114.651 -175.01 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.72 -34.08 69.11 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.651 2.226 . . . . 0.0 111.349 175.079 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.688 HD12 ' H ' ' A' ' 40' ' ' LEU . 0.5 OUTLIER -62.8 -21.06 65.61 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 126.22 1.808 . . . . 0.0 111.985 -178.317 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.19 -30.02 69.02 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.431 0.692 . . . . 0.0 111.786 -179.581 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.37 -44.85 61.97 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.527 0.331 . . . . 0.0 110.344 169.87 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -62.59 -35.53 79.82 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -179.174 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.484 HD22 ' HB3' ' A' ' 25' ' ' ARG . 26.0 mt -103.27 -16.38 15.69 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -174.363 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.56 -2.08 54.99 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-O 118.072 -1.404 . . . . 0.0 114.341 -175.409 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 mp -105.6 148.43 27.32 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.561 1.68 . . . . 0.0 110.947 177.23 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.444 HG23 ' H ' ' A' ' 50' ' ' ASN . 13.5 t -54.83 151.24 8.77 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.356 1.063 . . . . 0.0 113.005 -173.252 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -50.13 -23.25 2.04 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.054 1.741 . . . . 0.0 113.839 169.498 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 14.7 m -69.22 -56.99 5.96 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.461 1.028 . . . . 0.0 111.85 170.395 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.444 ' H ' HG23 ' A' ' 47' ' ' THR . 16.0 t-20 -61.9 -42.85 99.56 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.461 1.028 . . . . 0.0 112.074 176.113 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.424 ' HA ' HD11 ' A' ' 26' ' ' ILE . 2.5 t -53.26 -48.16 55.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 123.834 0.854 . . . . 0.0 111.166 172.01 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 51.1 m -66.26 -35.96 81.75 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 177.559 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -60.4 -52.46 65.13 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.006 0.922 . . . . 0.0 110.097 176.579 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -68.36 -27.38 66.2 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 120.332 -1.48 . . . . 0.0 113.777 176.648 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 36.4 mt -70.42 -20.86 62.89 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 120.378 1.444 . . . . 0.0 113.311 167.862 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.2 t -63.19 -51.81 64.86 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 120.189 1.359 . . . . 0.0 112.973 -169.175 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 42.0 t -54.74 -51.25 66.25 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 123.956 1.836 . . . . 0.0 110.018 174.822 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.411 ' HB3' ' CG2' ' A' ' 64' ' ' VAL . 1.0 OUTLIER -48.36 -41.48 28.8 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 130.797 3.639 . . . . 0.0 113.628 -177.081 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 80.1 mtm-85 -78.86 -24.14 44.52 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 179.423 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.12 -54.69 2.1 Favored Glycine 0 N--CA 1.471 0.974 0 CA-C-N 119.181 0.9 . . . . 0.0 111.271 177.78 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 73.0 m -67.29 -3.69 8.69 Favored 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 127.119 2.168 . . . . 0.0 112.135 -178.853 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 86.01 10.57 74.99 Favored Glycine 0 C--N 1.34 0.792 0 C-N-CA 127.293 2.378 . . . . 0.0 116.304 164.791 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.8 mt -70.56 -22.75 62.56 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 119.6 1.7 . . . . 0.0 113.127 178.024 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.471 HG11 HD23 ' A' ' 30' ' ' LEU . 2.8 m -133.53 156.13 41.2 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 126.952 2.101 . . . . 0.0 113.088 171.454 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.3 t -133.47 153.44 37.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 127.744 2.418 . . . . 0.0 109.748 -179.57 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.52 145.65 26.02 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.822 1.649 . . . . 0.0 112.512 175.224 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.466 ' HB ' ' HG2' ' A' ' 74' ' ' ARG . 9.6 m -140.86 144.66 35.43 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.677 1.191 . . . . 0.0 109.285 -177.836 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -80.75 115.86 20.46 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.985 0.421 . . . . 0.0 110.803 167.89 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -88.54 166.08 14.41 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.25 1.42 . . . . 0.0 110.531 168.854 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -66.69 15.28 0.32 Allowed Glycine 0 N--CA 1.481 1.677 0 N-CA-C 117.035 1.574 . . . . 0.0 117.035 -169.59 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.61 -1.13 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.831 2.053 . . . . 0.0 114.185 178.229 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -168.55 164.8 12.49 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 126.172 1.789 . . . . 0.0 108.783 -168.959 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 34.5 m -94.68 156.42 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 CA-C-N 119.856 1.207 . . . . 0.0 110.626 168.834 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.466 ' HG2' ' HB ' ' A' ' 67' ' ' THR . 9.8 ptt180 -127.26 178.34 6.11 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.379 1.071 . . . . 0.0 112.65 -179.424 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -124.7 128.82 49.4 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.367 1.467 . . . . 0.0 108.384 165.236 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.02 157.43 41.73 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.291 1.037 . . . . 0.0 109.946 173.83 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.474 ' HB3' ' CD1' ' A' ' 82' ' ' LEU . 0.3 OUTLIER -66.61 153.6 42.65 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.339 0.518 . . . . 0.0 109.813 170.968 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.02 -36.18 79.52 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -168.584 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -158.71 158.81 34.42 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 123.378 1.561 . . . . 0.0 113.244 176.641 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -35.21 -39.23 0.11 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 130.25 3.42 . . . . 0.0 112.701 165.724 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -44.29 -66.12 0.43 Allowed 'General case' 0 C--N 1.342 0.275 0 C-N-CA 127.862 2.465 . . . . 0.0 112.647 169.519 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.474 ' CD1' ' HB3' ' A' ' 77' ' ' LEU . 1.2 pp -79.39 -25.39 42.15 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 118.576 -0.726 . . . . 0.0 112.626 -172.502 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.48 -45.77 89.23 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 122.71 0.404 . . . . 0.0 110.428 167.855 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 24.7 ttp85 -62.87 -54.0 45.54 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.618 1.167 . . . . 0.0 111.968 178.063 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.48 -35.97 79.14 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -175.707 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.25 -42.02 66.12 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.567 -0.708 . . . . 0.0 111.009 172.894 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.05 -43.88 98.16 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.824 1.678 . . . . 0.0 114.585 -178.409 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -76.06 -2.02 28.75 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.556 1.142 . . . . 0.0 113.482 174.263 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 34.2 tp 76.08 124.8 0.04 OUTLIER 'General case' 0 C--N 1.345 0.378 0 C-N-CA 130.136 3.374 . . . . 0.0 110.914 168.473 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 46.4 t -75.62 21.69 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 CA-C-O 123.465 1.602 . . . . 0.0 112.233 -169.521 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 84.99 -12.63 0.71 Allowed 'General case' 0 C--O 1.219 -0.534 0 O-C-N 120.038 -1.664 . . . . 0.0 111.467 130.662 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 12.7 p -68.35 46.81 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 C-N-CA 129.75 3.22 . . . . 0.0 111.14 164.672 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 69.71 -42.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 C-N-CA 130.486 3.514 . . . . 0.0 112.806 -169.893 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.1 tt 168.14 104.69 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 130.674 3.59 . . . . 0.0 106.03 -169.486 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.98 82.57 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.122 0 O-C-N 121.285 -0.885 . . . . 0.0 112.147 169.163 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 18.0 m -45.21 163.41 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 130.302 3.441 . . . . 0.0 116.788 -178.482 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -90.62 73.12 6.79 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.311 1.444 . . . . 0.0 109.263 166.444 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . 0.261 0.3 OUTLIER 172.8 138.83 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 128.477 2.711 . . . . 0.0 112.836 168.454 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -88.34 26.56 1.4 Allowed 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 130.526 3.53 . . . . 0.0 113.34 -171.244 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -33.43 134.82 0.32 Allowed Pre-proline 0 N--CA 1.483 1.176 0 C-N-CA 126.529 1.932 . . . . 0.0 112.821 -174.801 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -60.24 149.14 87.08 Favored 'Trans proline' 0 C--N 1.355 0.9 1 C-N-CA 126.12 4.546 . . . . 0.0 118.997 -164.94 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.809 0 C-N-CA 125.286 1.434 . . . . 0.0 109.551 170.135 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 pt? . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.26 -17.06 63.1 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.451 1.501 . . . . 0.0 112.967 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.43 -55.33 4.21 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.928 0.891 . . . . 0.0 110.216 167.439 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -54.93 -61.72 2.13 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.47 1.508 . . . . 0.0 110.716 -176.136 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.61 -38.63 95.93 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 111.781 -0.528 . . . . 0.0 111.781 -170.68 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 14.2 ttm105 -60.49 -48.51 81.46 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.704 1.602 . . . . 0.0 111.108 176.547 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.16 -29.94 69.78 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 177.51 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.0 mp -88.84 -8.0 55.11 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 113.858 1.058 . . . . 0.0 113.858 175.614 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -88.22 -15.64 35.39 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.637 1.575 . . . . 0.0 114.362 172.803 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -78.0 146.0 70.81 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 126.301 1.84 . . . . 0.0 110.825 174.33 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -59.13 -82.03 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.67 1 C-N-CA 126.474 4.783 . . . . 0.0 112.55 -168.974 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 5.7 m -59.42 -29.58 67.86 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.155 0.982 . . . . 0.0 111.114 176.48 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.407 ' HE ' ' HA ' ' B' ' 54' ' ' HIS . 11.0 ttm180 -66.74 -41.03 88.5 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -171.444 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 5.3 t -57.78 -47.24 83.12 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-O 122.238 1.018 . . . . 0.0 110.152 169.565 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . 0.436 ' HB3' HD22 ' B' ' 44' ' ' LEU . 11.2 mmp_? -63.05 -36.43 83.55 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.561 1.689 . . . . 0.0 115.561 175.911 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 4.8 mm -49.64 -41.4 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 120.319 -1.488 . . . . 0.0 111.91 173.283 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 83.0 mt -72.67 -29.62 63.57 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 112.808 0.669 . . . . 0.0 112.808 176.434 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . 0.426 HG23 HD22 ' B' ' 86' ' ' LEU . 0.3 OUTLIER -78.19 -25.59 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 O-C-N 120.585 -1.322 . . . . 0.0 112.096 176.46 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.77 -57.61 4.9 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.495 1.518 . . . . 0.0 108.822 168.337 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.411 HD12 HG11 ' B' ' 64' ' ' VAL . 10.4 mt -61.24 -23.38 65.6 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 117.163 2.282 . . . . 0.0 117.163 -176.126 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . 0.593 ' HA ' HD11 ' B' ' 77' ' ' LEU . 0.3 OUTLIER -42.5 -32.74 0.58 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 125.951 1.701 . . . . 0.0 112.109 168.427 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -120.05 -30.24 4.73 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 128.278 2.631 . . . . 0.0 112.324 168.563 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.8 21.55 1.58 Allowed Glycine 0 N--CA 1.465 0.633 0 C-N-CA 128.819 3.104 . . . . 0.0 115.39 -164.66 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . 0.575 HG12 ' HA ' ' B' ' 76' ' ' ALA . 13.3 m -64.87 29.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 C-N-CA 127.371 2.268 . . . . 0.0 114.613 173.818 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -85.17 -64.16 1.2 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.382 1.073 . . . . 0.0 111.457 -176.753 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 55.4 p90 -165.84 154.71 10.47 Favored Pre-proline 0 CA--C 1.545 0.751 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 -170.007 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -58.45 118.74 5.68 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 123.207 2.605 . . . . 0.0 109.894 175.971 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 94.22 -8.94 72.55 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-O 117.619 -1.656 . . . . 0.0 114.899 -174.64 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.67 -36.73 69.92 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 120.918 2.359 . . . . 0.0 110.545 172.855 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.694 ' H ' HD12 ' B' ' 40' ' ' LEU . 0.4 OUTLIER -61.6 -19.09 61.84 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 126.14 1.776 . . . . 0.0 112.361 -175.688 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.87 -31.27 71.76 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.145 0.578 . . . . 0.0 111.826 176.447 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.37 -43.81 59.9 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.661 0.384 . . . . 0.0 110.824 170.585 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -63.44 -33.41 75.51 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . 0.436 HD22 ' HB3' ' B' ' 25' ' ' ARG . 36.1 mt -104.35 -18.37 14.46 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.558 1.143 . . . . 0.0 113.725 -174.761 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.94 -0.72 61.48 Favored Glycine 0 CA--C 1.526 0.747 0 CA-C-O 118.156 -1.358 . . . . 0.0 113.756 -174.216 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 8.3 mp -107.2 143.32 35.59 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.031 1.415 . . . . 0.0 110.834 177.213 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.443 HG23 ' H ' ' B' ' 50' ' ' ASN . 9.8 t -51.35 149.97 3.78 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 126.189 1.796 . . . . 0.0 113.461 -173.295 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -49.12 -22.33 0.93 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.397 1.879 . . . . 0.0 113.458 169.372 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.4 m -67.22 -63.64 1.02 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.59 1.156 . . . . 0.0 112.374 169.516 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . 0.443 ' H ' HG23 ' B' ' 47' ' ' THR . 28.4 t-20 -65.04 -36.65 85.03 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.75 -1.219 . . . . 0.0 112.404 178.211 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.3 t -54.58 -48.79 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 122.963 0.505 . . . . 0.0 110.422 168.71 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.9 m -66.61 -38.81 87.76 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 117.809 -1.091 . . . . 0.0 113.926 177.508 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -54.36 -54.52 39.37 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.107 0.867 . . . . 0.0 109.692 174.57 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . 0.407 ' HA ' ' HE ' ' B' ' 23' ' ' ARG . 89.1 m-70 -70.9 -25.18 62.66 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.792 -1.193 . . . . 0.0 113.439 -178.872 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 32.0 mt -68.61 -25.52 64.89 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.436 1.471 . . . . 0.0 112.954 167.424 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.0 t -58.99 -55.79 30.65 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 119.983 1.265 . . . . 0.0 112.976 -169.44 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 40.5 t -53.46 -52.64 58.84 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 122.387 1.089 . . . . 0.0 109.476 172.655 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.4 tp -47.63 -38.16 14.14 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 128.293 2.637 . . . . 0.0 113.886 -174.291 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 25.2 mtm-85 -83.99 -32.62 24.88 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 119.684 1.129 . . . . 0.0 113.73 -179.211 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -83.3 -45.88 6.37 Favored Glycine 0 N--CA 1.467 0.755 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 -179.82 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 80.3 m -74.5 5.91 4.26 Favored 'General case' 0 CA--C 1.563 1.46 0 C-N-CA 127.484 2.313 . . . . 0.0 111.628 177.746 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.56 -6.46 83.38 Favored Glycine 0 C--N 1.344 1.01 0 C-N-CA 128.301 2.858 . . . . 0.0 119.078 165.594 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 59.9 mt -66.99 -26.93 67.05 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 119.366 1.583 . . . . 0.0 113.785 -172.713 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.411 HG11 HD12 ' B' ' 30' ' ' LEU . 11.1 m -132.01 161.09 41.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 126.767 2.027 . . . . 0.0 113.238 177.26 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 76.4 t -139.93 146.73 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 128.232 2.613 . . . . 0.0 109.877 -169.202 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -96.37 138.08 34.49 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.994 1.318 . . . . 0.0 111.605 170.493 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 9.5 m -146.88 147.19 30.56 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.097 1.359 . . . . 0.0 108.522 -174.465 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -77.11 138.03 39.28 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 175.778 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -112.17 164.71 12.88 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.385 1.874 . . . . 0.0 111.436 169.181 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.9 14.16 0.3 Allowed Glycine 0 N--CA 1.48 1.627 0 N-CA-C 117.271 1.669 . . . . 0.0 117.271 -168.952 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.92 -0.77 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.95 2.1 . . . . 0.0 113.849 178.907 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -168.79 167.08 11.3 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 126.561 1.945 . . . . 0.0 108.949 -168.225 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 35.2 m -93.74 159.34 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 119.818 1.19 . . . . 0.0 110.605 168.246 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 5.2 ptt180 -121.9 171.4 8.95 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 122.363 1.078 . . . . 0.0 112.508 178.154 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -119.94 112.62 19.41 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.469 -2.049 . . . . 0.0 105.469 165.227 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . 0.575 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -110.14 167.58 10.07 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.599 1.16 . . . . 0.0 110.147 174.458 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.593 HD11 ' HA ' ' B' ' 31' ' ' LEU . 0.0 OUTLIER -85.82 150.9 24.23 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 169.678 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.21 -50.47 69.31 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -168.411 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -153.34 160.35 42.66 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 123.275 1.512 . . . . 0.0 112.921 -178.822 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -35.34 -40.5 0.15 Allowed 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 129.657 3.183 . . . . 0.0 111.671 165.521 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -42.75 -68.22 0.21 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.469 2.308 . . . . 0.0 112.397 169.184 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 2.3 pp -79.04 -22.98 44.61 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -172.418 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.22 -44.51 91.69 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 122.892 0.477 . . . . 0.0 110.606 166.937 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 28.6 ttp85 -64.44 -51.61 62.23 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.132 1.773 . . . . 0.0 112.6 178.835 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.31 -41.61 80.23 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.983 0.81 . . . . 0.0 112.691 -179.857 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.426 HD22 HG23 ' B' ' 28' ' ' VAL . 0.3 OUTLIER -70.6 -41.53 72.17 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 118.79 -0.624 . . . . 0.0 111.038 176.263 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.87 -44.65 95.8 Favored Glycine 0 CA--C 1.533 1.189 0 C-N-CA 125.42 1.486 . . . . 0.0 114.389 179.571 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -76.93 -2.3 33.0 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.82 1.248 . . . . 0.0 113.129 172.982 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 44.7 tp 70.65 112.09 0.05 Allowed 'General case' 0 C--N 1.341 0.224 0 C-N-CA 129.679 3.192 . . . . 0.0 111.992 168.409 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.4 t -69.97 26.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 C-N-CA 127.198 2.199 . . . . 0.0 113.232 -176.167 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 89.02 -14.24 0.35 Allowed 'General case' 0 N--CA 1.468 0.47 0 O-C-N 119.623 -1.923 . . . . 0.0 113.226 119.046 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 11.5 p -63.95 39.69 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 130.306 3.443 . . . . 0.0 113.633 169.321 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 63.41 24.53 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 127.244 2.218 . . . . 0.0 112.823 -175.742 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 98.49 112.48 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 129.928 3.291 . . . . 0.0 107.947 -173.443 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.08 0 C-N-CA 123.866 0.866 . . . . 0.0 111.057 168.139 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 pp . . . . . 0 N--CA 1.473 0.707 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.84 -58.14 6.98 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 118.755 0.707 . . . . 0.0 111.724 175.639 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -62.28 -30.37 71.09 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 121.415 -0.803 . . . . 0.0 111.993 179.222 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.532 HD21 HD21 ' A' ' 63' ' ' LEU . 3.0 tm? -61.71 -43.41 98.91 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.798 1.639 . . . . 0.0 111.381 170.019 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -59.75 -29.25 66.93 Favored Glycine 0 N--CA 1.474 1.21 0 CA-C-N 119.548 1.067 . . . . 0.0 113.184 175.264 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.19 -27.37 64.45 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.085 0.954 . . . . 0.0 112.116 173.333 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.01 -26.13 62.1 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 120.104 1.32 . . . . 0.0 111.643 172.753 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.4 mp -83.21 -28.61 29.14 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.005 0.522 . . . . 0.0 111.389 172.71 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.7 -10.61 57.34 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 117.021 2.23 . . . . 0.0 117.021 -179.278 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.67 156.83 21.76 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 128.048 2.539 . . . . 0.0 114.098 -173.602 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.53 ' HG2' ' H ' ' A' ' 22' ' ' THR . 58.3 Cg_endo -53.65 -76.65 0.02 OUTLIER 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 124.532 3.488 . . . . 0.0 111.345 169.554 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.53 ' H ' ' HG2' ' A' ' 21' ' ' PRO . 57.9 m -87.37 -28.01 22.45 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 116.145 -1.883 . . . . 0.0 112.36 -172.528 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.3 mtt85 -64.15 -39.55 94.25 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 122.666 2.484 . . . . 0.0 111.589 172.668 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 15.2 t -57.66 -40.57 79.63 Favored 'General case' 0 CA--C 1.552 1.019 0 CA-C-N 121.466 1.939 . . . . 0.0 111.944 170.618 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -60.91 -55.82 28.49 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 121.129 -0.982 . . . . 0.0 112.081 173.688 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.4 mm -52.84 -42.82 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.96 1.704 . . . . 0.0 110.767 176.265 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 49.5 mt -68.21 -43.15 78.65 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.822 0.849 . . . . 0.0 112.869 178.714 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.2 p -68.37 -26.43 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 119.977 1.262 . . . . 0.0 111.806 177.471 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.66 1.67 9.73 Favored 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 127.242 2.217 . . . . 0.0 115.023 170.444 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.454 HD11 HG13 ' A' ' 64' ' ' VAL . 95.2 mt -99.23 -25.36 14.53 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.413 -1.429 . . . . 0.0 114.768 173.439 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.4 mt -59.4 -24.02 63.09 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.629 -1.169 . . . . 0.0 111.873 171.638 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 45.7 p-10 -132.25 -28.16 1.73 Allowed 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 116.036 1.865 . . . . 0.0 116.036 -175.179 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.86 -69.35 1.41 Allowed Glycine 0 C--N 1.343 0.945 0 CA-C-N 119.436 1.017 . . . . 0.0 113.221 -168.874 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 33.4 m 33.42 23.57 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 129.746 3.218 . . . . 0.0 119.14 174.88 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 69.2 m -86.08 -76.47 0.34 Allowed 'General case' 0 C--N 1.331 -0.204 0 O-C-N 121.01 -1.056 . . . . 0.0 109.764 177.608 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -137.04 157.1 75.24 Favored Pre-proline 0 N--CA 1.479 0.977 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -168.606 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -56.47 127.29 25.33 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.17 2.58 . . . . 0.0 110.535 173.327 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.05 -2.74 59.86 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-O 118.218 -1.324 . . . . 0.0 115.443 -178.292 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.79 -25.76 68.39 Favored 'General case' 0 N--CA 1.484 1.225 0 CA-C-N 120.46 2.13 . . . . 0.0 112.689 178.325 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.1 -12.27 3.31 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.507 1.123 . . . . 0.0 111.519 178.117 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.36 -38.56 91.62 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.988 1.315 . . . . 0.0 113.381 173.335 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.79 -37.98 70.33 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.586 0.63 . . . . 0.0 111.091 173.391 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -67.86 -47.73 68.09 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.209 1.004 . . . . 0.0 113.213 -178.987 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.2 mt -86.09 -11.92 51.46 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.539 1.136 . . . . 0.0 113.102 -178.659 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.31 -2.62 13.9 Favored Glycine 0 CA--C 1.537 1.444 0 C-N-CA 124.129 0.871 . . . . 0.0 113.728 -169.58 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.0 mt -81.9 153.52 26.29 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.618 1.167 . . . . 0.0 110.942 -176.712 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 50' ' ' ASN . 4.3 t -61.23 142.38 56.84 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.362 -0.836 . . . . 0.0 110.62 171.499 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.9 ptp180 -56.78 -23.79 45.82 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 118.685 -0.674 . . . . 0.0 112.667 178.366 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.0 m -66.04 -48.03 72.41 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.27 1.028 . . . . 0.0 113.258 170.862 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.407 ' H ' HG23 ' A' ' 47' ' ' THR . 43.6 t-20 -65.71 -41.21 92.58 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.041 1.336 . . . . 0.0 110.672 176.868 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 19.4 t -55.28 -49.9 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 123.654 0.781 . . . . 0.0 111.025 168.977 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 27.2 p -66.43 -36.15 82.1 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 120.31 1.414 . . . . 0.0 114.51 175.496 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -64.4 -45.28 88.3 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.31 1.444 . . . . 0.0 110.643 179.227 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -72.72 -35.35 67.55 Favored 'General case' 0 CA--C 1.558 1.281 0 CA-C-O 117.264 -1.35 . . . . 0.0 113.111 171.282 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.3 mt -63.11 -33.0 74.51 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 121.777 2.08 . . . . 0.0 113.719 173.259 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.3 m -55.42 -52.28 64.11 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.194 0.906 . . . . 0.0 113.405 -169.838 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 50.9 t -63.38 -40.29 96.86 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 122.933 0.493 . . . . 0.0 111.201 172.545 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.8 tp -58.86 -28.26 65.93 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.765 2.026 . . . . 0.0 112.908 -172.348 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 26.9 mtm180 -71.48 -38.9 71.18 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.9 0.88 . . . . 0.0 112.359 171.29 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -78.74 -36.12 29.98 Favored Glycine 0 N--CA 1.468 0.781 0 C-N-CA 125.883 1.706 . . . . 0.0 111.635 -176.721 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 36.3 m -61.86 -12.79 19.37 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 128.149 2.58 . . . . 0.0 112.865 167.28 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 81.87 -10.02 53.97 Favored Glycine 0 C--N 1.342 0.904 0 C-N-CA 126.957 2.218 . . . . 0.0 113.404 -179.033 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.532 HD21 HD21 ' A' ' 14' ' ' LEU . 85.0 mt -63.73 -33.03 74.73 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 127.496 2.318 . . . . 0.0 113.936 -169.902 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.454 HG13 HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -113.22 133.3 59.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.599 1.56 . . . . 0.0 109.101 166.833 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.8 t -121.79 133.06 69.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 124.971 1.308 . . . . 0.0 109.574 172.324 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.03 142.56 50.91 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 114.746 -1.115 . . . . 0.0 111.979 170.121 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.1 m -162.92 158.96 23.09 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.098 1.759 . . . . 0.0 106.944 -174.303 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -91.46 145.61 24.48 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.73 1.15 . . . . 0.0 113.206 178.302 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -111.39 -166.79 1.11 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.284 1.834 . . . . 0.0 109.85 168.79 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -72.02 -8.1 68.32 Favored Glycine 0 CA--C 1.537 1.417 0 O-C-N 120.498 -1.376 . . . . 0.0 116.457 -169.39 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.03 -31.28 0.77 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.326 1.85 . . . . 0.0 113.091 177.667 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.25 -175.79 4.97 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.942 1.246 . . . . 0.0 112.929 -172.642 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 8.1 p -79.81 146.96 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 123.842 0.857 . . . . 0.0 110.792 168.858 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -128.79 162.7 26.83 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 127.657 2.383 . . . . 0.0 111.091 -179.202 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -110.59 120.42 42.35 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.409 1.084 . . . . 0.0 108.919 168.262 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -121.46 168.62 11.49 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.881 1.272 . . . . 0.0 110.461 174.985 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 17.6 mt -58.64 155.44 12.54 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 172.642 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -48.04 -40.7 23.69 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.155 1.782 . . . . 0.0 114.342 -178.457 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -174.52 169.42 3.69 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.578 1.951 . . . . 0.0 110.982 -174.387 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 88.0 p -46.57 -34.75 5.18 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 127.372 2.269 . . . . 0.0 113.605 169.271 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 62.1 m-70 -54.23 -53.47 53.16 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 125.525 1.53 . . . . 0.0 112.221 176.203 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 28.2 mt -73.15 -37.1 66.73 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 118.219 -0.895 . . . . 0.0 110.61 -179.968 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.2 -50.76 64.03 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 118.913 0.779 . . . . 0.0 111.495 179.089 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -75.64 -32.23 60.15 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.49 1.041 . . . . 0.0 113.611 -179.274 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.18 -44.72 83.2 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.764 1.166 . . . . 0.0 112.576 176.298 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.01 -38.43 75.93 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.931 0.892 . . . . 0.0 110.694 174.63 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.16 -35.43 91.96 Favored Glycine 0 CA--C 1.529 0.907 0 O-C-N 121.418 -0.801 . . . . 0.0 112.225 176.884 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -83.15 9.57 10.21 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.865 1.266 . . . . 0.0 114.093 170.148 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.7 tp 66.52 -18.48 0.11 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 130.785 3.634 . . . . 0.0 117.525 164.041 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.27 34.3 m 118.71 20.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.138 1 C-N-CA 134.938 5.295 . . . . 0.0 112.152 178.219 . . . . . . . . 3 2 . 1 . 026 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.441 ' HB3' ' CG ' ' B' ' 81' ' ' HIS . 25.4 mm-40 79.63 -33.43 0.14 Allowed 'General case' 0 CA--C 1.539 0.524 0 O-C-N 120.176 -1.578 . . . . 0.0 114.127 162.945 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.8 p -57.34 16.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 C-N-CA 129.835 3.254 . . . . 0.0 117.572 -175.206 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.4 t 69.54 27.37 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 C-N-CA 125.218 1.407 . . . . 0.0 111.446 169.036 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.6 tp 80.13 96.94 0.06 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 129.53 3.132 . . . . 0.0 111.855 -173.805 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -87.69 114.76 24.61 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 120.887 -1.133 . . . . 0.0 109.045 170.021 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.3 m -141.82 142.99 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 127.528 2.331 . . . . 0.0 108.891 170.397 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.79 127.45 32.27 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.729 1.612 . . . . 0.0 109.688 170.818 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 2.7 m -179.88 -57.96 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 126.867 2.067 . . . . 0.0 109.138 -168.824 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.1 t0 176.19 56.44 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 131.235 3.814 . . . . 0.0 108.065 175.322 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -111.12 -163.2 0.05 OUTLIER Pre-proline 0 CA--C 1.555 1.139 0 C-N-CA 127.912 2.485 . . . . 0.0 110.543 -168.282 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -73.56 -159.57 0.08 OUTLIER 'Trans proline' 0 CA--C 1.55 1.282 0 CA-C-N 122.664 1.987 . . . . 0.0 112.928 177.021 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . 0.449 0.5 OUTLIER . . . . . 0 CA--C 1.55 0.959 0 C-N-CA 130.84 3.656 . . . . 0.0 117.402 -169.451 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 pp . . . . . 0 N--CA 1.472 0.659 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.23 -43.27 95.47 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.61 0.641 . . . . 0.0 111.506 177.299 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 25.6 ttp85 -64.95 -20.26 66.38 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.471 -1.393 . . . . 0.0 112.532 174.885 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.2 -38.22 85.79 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.802 1.637 . . . . 0.0 111.078 169.016 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -60.82 -25.52 63.92 Favored Glycine 0 CA--C 1.533 1.178 0 O-C-N 121.005 -1.059 . . . . 0.0 112.989 174.534 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 29.0 ttt-85 -69.35 -44.66 71.14 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 118.871 1.336 . . . . 0.0 110.364 170.817 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.54 -22.05 66.16 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 118.268 -0.873 . . . . 0.0 112.549 -177.014 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mp -91.34 -19.46 22.91 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.231 0.923 . . . . 0.0 113.308 168.384 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.0 -24.29 38.07 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 174.274 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -55.53 136.63 70.35 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 125.686 1.594 . . . . 0.0 109.597 178.849 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -49.26 -81.34 0.02 OUTLIER 'Trans proline' 0 CA--C 1.535 0.532 1 C-N-CA 126.611 4.874 . . . . 0.0 112.712 -167.695 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 13.4 m -62.86 -27.75 69.55 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 125.226 1.41 . . . . 0.0 111.415 -179.855 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -67.84 -43.5 79.38 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 120.495 1.498 . . . . 0.0 111.244 178.903 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 2.7 t -58.6 -14.1 7.38 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.51 1.05 . . . . 0.0 113.069 168.531 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -93.28 -55.33 3.35 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 120.265 -1.522 . . . . 0.0 112.053 171.641 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mt -38.87 -56.56 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 125.223 1.409 . . . . 0.0 110.464 170.899 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.52 ' HA ' HD12 ' B' ' 30' ' ' LEU . 96.9 mt -62.92 -30.56 71.65 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -170.545 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.6 p -88.12 -10.71 10.77 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 124.546 1.139 . . . . 0.0 112.337 178.012 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.71 -6.42 25.07 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 128.28 2.632 . . . . 0.0 112.907 176.503 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.545 HD11 ' CG1' ' B' ' 64' ' ' VAL . 52.7 mt -77.72 -54.27 6.56 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 119.639 -1.913 . . . . 0.0 110.177 168.84 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -35.31 -48.32 0.46 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 131.614 3.966 . . . . 0.0 114.303 179.551 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -102.8 -21.5 14.03 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.959 2.104 . . . . 0.0 113.224 -179.317 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -83.99 -70.1 1.36 Allowed Glycine 0 C--N 1.336 0.542 0 C-N-CA 125.826 1.679 . . . . 0.0 110.562 -170.726 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 11.0 m 32.46 26.81 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 N-CA-C 117.551 2.426 . . . . 0.0 117.551 -170.9 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 54.1 m -81.36 -89.56 0.07 Allowed 'General case' 0 C--O 1.221 -0.427 0 O-C-N 120.846 -1.159 . . . . 0.0 111.634 -178.661 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . 0.455 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 27.6 m-85 -135.16 156.52 78.12 Favored Pre-proline 0 N--CA 1.472 0.653 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -169.166 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -57.24 125.4 18.76 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.266 1.978 . . . . 0.0 109.359 171.554 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.14 -6.83 80.45 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 117.313 -1.826 . . . . 0.0 114.935 -174.091 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . 0.455 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 2.5 pp0? -59.36 -38.16 79.73 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 120.764 2.282 . . . . 0.0 111.235 172.273 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 15.0 mt -53.71 -23.05 10.42 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.224 1.41 . . . . 0.0 112.454 179.384 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.88 -28.15 69.3 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 176.966 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.03 -55.26 5.77 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.774 0.83 . . . . 0.0 110.6 171.312 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -49.67 -40.42 39.82 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 177.426 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.4 mt -95.6 -15.3 22.87 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.03 0.932 . . . . 0.0 113.245 -175.999 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.95 -5.13 4.93 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 124.542 1.068 . . . . 0.0 114.188 -170.123 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 87.8 mt -89.58 136.08 33.24 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 125.279 1.431 . . . . 0.0 109.678 -177.903 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.0 t -61.23 150.54 34.28 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.294 -0.879 . . . . 0.0 112.316 -173.631 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -57.5 -32.01 66.59 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -169.863 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.7 m -64.29 -52.34 59.02 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.017 0.927 . . . . 0.0 112.551 173.822 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -64.24 -40.92 97.01 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.8 1.24 . . . . 0.0 111.827 179.127 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 78.6 t -61.34 -44.7 98.94 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 121.505 -0.747 . . . . 0.0 111.143 169.504 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 81.1 p -64.04 -31.51 72.73 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.0 1.273 . . . . 0.0 113.913 176.88 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -57.27 -40.64 78.12 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 122.345 1.069 . . . . 0.0 110.854 174.316 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -73.85 -34.67 64.6 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 116.925 -1.512 . . . . 0.0 114.121 170.135 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 90.7 mt -61.24 -32.83 72.63 Favored 'General case' 0 N--CA 1.483 1.175 0 CA-C-N 121.793 2.088 . . . . 0.0 113.443 173.274 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 70.4 m -52.53 -44.82 66.01 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -174.159 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.1 t -75.73 -36.67 59.87 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.548 0.613 . . . . 0.0 110.788 175.733 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 10.1 tp -62.51 -28.33 69.76 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 127.16 2.184 . . . . 0.0 113.737 -168.148 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 28.2 mtm105 -71.92 -40.72 68.58 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.007 0.523 . . . . 0.0 110.602 171.815 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.82 -39.95 85.32 Favored Glycine 0 C--O 1.222 -0.654 0 CA-C-O 118.439 -1.2 . . . . 0.0 111.147 178.5 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 96.6 m -58.31 -12.91 4.18 Favored 'General case' 0 CA--C 1.565 1.556 0 C-N-CA 127.255 2.222 . . . . 0.0 112.323 168.541 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 82.29 -9.82 56.55 Favored Glycine 0 C--N 1.344 1.02 0 C-N-CA 127.033 2.254 . . . . 0.0 113.412 -179.834 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 19.8 mt -71.08 -31.52 67.92 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.196 1.398 . . . . 0.0 114.643 -167.862 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.545 ' CG1' HD11 ' B' ' 30' ' ' LEU . 0.1 OUTLIER -109.62 139.65 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.688 1.595 . . . . 0.0 111.125 169.874 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 71.6 t -132.66 133.7 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 C-N-CA 125.764 1.626 . . . . 0.0 109.241 -176.272 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.72 135.34 35.5 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.482 0.713 . . . . 0.0 110.126 168.965 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 2.1 m -162.49 163.5 27.47 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.764 1.625 . . . . 0.0 107.046 -171.31 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -91.73 151.77 20.48 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 120.89 -1.131 . . . . 0.0 113.673 178.518 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -119.22 -171.56 2.14 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.513 1.925 . . . . 0.0 108.834 166.396 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -69.99 -10.28 64.72 Favored Glycine 0 CA--C 1.536 1.378 0 N-CA-C 116.932 1.533 . . . . 0.0 116.932 -168.69 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 24.6 mtm180 -138.27 -21.94 1.04 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.153 1.781 . . . . 0.0 113.571 -177.4 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -154.83 -175.39 5.4 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.665 1.575 . . . . 0.0 112.755 -179.478 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 9.2 p -83.34 146.61 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.312 1.045 . . . . 0.0 110.453 169.073 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -134.72 162.48 32.22 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 126.436 1.894 . . . . 0.0 111.566 -170.962 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -106.59 127.0 52.98 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 165.723 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -128.62 172.11 11.51 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.385 1.874 . . . . 0.0 109.924 176.218 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 29.4 mt -76.03 158.96 31.3 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.116 0.566 . . . . 0.0 112.399 177.912 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -46.2 -34.92 4.68 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.712 2.005 . . . . 0.0 116.071 177.955 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 11.6 t70 171.59 158.63 0.09 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 128.922 2.889 . . . . 0.0 110.453 -169.988 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 91.9 p -40.98 -36.14 0.62 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 128.749 2.82 . . . . 0.0 113.501 168.57 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . 0.441 ' CG ' ' HB3' ' A' ' 91' ' ' GLN . 5.2 m-70 -49.47 -53.05 25.18 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 125.674 1.59 . . . . 0.0 113.039 173.854 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 14.2 mt -74.22 -40.11 62.66 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.075 0.852 . . . . 0.0 110.43 -179.395 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.01 -45.76 75.14 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.088 0.555 . . . . 0.0 110.99 179.376 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -77.01 -35.6 56.94 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 117.049 -1.453 . . . . 0.0 114.193 176.088 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -69.31 -33.45 73.18 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 121.143 1.792 . . . . 0.0 112.822 178.778 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.44 -44.5 51.46 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.587 0.755 . . . . 0.0 110.683 169.868 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.96 -32.67 73.58 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 123.972 0.796 . . . . 0.0 113.178 -176.022 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -71.68 -8.79 56.34 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.289 1.436 . . . . 0.0 112.548 169.421 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 4.8 tp 66.95 11.01 8.1 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 128.453 2.701 . . . . 0.0 115.338 167.994 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER 75.28 -9.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 C-N-CA 129.973 3.309 . . . . 0.0 111.907 168.093 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . 0.486 ' C ' ' H ' ' B' ' 93' ' ' VAL 0.482 5.2 pt20 73.93 12.46 4.31 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 115.306 1.595 . . . . 0.0 115.306 141.726 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.511 HG13 ' HB2' ' B' ' 95' ' ' ALA . 4.9 p -68.38 42.68 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 130.112 3.365 . . . . 0.0 109.368 163.141 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . 0.486 ' H ' ' C ' ' B' ' 91' ' ' GLN . 1.5 t 59.22 45.57 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 C-N-CA 127.741 2.416 . . . . 0.0 111.633 178.296 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 32.6 tp 60.26 60.37 2.07 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 122.096 0.951 . . . . 0.0 110.242 -179.92 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . 0.511 ' HB2' HG13 ' B' ' 92' ' ' VAL . . . . . . . . 0 CA--C 1.548 0.877 0 O-C-N 121.156 -0.965 . . . . 0.0 110.658 179.682 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 pt? . . . . . 0 N--CA 1.476 0.864 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.47 -54.23 35.77 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.879 0.871 . . . . 0.0 110.532 178.591 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -34.57 76.78 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.335 0.97 . . . . 0.0 112.586 176.631 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.474 ' HG ' HG11 ' B' ' 92' ' ' VAL . 3.2 tm? -68.77 -56.5 7.84 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.306 0.957 . . . . 0.0 111.066 -179.179 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.86 -29.84 75.91 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-O 119.128 -0.818 . . . . 0.0 111.141 -179.783 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -65.36 -48.4 73.08 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 118.344 1.072 . . . . 0.0 110.649 169.878 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.1 -24.97 67.44 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 119.869 1.213 . . . . 0.0 112.977 -179.647 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 mp -94.14 -4.34 49.39 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 171.477 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -99.68 -15.37 18.55 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 126.489 1.916 . . . . 0.0 114.192 168.511 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.406 ' CG ' HH21 ' A' ' 23' ' ' ARG . 0.7 OUTLIER -62.66 152.18 82.17 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 127.257 2.223 . . . . 0.0 112.671 174.221 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.35 -101.1 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 0.978 1 C-N-CA 127.533 5.489 . . . . 0.0 112.317 -169.681 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -44.92 -35.43 2.84 Favored 'General case' 0 C--O 1.22 -0.494 0 C-N-CA 126.516 1.926 . . . . 0.0 111.346 168.807 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.499 ' HG2' HD13 ' A' ' 58' ' ' LEU . 11.9 ttm-85 -64.41 -50.54 67.22 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 120.277 1.399 . . . . 0.0 113.952 -179.462 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.23 -42.51 99.37 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 120.069 1.304 . . . . 0.0 110.063 174.384 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 18.6 mmt-85 -54.48 -44.05 72.3 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 174.679 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.5 mm -50.22 -54.15 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.236 0.614 . . . . 0.0 109.792 170.772 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 86.7 mt -59.91 -48.11 83.05 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.472 -0.775 . . . . 0.0 112.173 -177.239 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.7 m -65.55 -36.05 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 CA-C-N 118.776 0.716 . . . . 0.0 111.092 -176.716 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.02 -26.7 33.58 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.513 0.561 . . . . 0.0 112.513 -178.773 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.418 ' O ' HG13 ' A' ' 34' ' ' VAL . 19.9 tp -68.79 -37.27 79.17 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 117.182 -1.389 . . . . 0.0 112.051 174.323 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.39 -50.83 12.0 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.182 2.193 . . . . 0.0 112.893 -173.135 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -104.05 8.72 36.6 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 126.454 1.902 . . . . 0.0 112.118 178.695 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -92.98 -73.85 1.25 Allowed Glycine 0 C--N 1.341 0.86 0 C-N-CA 127.365 2.412 . . . . 0.0 111.504 172.256 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.574 HG12 ' HA ' ' A' ' 76' ' ' ALA . 23.7 m 24.54 49.54 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 C-N-CA 128.399 2.68 . . . . 0.0 115.918 -172.792 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 80.3 m -96.61 -66.94 0.87 Allowed 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 125.523 1.529 . . . . 0.0 112.661 177.304 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -146.0 159.02 47.7 Favored Pre-proline 0 N--CA 1.486 1.364 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -168.382 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -55.45 126.27 21.92 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.214 2.609 . . . . 0.0 111.061 173.528 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.56 8.35 62.91 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 117.918 -1.49 . . . . 0.0 115.046 179.966 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.07 -24.74 26.71 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.353 2.076 . . . . 0.0 112.883 177.085 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.3 mt -63.2 -15.87 58.32 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 125.894 1.677 . . . . 0.0 111.643 -176.662 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.27 -29.75 70.04 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 170.308 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.0 -49.04 16.31 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.489 0.586 . . . . 0.0 110.711 169.959 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -59.05 -36.49 75.13 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -179.023 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 17.5 mt -101.45 -14.12 17.66 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.279 1.432 . . . . 0.0 112.468 -175.839 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.4 -1.83 12.19 Favored Glycine 0 CA--C 1.536 1.359 0 CA-C-N 119.416 1.007 . . . . 0.0 114.497 -171.981 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -85.54 150.97 24.29 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.879 1.272 . . . . 0.0 110.738 178.21 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.4 p -64.58 159.38 21.93 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.637 -1.289 . . . . 0.0 111.87 -177.506 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 23.7 ttm180 -53.24 -34.43 57.11 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.27 0.628 . . . . 0.0 111.385 175.186 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.2 m -66.28 -55.47 15.91 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.01 0.823 . . . . 0.0 111.378 172.988 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -57.73 -33.53 68.55 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.944 0.793 . . . . 0.0 112.902 179.323 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.8 t -72.26 -49.46 42.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.905 1.282 . . . . 0.0 112.329 172.54 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 39.5 m -64.52 -30.4 71.43 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.987 0.812 . . . . 0.0 112.297 -178.107 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -50.95 -35.57 34.14 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.252 1.421 . . . . 0.0 113.529 170.529 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -90.06 -29.45 18.36 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 117.534 -1.222 . . . . 0.0 113.997 174.214 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 66.8 mt -66.58 -27.77 67.98 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.142 1.337 . . . . 0.0 112.388 176.047 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.1 t -50.5 -51.2 49.58 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.168 0.587 . . . . 0.0 111.887 173.505 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 15.6 t -68.85 -45.72 70.33 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.79 1.236 . . . . 0.0 111.511 170.415 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.499 HD13 ' HG2' ' A' ' 23' ' ' ARG . 6.7 tp -62.53 -32.64 73.62 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -169.021 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 25.5 mtp-105 -75.8 -37.69 58.92 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.758 0.708 . . . . 0.0 112.535 168.945 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.5 -45.56 84.35 Favored Glycine 0 N--CA 1.469 0.873 0 C-N-CA 124.024 0.821 . . . . 0.0 112.646 -178.484 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.8 m -66.53 -5.59 11.88 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 126.472 1.909 . . . . 0.0 112.336 168.151 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.54 -7.57 57.41 Favored Glycine 0 C--N 1.338 0.675 0 C-N-CA 125.712 1.625 . . . . 0.0 115.315 175.989 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 37.5 mt -65.56 -25.67 67.53 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.934 1.294 . . . . 0.0 113.168 -169.128 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.6 m -119.63 139.29 47.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.14 1.376 . . . . 0.0 112.448 167.249 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 24.6 t -130.08 145.73 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 127.046 2.138 . . . . 0.0 109.681 -177.214 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.61 146.85 28.06 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 175.68 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.4 165.42 28.55 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.42 1.488 . . . . 0.0 110.188 172.544 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -89.55 138.04 31.81 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 118.393 -0.813 . . . . 0.0 109.496 165.259 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -95.76 -32.8 12.54 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.273 0.942 . . . . 0.0 112.166 167.277 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 146.77 -32.95 1.42 Allowed Glycine 0 N--CA 1.477 1.37 0 C-N-CA 125.873 1.702 . . . . 0.0 114.549 169.43 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 49.5 ttm-85 -89.17 -34.13 16.8 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 128.075 2.55 . . . . 0.0 111.652 170.523 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.54 179.86 8.78 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 128.084 2.553 . . . . 0.0 109.797 -172.582 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 15.9 m -85.98 161.43 2.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.456 166.723 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.0 ptt180 -138.38 156.17 47.85 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.044 1.737 . . . . 0.0 109.411 -178.619 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -90.88 148.68 22.31 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 164.395 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.574 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -148.49 164.73 33.29 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 123.682 0.793 . . . . 0.0 109.154 172.816 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -58.87 156.81 10.72 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 122.632 0.373 . . . . 0.0 111.859 169.92 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.73 -30.23 31.34 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -175.023 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.3 t0 174.98 167.36 0.28 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 129.976 3.311 . . . . 0.0 109.426 179.608 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 20.2 m -51.37 -22.94 3.25 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.283 1.833 . . . . 0.0 113.182 169.166 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.43 -58.39 8.21 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.343 1.057 . . . . 0.0 111.748 170.776 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 22.7 mt -65.35 -32.71 74.5 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.408 1.458 . . . . 0.0 110.841 176.034 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.12 -29.05 69.54 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.862 0.755 . . . . 0.0 111.073 -177.046 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -70.46 -53.91 14.44 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.731 1.212 . . . . 0.0 112.532 171.281 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.38 -40.01 96.08 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 120.622 1.555 . . . . 0.0 112.582 -178.858 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.34 -40.52 97.52 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.899 2.08 . . . . 0.0 113.165 169.89 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.85 -45.01 5.56 Favored Glycine 0 N--CA 1.476 1.343 0 C-N-CA 127.236 2.35 . . . . 0.0 114.701 -168.943 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 41.5 tp10 -62.3 -25.6 67.95 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.144 0.972 . . . . 0.0 108.617 165.204 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 20.6 tp 73.4 170.25 0.31 Allowed 'General case' 0 C--N 1.344 0.349 0 C-N-CA 130.162 3.385 . . . . 0.0 109.422 175.261 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.1 m -58.27 -5.39 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 O-C-N 120.24 -1.538 . . . . 0.0 113.573 168.125 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.452 ' C ' ' H ' ' A' ' 93' ' ' VAL . 19.7 mm-40 76.81 -24.87 0.21 Allowed 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 127.038 2.135 . . . . 0.0 111.844 165.409 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 2.3 p -62.89 29.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 128.595 2.758 . . . . 0.0 114.844 172.216 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.452 ' H ' ' C ' ' A' ' 91' ' ' GLN . 2.4 t 79.36 -22.08 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 130.217 3.407 . . . . 0.0 112.935 168.401 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.6 tp 132.16 99.8 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.771 1 C-N-CA 132.928 4.491 . . . . 0.0 107.674 -176.503 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.05 139.02 58.16 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 174.792 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 35.1 t -72.52 146.2 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 C-N-CA 124.658 1.183 . . . . 0.0 113.713 -169.024 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -77.21 51.24 0.82 Allowed 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 126.07 1.748 . . . . 0.0 113.291 173.203 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.6 p -122.19 151.45 40.99 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 125.748 1.619 . . . . 0.0 113.434 -176.025 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -88.35 115.17 25.66 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 165.791 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -140.43 140.14 22.19 Favored Pre-proline 0 CA--C 1.536 0.429 0 C-N-CA 124.121 0.968 . . . . 0.0 109.738 171.114 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -72.55 145.47 42.18 Favored 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 123.728 2.952 . . . . 0.0 113.77 -168.288 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 14.3 t . . . . . 0 CA--C 1.553 1.079 0 C-N-CA 125.376 1.47 . . . . 0.0 111.308 171.08 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 pt? . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.61 -23.36 66.8 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 119.645 1.111 . . . . 0.0 113.285 178.841 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . 0.472 HH21 ' CB ' ' B' ' 61' ' ' CYS . 3.4 tpt85 -82.25 -58.3 3.01 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.879 1.671 . . . . 0.0 110.759 169.004 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -64.75 -50.86 65.2 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 128.226 2.61 . . . . 0.0 112.655 -173.141 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.9 -39.08 97.59 Favored Glycine 0 CA--C 1.526 0.721 0 O-C-N 121.216 -0.927 . . . . 0.0 111.512 177.384 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.406 ' HA ' ' HB3' ' B' ' 19' ' ' ALA . 65.5 ttt180 -65.57 -34.54 78.47 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.64 0.776 . . . . 0.0 111.812 174.426 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.15 -24.97 65.16 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.473 1.033 . . . . 0.0 112.651 173.43 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.0 mp -101.7 -9.27 21.03 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.862 0.865 . . . . 0.0 113.088 174.571 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . 0.406 ' HB3' ' HA ' ' B' ' 16' ' ' ARG . . . -85.19 -19.86 31.08 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.756 1.623 . . . . 0.0 113.242 167.233 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -54.08 151.17 13.24 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 127.381 2.272 . . . . 0.0 113.571 173.055 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -66.92 -100.84 0.0 OUTLIER 'Trans proline' 0 CA--C 1.547 1.161 1 C-N-CA 127.194 5.262 . . . . 0.0 112.663 -171.91 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -47.46 -28.01 1.97 Allowed 'General case' 0 C--N 1.342 0.241 0 C-N-CA 126.467 1.907 . . . . 0.0 112.936 169.973 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.671 HH21 ' CB ' ' B' ' 57' ' ' CYS . 0.2 OUTLIER -68.93 -47.93 64.5 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 119.65 1.113 . . . . 0.0 113.66 177.85 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 43.3 t -60.41 -42.18 95.43 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.866 1.212 . . . . 0.0 110.728 172.757 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 19.3 mmt-85 -58.03 -43.14 86.59 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 174.437 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.1 mt -47.37 -57.7 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 CA-C-N 118.782 0.719 . . . . 0.0 109.185 169.155 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.758 HD22 HD21 ' B' ' 77' ' ' LEU . 63.6 mt -62.22 -44.72 95.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 117.365 -1.303 . . . . 0.0 112.608 -171.167 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.7 m -61.49 -33.3 56.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 CA-C-N 120.391 1.451 . . . . 0.0 111.698 176.34 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.01 -17.22 47.57 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.929 0.891 . . . . 0.0 113.37 177.617 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 tp -72.55 -42.12 65.02 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 117.366 -1.302 . . . . 0.0 111.446 169.115 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.03 -51.09 25.55 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.829 2.052 . . . . 0.0 112.475 -173.229 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -99.51 10.79 40.73 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.546 1.938 . . . . 0.0 112.581 -178.338 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -119.07 -80.44 0.68 Allowed Glycine 0 C--N 1.34 0.796 0 C-N-CA 126.46 1.981 . . . . 0.0 112.821 -173.388 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 9.1 m 35.58 37.68 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 126.559 1.944 . . . . 0.0 115.169 -169.995 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -82.33 -71.94 0.46 Allowed 'General case' 0 C--O 1.223 -0.327 0 O-C-N 120.842 -1.161 . . . . 0.0 112.357 -171.756 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -136.01 -176.18 0.55 Allowed Pre-proline 0 CA--C 1.553 1.096 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -168.547 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -79.51 95.92 1.05 Allowed 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 121.734 1.623 . . . . 0.0 108.964 -174.386 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 80.54 29.59 43.4 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-O 119.177 -0.79 . . . . 0.0 113.92 -177.648 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -60.73 -22.47 64.03 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.317 1.559 . . . . 0.0 112.0 169.889 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 8.1 mt -48.34 -20.87 0.44 Allowed 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 127.368 2.267 . . . . 0.0 113.455 171.018 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.28 -28.89 70.03 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.961 0.801 . . . . 0.0 112.055 176.958 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.01 -50.74 12.45 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.324 0.65 . . . . 0.0 110.55 168.904 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -56.91 -37.5 71.53 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -177.248 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.6 mt -97.58 -13.74 21.43 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.334 1.453 . . . . 0.0 112.28 -177.497 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.19 -6.58 4.0 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.691 1.139 . . . . 0.0 114.532 -171.349 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -84.12 147.65 27.23 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.91 1.355 . . . . 0.0 110.042 -179.532 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.7 p -59.93 155.29 16.9 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 121.677 -0.639 . . . . 0.0 111.311 -177.881 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -53.15 -35.77 60.11 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.099 178.054 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 11.6 m -64.26 -58.63 5.98 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.017 0.927 . . . . 0.0 111.514 172.139 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -55.16 -36.36 65.75 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.444 1.02 . . . . 0.0 113.262 -178.255 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 59.5 t -76.53 -43.4 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.465 0.706 . . . . 0.0 112.346 174.467 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.5 m -62.37 -30.67 71.36 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 119.763 1.165 . . . . 0.0 112.882 178.972 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -56.11 -28.97 59.88 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.879 1.271 . . . . 0.0 113.201 171.603 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 -90.46 -30.5 17.29 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-O 117.507 -1.235 . . . . 0.0 114.036 169.613 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 91.1 mt -64.79 -38.3 90.51 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 120.656 1.571 . . . . 0.0 113.035 177.808 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 1.2 m -60.3 -29.8 69.07 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 179.831 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . 0.671 ' CB ' HH21 ' B' ' 23' ' ' ARG . 40.0 t -75.86 -41.05 53.42 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.318 0.963 . . . . 0.0 110.682 169.017 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . 0.453 HD13 ' HG2' ' B' ' 23' ' ' ARG . 5.5 tp -57.79 -38.68 75.93 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 125.54 1.536 . . . . 0.0 112.597 -174.819 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 58.5 mtm-85 -73.03 -35.33 66.74 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 118.47 0.577 . . . . 0.0 112.098 174.458 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.82 -44.16 7.9 Favored Glycine 0 N--CA 1.468 0.774 0 C-N-CA 124.188 0.899 . . . . 0.0 112.855 -170.287 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . 0.472 ' CB ' HH21 ' B' ' 13' ' ' ARG . 94.4 m -74.18 16.21 0.26 Allowed 'General case' 0 CA--C 1.57 1.73 0 C-N-CA 125.837 1.655 . . . . 0.0 112.183 169.538 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.36 28.13 72.88 Favored Glycine 0 C--N 1.343 0.938 0 C-N-CA 127.38 2.419 . . . . 0.0 117.383 167.783 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.519 ' O ' HD23 ' B' ' 77' ' ' LEU . 56.1 mt -92.96 -32.64 14.47 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.183 0.992 . . . . 0.0 113.272 -177.782 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -134.56 138.57 49.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 C-N-CA 125.469 1.508 . . . . 0.0 113.598 -175.72 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 97.1 t -126.15 136.19 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 126.956 2.102 . . . . 0.0 108.83 179.856 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -77.64 141.13 39.61 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.782 0.833 . . . . 0.0 112.141 177.346 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -141.85 154.74 45.37 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.9 0.88 . . . . 0.0 108.828 171.817 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -73.83 132.62 42.75 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 167.715 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.53 -31.84 42.15 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.475 0.71 . . . . 0.0 110.887 166.86 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 145.61 -35.78 1.39 Allowed Glycine 0 CA--C 1.533 1.168 0 C-N-CA 126.51 2.005 . . . . 0.0 113.506 173.92 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 56.4 ttm-85 -96.06 -36.08 11.14 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 127.146 2.179 . . . . 0.0 111.886 169.921 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.38 -171.09 3.71 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.484 1.513 . . . . 0.0 110.768 -178.736 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 17.6 m -100.62 146.0 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.569 1.148 . . . . 0.0 111.106 176.459 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.0 ptt180 -116.39 172.26 7.31 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 126.537 1.935 . . . . 0.0 109.764 177.732 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -111.5 110.68 21.22 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 167.898 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -108.43 143.84 36.83 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.502 0.592 . . . . 0.0 109.49 176.06 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.758 HD21 HD22 ' B' ' 27' ' ' LEU . 8.5 mt -52.97 144.17 15.53 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 122.952 0.501 . . . . 0.0 110.864 169.385 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.28 -30.24 70.35 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 113.747 1.018 . . . . 0.0 113.747 -168.136 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -158.03 155.64 29.69 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 122.737 1.256 . . . . 0.0 111.622 167.387 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -39.95 -32.23 0.15 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 129.751 3.221 . . . . 0.0 113.264 167.185 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -52.95 -51.57 60.96 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.608 1.563 . . . . 0.0 112.844 169.532 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 11.8 mt -69.0 -44.35 72.98 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.225 0.921 . . . . 0.0 110.049 -178.881 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.59 -33.56 55.28 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.252 1.021 . . . . 0.0 112.617 173.52 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -69.61 -54.09 15.67 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.7 1.2 . . . . 0.0 113.479 173.28 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.31 -38.4 91.01 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 120.249 1.386 . . . . 0.0 112.672 178.619 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 60.1 tp -60.86 -41.52 96.08 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.099 1.76 . . . . 0.0 112.872 169.222 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.36 -44.91 6.37 Favored Glycine 0 N--CA 1.474 1.18 0 C-N-CA 127.167 2.318 . . . . 0.0 115.198 -169.062 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -63.15 -27.07 69.12 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 118.297 1.048 . . . . 0.0 109.156 166.641 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 30.6 tp 77.18 163.05 0.23 Allowed 'General case' 0 C--N 1.345 0.38 0 C-N-CA 129.971 3.308 . . . . 0.0 109.487 173.313 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . 0.489 HG23 HG12 ' B' ' 92' ' ' VAL . 14.9 m -54.21 -5.77 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 O-C-N 120.203 -1.561 . . . . 0.0 114.564 168.05 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 72.13 -20.32 0.26 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.739 2.015 . . . . 0.0 114.218 164.491 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.489 HG12 HG23 ' B' ' 90' ' ' VAL . 9.2 p -65.66 38.98 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 131.045 3.738 . . . . 0.0 114.275 -177.931 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.1 t 70.97 17.42 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 C-N-CA 126.387 1.875 . . . . 0.0 111.897 175.127 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 56.8 tp 73.95 108.17 0.07 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 129.596 3.158 . . . . 0.0 109.371 -168.507 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.695 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 175.79 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 pp . . . . . 0 N--CA 1.474 0.762 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.49 -26.31 67.83 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 174.221 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.6 mmt-85 -79.33 -43.09 24.24 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.33 -0.843 . . . . 0.0 110.911 168.967 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -56.18 -48.12 76.96 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.904 1.682 . . . . 0.0 112.622 -177.07 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.61 -26.59 71.23 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-O 119.539 -0.589 . . . . 0.0 112.56 -177.02 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.5 tmm_? -70.75 -45.44 64.82 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 118.322 1.061 . . . . 0.0 108.688 166.8 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.01 -22.55 66.97 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.019 1.328 . . . . 0.0 113.988 -176.964 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.7 mp -99.9 -3.45 32.4 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.894 1.225 . . . . 0.0 113.125 168.949 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -86.76 1.38 52.41 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.555 1.142 . . . . 0.0 113.165 167.926 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.82 160.78 71.65 Favored Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 127.177 2.191 . . . . 0.0 114.145 -172.003 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -72.4 -121.68 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.125 1 C-N-CA 126.061 4.508 . . . . 0.0 110.139 173.079 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.9 m -56.97 -21.07 27.51 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.014 1.326 . . . . 0.0 113.405 179.946 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.04 -39.64 79.08 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.6 1.546 . . . . 0.0 112.254 173.547 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 5.7 t -71.28 -28.08 63.88 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.661 -1.274 . . . . 0.0 111.483 169.623 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.9 tpp180 -61.68 -40.25 94.31 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 120.742 -1.224 . . . . 0.0 111.769 170.766 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.496 HG23 HD13 ' A' ' 40' ' ' LEU . 1.9 mm -57.17 -43.49 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 124.873 1.269 . . . . 0.0 112.43 171.585 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 71.6 mt -60.11 -47.0 87.72 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 119.129 -0.462 . . . . 0.0 111.74 174.769 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.4 p -76.55 -26.59 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -171.869 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.84 -21.52 37.54 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 173.334 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.3 tp -77.63 -29.43 51.76 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 120.947 1.703 . . . . 0.0 112.117 170.602 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.42 -49.68 17.77 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.84 2.056 . . . . 0.0 112.51 170.129 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -101.31 29.84 4.53 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 128.538 2.735 . . . . 0.0 110.55 174.703 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -128.02 -84.45 0.45 Allowed Glycine 0 CA--C 1.527 0.791 0 C-N-CA 125.6 1.571 . . . . 0.0 113.256 -177.542 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 26.9 m 31.77 31.4 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 118.347 2.721 . . . . 0.0 118.347 -171.172 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 96.3 m -83.3 -87.33 0.1 Allowed 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 125.316 1.446 . . . . 0.0 110.861 175.821 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -136.37 153.23 76.18 Favored Pre-proline 0 N--CA 1.472 0.63 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -169.569 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -56.53 135.02 68.05 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.991 1.794 . . . . 0.0 109.096 171.882 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.72 -5.89 67.87 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 117.874 -1.515 . . . . 0.0 114.854 -174.961 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.88 -28.89 64.6 Favored 'General case' 0 C--N 1.348 0.539 0 CA-C-N 120.499 2.149 . . . . 0.0 112.38 177.284 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.496 HD13 HG23 ' A' ' 26' ' ' ILE . 4.0 mt -69.09 -16.1 63.6 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 124.262 1.025 . . . . 0.0 111.952 -175.762 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.58 -47.54 66.51 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 119.772 1.169 . . . . 0.0 110.36 174.315 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.48 -39.97 85.26 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.849 -0.532 . . . . 0.0 111.789 172.587 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -71.78 -27.85 63.22 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -175.796 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 37.6 mt -95.96 -22.79 17.19 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.316 1.046 . . . . 0.0 112.16 173.749 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.54 9.81 86.72 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.319 0.961 . . . . 0.0 112.003 -167.97 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 80.3 mt -108.26 167.57 9.93 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.954 1.302 . . . . 0.0 112.445 -169.358 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.7 p -69.15 143.26 54.14 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.526 0.679 . . . . 0.0 112.537 -167.882 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -56.71 -31.49 64.56 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.44 1.096 . . . . 0.0 111.157 172.024 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 12.4 m -66.0 -54.43 26.24 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.14 0.976 . . . . 0.0 111.445 171.096 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -70.43 -35.46 73.41 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.464 1.029 . . . . 0.0 112.239 -175.531 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.405 HG22 HD11 ' A' ' 26' ' ' ILE . 6.3 t -61.78 -34.69 63.61 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 O-C-N 119.57 -1.956 . . . . 0.0 111.865 169.779 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 56.0 m -67.53 -41.93 83.57 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 120.134 1.334 . . . . 0.0 112.523 172.753 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -50.7 -45.98 58.63 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.66 0.784 . . . . 0.0 110.735 171.973 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -68.93 -33.9 74.5 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 -179.189 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 23.8 mt -88.89 -7.32 56.31 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.807 1.243 . . . . 0.0 113.988 -178.172 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.7 t -67.05 -51.18 57.82 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 120.194 1.361 . . . . 0.0 110.886 177.217 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 5.2 t -73.8 -39.84 63.83 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 122.893 0.477 . . . . 0.0 111.76 179.767 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.3 tp -55.25 -38.19 68.21 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.778 2.031 . . . . 0.0 113.556 -174.036 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.7 mtm180 -78.51 -23.11 46.49 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.46 1.104 . . . . 0.0 112.178 -179.741 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -80.49 -55.51 3.41 Favored Glycine 0 C--N 1.342 0.908 0 C-N-CA 125.861 1.696 . . . . 0.0 110.78 172.766 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 66.6 m -51.08 -16.12 0.42 Allowed 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 127.413 2.285 . . . . 0.0 113.164 173.184 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.4 ' O ' ' HB2' ' A' ' 78' ' ' ALA . . . 79.35 -3.24 67.92 Favored Glycine 0 C--N 1.338 0.677 0 C-N-CA 125.91 1.719 . . . . 0.0 113.716 179.468 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 34.5 mt -57.17 -26.57 60.83 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 118.495 1.148 . . . . 0.0 112.323 -179.044 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 6.1 m -133.21 156.88 42.49 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.102 0 C-N-CA 126.488 1.915 . . . . 0.0 111.384 169.204 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.5 m -148.92 151.5 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 126.043 1.737 . . . . 0.0 111.349 -171.907 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -88.4 140.27 29.63 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.355 1.462 . . . . 0.0 112.416 176.94 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 90.2 m -160.84 158.83 29.04 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.774 1.63 . . . . 0.0 107.777 -179.892 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -84.97 138.15 32.66 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 121.57 1.986 . . . . 0.0 112.011 169.6 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.0 -10.2 57.26 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 169.866 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 131.29 -22.5 4.43 Favored Glycine 0 N--CA 1.474 1.205 0 C-N-CA 125.96 1.743 . . . . 0.0 114.751 174.697 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.94 5.71 0.3 Allowed 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.056 2.142 . . . . 0.0 113.886 -179.909 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -152.67 157.64 41.23 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 128.62 2.768 . . . . 0.0 108.043 168.641 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 5.6 p -79.78 145.85 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 168.642 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.9 ptt85 -124.7 148.2 48.16 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 125.535 1.534 . . . . 0.0 109.837 -177.494 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -100.42 135.08 42.41 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 105.443 -2.058 . . . . 0.0 105.443 164.902 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -145.87 158.3 43.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 118.19 -0.909 . . . . 0.0 111.541 -176.003 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 tp -56.53 154.86 8.0 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.064 0.945 . . . . 0.0 112.688 176.342 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 62' ' ' GLY . . . -59.14 -11.08 3.27 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 117.83 2.53 . . . . 0.0 117.83 -175.898 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.0 t70 152.1 161.62 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 131.165 3.786 . . . . 0.0 109.549 -177.371 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -41.33 -22.51 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 129.372 3.069 . . . . 0.0 112.099 163.579 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -64.12 0.96 Allowed 'General case' 0 C--N 1.349 0.563 0 C-N-CA 126.621 1.968 . . . . 0.0 111.485 175.21 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 25.3 mt -56.27 -43.77 79.09 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.701 1.137 . . . . 0.0 108.741 173.928 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.53 -44.65 69.35 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.512 1.125 . . . . 0.0 112.148 -172.884 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -79.67 -15.09 58.22 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 115.706 1.743 . . . . 0.0 115.706 -175.887 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -92.78 -48.45 6.56 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.695 1.134 . . . . 0.0 110.956 170.278 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.5 tp -49.62 -45.83 48.62 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.641 1.976 . . . . 0.0 110.824 169.679 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.81 -19.33 79.31 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 126.796 2.141 . . . . 0.0 116.433 -170.925 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -101.54 -0.88 34.21 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 118.928 1.364 . . . . 0.0 113.047 170.208 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.6 tp 93.7 23.57 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 129.19 2.996 . . . . 0.0 113.68 169.219 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.285 3.9 t 71.34 37.98 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 125.47 1.508 . . . . 0.0 110.04 169.436 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 86.61 -21.98 0.18 Allowed 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.309 -0.869 . . . . 0.0 112.329 130.021 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.9 p -72.66 39.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 129.428 3.091 . . . . 0.0 112.566 171.94 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.6 m 52.44 10.61 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 128.627 2.771 . . . . 0.0 116.425 -179.903 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.8 tt 100.35 101.37 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 130.857 3.663 . . . . 0.0 108.829 -169.719 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -103.1 155.66 18.24 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.258 0.623 . . . . 0.0 111.035 170.255 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 31.3 m -98.24 150.25 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -171.681 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 59.7 p30 -99.57 -4.07 31.92 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 -179.713 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -75.71 40.0 0.18 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 127.708 2.403 . . . . 0.0 115.701 -167.015 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 45.8 t0 62.88 69.56 0.59 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.812 2.045 . . . . 0.0 110.081 170.66 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.97 164.57 33.23 Favored Pre-proline 0 CA--C 1.549 0.925 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.531 -169.879 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -83.21 172.75 10.41 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 124.292 3.328 . . . . 0.0 111.819 177.663 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 31.0 p . . . . . 0 CA--C 1.55 0.946 0 CA-C-O 123.073 1.416 . . . . 0.0 107.26 165.532 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 pp . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.67 -27.85 68.97 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 118.624 0.647 . . . . 0.0 112.49 175.548 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 1.3 mmt-85 -77.16 -26.36 52.92 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 116.854 -1.546 . . . . 0.0 113.413 176.979 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.71 -63.97 1.03 Allowed 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.785 1.175 . . . . 0.0 109.5 170.928 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.27 -37.71 95.31 Favored Glycine 0 N--CA 1.471 0.972 0 CA-C-N 118.22 0.464 . . . . 0.0 112.704 -172.764 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -46.58 88.98 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.698 0.799 . . . . 0.0 111.292 173.799 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.55 -14.72 61.7 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 118.239 -0.886 . . . . 0.0 112.893 -179.625 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 10.6 mp -93.39 -24.21 18.15 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.169 0.895 . . . . 0.0 112.607 170.624 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.18 -16.64 57.71 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.894 1.678 . . . . 0.0 113.776 169.443 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -59.36 130.64 87.5 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 126.423 1.889 . . . . 0.0 109.511 176.643 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -48.92 -72.3 0.05 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.554 1 C-N-CA 125.869 4.379 . . . . 0.0 111.918 -168.59 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 70.8 m -91.56 -15.43 28.69 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 117.914 -1.041 . . . . 0.0 112.082 -173.739 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 48.4 mtt180 -66.1 -33.97 76.99 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 121.415 1.916 . . . . 0.0 110.779 167.997 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 42.4 t -56.75 -46.03 81.64 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 120.024 1.284 . . . . 0.0 111.15 167.309 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -60.88 -46.71 89.55 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.56 0.744 . . . . 0.0 111.866 176.539 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.6 mm -57.85 -49.93 79.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.953 1.301 . . . . 0.0 112.06 174.706 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 85.8 mt -62.11 -45.34 93.89 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.092 0.957 . . . . 0.0 111.496 -178.767 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 5.7 p -74.81 -32.5 28.37 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 CA-C-N 118.868 0.758 . . . . 0.0 112.979 -179.501 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.95 -28.83 64.77 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.494 -0.754 . . . . 0.0 111.875 173.857 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.7 tp -65.3 -36.27 83.54 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-N 119.973 1.26 . . . . 0.0 113.507 175.509 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.96 -40.57 30.93 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.999 2.52 . . . . 0.0 113.077 171.414 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -98.24 9.14 43.68 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 127.023 2.129 . . . . 0.0 112.307 179.499 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -126.0 -82.61 0.46 Allowed Glycine 0 CA--C 1.527 0.815 0 C-N-CA 124.746 1.165 . . . . 0.0 115.147 -169.725 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 34.6 m 36.93 32.13 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 127.884 2.474 . . . . 0.0 116.707 -168.57 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 68.2 m -79.75 -90.65 0.05 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.662 0.785 . . . . 0.0 111.019 179.716 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -136.72 154.65 76.64 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -169.174 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -55.89 125.69 19.94 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.316 2.011 . . . . 0.0 109.696 175.55 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 90.03 -7.27 81.96 Favored Glycine 0 CA--C 1.533 1.178 0 CA-C-O 117.6 -1.667 . . . . 0.0 115.348 -174.409 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -27.05 63.17 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.666 2.233 . . . . 0.0 112.137 178.938 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 2.1 mp -71.35 -18.88 62.36 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-O 117.913 -1.042 . . . . 0.0 113.075 -177.653 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.09 -40.9 97.24 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.88 1.218 . . . . 0.0 111.206 172.443 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.04 -44.13 66.43 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.652 -0.655 . . . . 0.0 111.714 170.122 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.96 -29.23 70.65 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -177.714 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 45.9 mt -103.76 -14.06 16.21 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.336 1.454 . . . . 0.0 113.824 179.18 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.98 -0.51 45.59 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 119.004 0.82 . . . . 0.0 113.797 -169.153 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 43.3 mt -92.37 157.96 16.33 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.757 1.279 . . . . 0.0 111.653 -171.38 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 13.3 p -62.25 147.43 48.02 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.134 0.492 . . . . 0.0 110.91 -174.594 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 ptp180 -57.94 -33.6 68.98 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 122.148 -0.345 . . . . 0.0 111.834 175.883 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 15.9 m -65.68 -49.29 69.11 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.649 0.779 . . . . 0.0 111.532 171.345 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -66.07 -43.03 88.57 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 118.897 0.771 . . . . 0.0 111.246 -178.612 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 4.2 t -59.88 -32.04 48.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 O-C-N 119.303 -2.123 . . . . 0.0 112.55 170.371 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 54.8 m -67.66 -39.93 84.5 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.922 1.237 . . . . 0.0 113.204 172.468 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -50.15 -46.79 54.3 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.976 0.911 . . . . 0.0 110.715 171.215 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -67.18 -45.42 77.0 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 118.523 -0.751 . . . . 0.0 112.162 -179.311 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 32.2 mt -73.49 -22.55 60.11 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.963 1.098 . . . . 0.0 113.963 -177.828 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -56.49 -53.11 61.27 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.137 1.335 . . . . 0.0 113.685 -176.758 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 2.3 t -70.64 -40.17 73.24 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 118.654 0.661 . . . . 0.0 110.727 177.507 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 2.0 tp -56.23 -38.39 70.99 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 127.796 2.439 . . . . 0.0 114.743 -173.32 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 46.9 mtm105 -78.76 -16.05 57.68 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.276 1.03 . . . . 0.0 112.757 177.43 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -85.4 -54.39 2.84 Favored Glycine 0 C--N 1.341 0.847 0 C-N-CA 125.82 1.676 . . . . 0.0 111.025 169.715 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 99.4 m -50.94 -16.26 0.41 Allowed 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 127.549 2.34 . . . . 0.0 113.296 175.162 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.11 -4.18 59.19 Favored Glycine 0 C--N 1.338 0.684 0 C-N-CA 125.99 1.757 . . . . 0.0 113.526 -178.394 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 68.3 mt -56.11 -28.65 58.65 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.633 1.217 . . . . 0.0 112.286 178.707 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 8.1 m -132.22 155.64 41.68 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 C-N-CA 126.025 1.73 . . . . 0.0 111.451 169.642 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 1.7 m -147.63 151.63 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.73 1.612 . . . . 0.0 111.443 -170.213 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -94.13 140.25 29.98 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.442 1.497 . . . . 0.0 111.544 178.006 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.432 HG22 ' N ' ' B' ' 68' ' ' TYR . 47.7 m -163.15 171.97 15.54 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.547 1.539 . . . . 0.0 108.375 -174.442 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.432 ' N ' HG22 ' B' ' 67' ' ' THR . 6.5 m-85 -88.15 145.04 26.13 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 121.04 1.746 . . . . 0.0 111.878 167.807 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.19 -44.71 13.68 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.461 -0.774 . . . . 0.0 111.328 170.533 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.25 -25.55 0.03 OUTLIER Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.553 1.549 . . . . 0.0 114.266 171.368 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.76 -29.73 0.78 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.042 1.737 . . . . 0.0 112.751 176.952 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -117.38 166.55 12.18 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.326 2.25 . . . . 0.0 110.255 176.982 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 8.7 p -79.78 147.93 6.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.641 172.255 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 14.0 ptt85 -130.65 160.93 32.77 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 127.983 2.513 . . . . 0.0 109.646 -177.306 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 21.2 m-30 -104.59 146.56 28.73 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 161.924 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -148.72 157.97 43.82 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 124.376 1.07 . . . . 0.0 110.299 178.807 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 58.3 mt -62.56 155.28 26.34 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.604 0.638 . . . . 0.0 111.529 172.279 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -50.49 -21.5 1.52 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 128.155 2.582 . . . . 0.0 117.3 -176.128 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 8.3 t70 167.4 168.2 0.03 OUTLIER 'General case' 0 C--O 1.24 0.558 0 C-N-CA 130.669 3.588 . . . . 0.0 108.282 177.167 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -42.02 -20.25 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.782 2.433 . . . . 0.0 111.778 162.087 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -63.18 1.3 Allowed 'General case' 0 C--N 1.346 0.415 0 C-N-CA 127.885 2.474 . . . . 0.0 111.742 175.5 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 34.1 mt -65.1 -35.86 82.46 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.384 0.993 . . . . 0.0 109.683 176.25 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.65 -41.72 82.05 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 177.238 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -81.76 -21.59 37.73 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -176.678 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -85.84 -44.31 12.55 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.024 0.829 . . . . 0.0 111.567 171.204 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.74 -39.93 88.13 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 122.762 0.425 . . . . 0.0 111.042 175.564 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.15 -18.96 58.75 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.686 1.612 . . . . 0.0 115.638 -176.698 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.6 -2.23 25.38 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 169.877 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 17.6 tp 106.17 2.26 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 130.596 3.559 . . . . 0.0 114.476 167.542 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . 0.306 2.9 t 80.58 40.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 125.939 1.696 . . . . 0.0 110.068 -177.871 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 86.81 -26.41 0.09 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.367 -0.833 . . . . 0.0 113.049 127.046 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 13.7 p -68.58 31.1 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.918 1 C-N-CA 131.787 4.035 . . . . 0.0 113.595 175.955 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 31.1 m 47.08 25.62 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 127.334 2.254 . . . . 0.0 115.84 -177.107 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt 97.74 98.78 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 130.502 3.521 . . . . 0.0 110.506 -179.348 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.651 0 O-C-N 121.872 -0.517 . . . . 0.0 110.691 169.567 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 pp . . . . . 0 N--CA 1.468 0.436 0 CA-C-O 120.658 0.266 . . . . 0.0 111.588 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.29 -11.2 60.61 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.167 0.987 . . . . 0.0 113.27 -179.176 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.0 mmp_? -108.5 -25.62 10.84 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.731 -1.231 . . . . 0.0 113.354 171.215 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -53.82 -45.78 70.95 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.408 1.083 . . . . 0.0 109.464 169.267 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.03 -36.6 93.24 Favored Glycine 0 CA--C 1.535 1.287 0 CA-C-O 119.349 -0.695 . . . . 0.0 113.365 175.148 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -45.65 92.09 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 118.975 1.388 . . . . 0.0 110.311 177.602 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.46 98.09 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.565 1.146 . . . . 0.0 111.94 176.756 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.6 mt -78.61 -15.11 58.91 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 117.918 -1.039 . . . . 0.0 113.271 177.612 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.86 -26.8 25.46 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 169.74 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -47.83 143.37 6.24 Favored Pre-proline 0 CA--C 1.543 0.689 0 C-N-CA 126.069 1.747 . . . . 0.0 113.571 -173.865 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -61.15 -74.62 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.607 1 C-N-CA 125.604 4.202 . . . . 0.0 111.956 -169.762 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 46.7 m -59.1 -37.94 78.35 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 121.834 -0.541 . . . . 0.0 110.429 172.092 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.55 -32.38 68.04 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -169.019 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.7 t -64.88 -46.89 79.89 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 121.369 1.895 . . . . 0.0 108.273 167.28 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 32.9 ttm-85 -62.55 -15.83 52.87 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.157 1.383 . . . . 0.0 114.661 175.28 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.3 mt -71.71 -55.93 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 CA-C-N 121.46 1.937 . . . . 0.0 108.886 167.571 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.02 -33.24 70.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 117.889 -1.053 . . . . 0.0 113.685 -172.269 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.4 m -60.48 -27.25 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 CA-C-N 119.658 1.117 . . . . 0.0 112.072 173.974 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -104.17 8.05 36.24 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.616 1.966 . . . . 0.0 112.398 -179.038 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.465 HD22 ' HA ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -104.94 -22.12 13.19 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.016 1.726 . . . . 0.0 113.061 172.013 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.14 -59.14 5.75 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.411 1.885 . . . . 0.0 107.007 166.298 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -96.77 35.52 1.52 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 128.213 2.605 . . . . 0.0 112.202 173.716 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -110.61 -98.89 2.51 Favored Glycine 0 N--CA 1.472 1.049 0 O-C-N 120.889 -1.132 . . . . 0.0 113.721 -172.152 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.4 m 43.35 14.67 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 N-CA-C 120.268 3.433 . . . . 0.0 120.268 173.07 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 72.6 m -80.7 -89.88 0.06 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.347 0.976 . . . . 0.0 111.058 175.699 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.461 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 0.5 OUTLIER -133.02 158.14 76.6 Favored Pre-proline 0 CA--C 1.55 0.977 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -168.077 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -59.57 131.22 39.15 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.438 2.759 . . . . 0.0 110.717 177.867 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.09 -2.47 18.6 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-O 117.783 -1.565 . . . . 0.0 115.079 -179.072 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.461 ' HG2' ' H ' ' A' ' 36' ' ' TYR . 2.6 pp0? -60.21 -30.32 69.3 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 120.468 2.134 . . . . 0.0 111.71 -178.637 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 mt -46.87 -26.95 1.08 Allowed 'General case' 0 C--O 1.219 -0.535 0 C-N-CA 126.141 1.777 . . . . 0.0 112.992 174.555 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.74 -39.71 71.53 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 175.096 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.68 -42.77 57.83 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.139 0.881 . . . . 0.0 111.467 172.361 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -31.2 70.38 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 125.689 1.596 . . . . 0.0 113.698 -178.502 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 25.7 mt -103.18 -13.98 16.56 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.814 2.046 . . . . 0.0 113.521 178.854 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.33 3.92 67.35 Favored Glycine 0 CA--C 1.538 1.512 0 C-N-CA 125.164 1.364 . . . . 0.0 114.569 -171.084 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.5 mt -93.04 169.06 10.71 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.758 1.223 . . . . 0.0 112.142 -171.258 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.491 HG23 ' H ' ' A' ' 50' ' ' ASN . 1.3 t -70.65 141.72 51.65 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 120.915 -1.116 . . . . 0.0 110.857 169.339 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -62.78 -11.67 19.3 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.06 0.944 . . . . 0.0 112.949 169.695 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 41.0 t -71.0 -58.44 3.57 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.555 1.142 . . . . 0.0 111.157 167.811 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.491 ' H ' HG23 ' A' ' 47' ' ' THR . 41.6 t-20 -55.08 -49.33 71.93 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.851 1.66 . . . . 0.0 110.811 173.394 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 5.0 t -60.08 -44.59 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-O 117.91 -1.043 . . . . 0.0 112.302 175.326 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 60.0 m -69.76 -35.66 75.12 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 121.335 1.88 . . . . 0.0 113.705 -179.686 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -50.54 -46.58 57.54 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.536 0.734 . . . . 0.0 110.887 172.14 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -82.2 -13.04 57.71 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 175.82 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 92.3 mt -78.78 -26.72 44.46 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 122.117 2.235 . . . . 0.0 110.906 168.637 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.0 m -45.51 -55.93 5.65 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.662 1.119 . . . . 0.0 113.08 172.917 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 1.7 t -93.2 4.64 53.66 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 179.388 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.7 tp -83.72 -40.68 18.56 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.871 -1.143 . . . . 0.0 108.657 167.159 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.2 mtm105 -76.86 -28.76 55.56 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.618 1.567 . . . . 0.0 110.585 173.552 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.71 -64.25 3.55 Favored Glycine 0 C--N 1.345 1.05 0 C-N-CA 125.431 1.491 . . . . 0.0 110.909 174.744 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 49.5 m -65.89 5.72 0.45 Allowed 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 125.7 1.6 . . . . 0.0 114.6 176.202 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.62 -2.4 31.59 Favored Glycine 0 N--CA 1.471 0.974 0 C-N-CA 126.03 1.776 . . . . 0.0 114.973 176.031 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 72.1 mt -59.85 -25.67 65.22 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.718 1.259 . . . . 0.0 113.51 -175.689 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.7 m -123.83 140.77 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.755 1.622 . . . . 0.0 111.815 169.002 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 51.6 t -118.61 138.64 48.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 127.18 2.192 . . . . 0.0 110.025 -175.988 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.49 143.05 40.7 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.605 1.162 . . . . 0.0 111.254 172.574 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.8 m -164.72 150.04 9.89 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 120.256 -1.528 . . . . 0.0 109.644 -176.788 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -84.16 126.34 33.02 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.166 1.348 . . . . 0.0 110.061 165.557 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.282 0.0 OUTLIER -74.34 -41.47 61.03 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.477 0.581 . . . . 0.0 111.844 174.817 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 162.08 -30.36 0.3 Allowed Glycine 0 CA--C 1.531 1.073 0 C-N-CA 125.476 1.512 . . . . 0.0 114.116 169.724 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -112.58 -17.82 12.53 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 127.055 2.142 . . . . 0.0 112.61 172.116 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -151.21 164.27 36.95 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.81 2.444 . . . . 0.0 110.415 -171.913 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 4.2 p -82.55 152.89 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 123.559 0.743 . . . . 0.0 110.51 168.833 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.2 ptt180 -136.96 162.34 33.54 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 126.316 1.846 . . . . 0.0 111.3 -172.755 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -116.68 123.46 47.3 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.142 0.977 . . . . 0.0 108.466 166.463 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -125.3 149.11 48.38 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 117.011 -1.471 . . . . 0.0 110.989 -178.531 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.7 mp -61.0 151.28 31.03 Favored 'General case' 0 C--N 1.348 0.508 0 C-N-CA 118.697 -1.201 . . . . 0.0 108.562 170.291 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.04 -28.78 69.31 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 114.534 -1.212 . . . . 0.0 113.924 -168.912 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -171.7 161.66 6.09 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.644 2.378 . . . . 0.0 111.169 169.604 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.1 m -34.99 -32.73 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 131.024 3.729 . . . . 0.0 113.434 165.505 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -59.8 -56.0 27.3 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.895 1.678 . . . . 0.0 111.078 175.471 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -39.49 89.99 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 120.462 1.483 . . . . 0.0 110.977 176.827 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.7 -37.49 73.58 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-O 119.023 -0.513 . . . . 0.0 112.299 176.779 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -67.17 -45.79 75.96 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 119.433 1.015 . . . . 0.0 113.173 176.929 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.82 -42.94 80.74 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.44 1.018 . . . . 0.0 110.423 -177.229 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -61.83 -28.64 69.63 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 170.854 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.6 -30.18 76.86 Favored Glycine 0 CA--C 1.538 1.528 0 O-C-N 121.0 -1.062 . . . . 0.0 113.917 169.585 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -101.43 22.62 12.3 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 119.089 1.445 . . . . 0.0 111.698 166.551 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 19.4 tp 63.9 -40.88 0.23 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 131.005 3.722 . . . . 0.0 114.254 -171.694 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -170.8 -61.84 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 128.975 2.91 . . . . 0.0 108.481 -172.431 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 174.06 -35.06 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 126.347 1.859 . . . . 0.0 111.126 -173.371 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.1 p -73.48 26.33 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -171.39 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 62.87 25.27 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 125.107 1.363 . . . . 0.0 111.985 172.811 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.5 mp 90.95 95.44 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 131.573 3.949 . . . . 0.0 112.457 175.573 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.93 152.93 44.77 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 166.278 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.407 HG12 ' H ' ' A' ' 98' ' ' THR . 3.4 t -79.33 139.29 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.612 1.565 . . . . 0.0 112.504 -167.718 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -71.29 4.2 3.07 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 125.48 1.512 . . . . 0.0 114.514 174.55 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.407 ' H ' HG12 ' A' ' 96' ' ' VAL . 26.0 p -72.14 111.62 7.52 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 120.88 -1.138 . . . . 0.0 108.218 168.872 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -76.16 113.11 13.33 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 174.35 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -129.97 154.61 81.22 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-O 117.606 -1.188 . . . . 0.0 107.817 179.773 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -67.37 -18.93 49.99 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.505 2.137 . . . . 0.0 114.19 179.365 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . 0.394 1.8 t . . . . . 0 CA--C 1.545 0.773 1 C-N-CA 134.117 4.967 . . . . 0.0 112.373 167.221 . . . . . . . . 2 1 . 1 . 029 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 pp . . . . . 0 N--CA 1.47 0.543 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.97 -14.29 62.64 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.213 1.005 . . . . 0.0 112.975 175.905 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 15.7 mmp_? -93.14 -33.56 13.99 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 120.764 -1.21 . . . . 0.0 112.22 169.473 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -57.3 -55.44 34.79 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.527 1.058 . . . . 0.0 109.317 169.725 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.56 -33.83 88.27 Favored Glycine 0 CA--C 1.53 0.996 0 CA-C-N 118.715 0.689 . . . . 0.0 112.311 -178.447 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -46.99 87.53 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 118.347 1.074 . . . . 0.0 110.207 171.33 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.67 -15.83 63.17 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.42 1.488 . . . . 0.0 113.506 -178.177 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.3 mp -102.71 -12.73 17.44 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.972 0.909 . . . . 0.0 112.586 169.272 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.45 -7.93 59.65 Favored 'General case' 0 CA--C 1.554 1.134 0 N-CA-C 116.985 2.217 . . . . 0.0 116.985 174.573 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -73.0 161.72 78.04 Favored Pre-proline 0 CA--C 1.543 0.707 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -168.822 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -58.82 -70.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.868 1 C-N-CA 125.455 4.103 . . . . 0.0 111.518 168.465 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 24.6 m -75.68 -43.03 49.47 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 117.902 -1.047 . . . . 0.0 111.939 -179.506 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.426 ' HD2' HD13 ' B' ' 58' ' ' LEU . 0.3 OUTLIER -64.29 -40.27 95.61 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 121.006 1.73 . . . . 0.0 115.211 -169.643 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 14.6 t -60.85 -45.06 96.0 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 120.153 1.342 . . . . 0.0 110.351 170.867 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 33.0 ttm-85 -62.49 -23.67 67.05 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.464 1.106 . . . . 0.0 113.556 175.364 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 mt -67.99 -57.13 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 120.156 1.344 . . . . 0.0 107.837 166.928 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 61.8 mt -55.6 -41.83 73.99 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 117.715 -1.136 . . . . 0.0 112.743 -174.367 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.1 m -61.35 -30.72 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-N 119.896 1.225 . . . . 0.0 112.65 176.652 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -95.62 -3.81 45.6 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.302 1.441 . . . . 0.0 112.525 -176.291 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.418 HD22 ' HA ' ' B' ' 30' ' ' LEU . 0.1 OUTLIER -90.67 -23.01 20.88 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 175.945 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.14 -61.21 2.37 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 128.806 2.842 . . . . 0.0 110.167 170.574 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -91.66 7.83 39.71 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 126.593 1.957 . . . . 0.0 113.078 175.655 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.87 -85.9 1.17 Allowed Glycine 0 N--CA 1.47 0.909 0 C-N-CA 125.02 1.295 . . . . 0.0 114.179 -168.376 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 20.9 m 39.14 15.83 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 N-CA-C 120.95 3.685 . . . . 0.0 120.95 179.793 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 69.6 m -79.39 -91.45 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.465 1.03 . . . . 0.0 111.791 -178.12 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . 0.513 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 1.8 m-85 -137.88 161.56 59.27 Favored Pre-proline 0 CA--C 1.555 1.161 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -168.216 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -55.61 132.41 51.95 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 123.285 2.657 . . . . 0.0 110.396 174.943 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.05 -6.57 26.92 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 117.686 -1.619 . . . . 0.0 114.827 -179.341 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . 0.513 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 2.6 pp0? -56.67 -36.14 69.23 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.686 1.743 . . . . 0.0 111.292 -179.689 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 8.7 mt -50.17 -32.84 17.24 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 125.103 1.361 . . . . 0.0 112.235 176.42 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.8 -53.16 58.85 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.496 0.589 . . . . 0.0 111.334 -177.751 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.5 -39.07 88.5 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.078 0.551 . . . . 0.0 112.083 175.797 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -63.23 -27.23 69.21 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.835 1.654 . . . . 0.0 113.708 179.175 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 18.0 mt -99.15 -21.48 16.12 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 126.144 1.778 . . . . 0.0 112.818 175.385 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.7 10.84 83.73 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 124.957 1.265 . . . . 0.0 113.737 -170.411 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 69.6 mt -105.87 168.87 8.83 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.381 1.473 . . . . 0.0 112.53 -170.727 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.53 HG23 ' H ' ' B' ' 50' ' ' ASN . 3.3 t -71.96 138.34 47.97 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 120.798 -1.188 . . . . 0.0 111.748 170.276 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 23.2 ptt180 -59.72 -17.39 34.35 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.165 1.386 . . . . 0.0 112.587 169.628 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 39.2 t -66.79 -58.13 5.66 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 119.91 1.232 . . . . 0.0 112.142 168.882 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . 0.53 ' H ' HG23 ' B' ' 47' ' ' THR . 35.0 t-20 -56.84 -51.71 67.95 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.501 1.521 . . . . 0.0 110.548 173.285 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 94.0 t -62.01 -37.65 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-O 118.305 -0.855 . . . . 0.0 112.02 -178.647 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 24.5 m -74.91 -35.49 62.22 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 120.89 1.677 . . . . 0.0 113.857 175.648 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -50.88 -45.28 59.95 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.127 0.876 . . . . 0.0 111.64 170.628 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -75.64 -19.82 58.92 Favored 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 174.673 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 28.5 mt -80.02 -20.68 44.79 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.501 1.5 . . . . 0.0 113.192 171.586 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 43.4 m -44.09 -55.86 4.44 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 120.161 1.346 . . . . 0.0 112.323 172.416 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.8 t -93.44 -10.79 33.88 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 179.28 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . 0.426 HD13 ' HD2' ' B' ' 23' ' ' ARG . 6.4 tp -69.34 -34.62 74.9 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.446 -1.408 . . . . 0.0 109.621 168.645 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.4 ' HG2' HG23 ' B' ' 64' ' ' VAL . 74.7 mtm180 -80.77 -22.26 40.3 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.798 1.239 . . . . 0.0 112.683 169.72 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -69.79 -65.44 2.56 Favored Glycine 0 N--CA 1.472 1.092 0 C-N-CA 125.21 1.386 . . . . 0.0 111.571 175.7 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 56.3 m -67.23 5.12 0.77 Allowed 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 125.796 1.639 . . . . 0.0 114.338 175.23 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.07 6.53 79.64 Favored Glycine 0 C--N 1.343 0.961 0 O-C-N 120.85 -1.157 . . . . 0.0 114.188 172.57 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.404 HD12 HD12 ' B' ' 58' ' ' LEU . 98.4 mt -62.12 -31.41 71.86 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.748 1.219 . . . . 0.0 112.929 179.605 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.4 HG23 ' HG2' ' B' ' 59' ' ' ARG . 1.6 m -125.18 136.02 62.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 126.214 1.805 . . . . 0.0 112.333 170.99 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 47.3 t -119.11 137.98 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 127.357 2.263 . . . . 0.0 111.35 -171.242 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.22 142.75 34.36 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.831 1.252 . . . . 0.0 112.613 173.463 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.9 m -167.4 142.49 3.93 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 117.034 -1.46 . . . . 0.0 111.768 -173.993 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -74.72 121.03 21.07 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 121.31 1.868 . . . . 0.0 109.276 165.658 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.305 0.0 OUTLIER -68.24 -55.72 11.22 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 118.234 -0.888 . . . . 0.0 109.858 175.185 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -173.55 -32.7 0.03 OUTLIER Glycine 0 CA--C 1.535 1.287 0 C-N-CA 125.769 1.652 . . . . 0.0 113.984 169.171 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 29.2 tpt180 -114.0 -19.45 11.41 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.601 2.36 . . . . 0.0 113.413 176.729 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -149.55 164.9 33.8 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 128.468 2.707 . . . . 0.0 109.926 -170.821 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 4.2 p -79.32 147.15 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 121.22 -0.925 . . . . 0.0 109.845 168.672 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -128.68 160.96 30.83 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 127.043 2.137 . . . . 0.0 110.674 -176.18 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -111.39 121.4 45.13 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 106.873 -1.529 . . . . 0.0 106.873 167.069 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -123.42 154.65 38.75 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 117.156 -1.402 . . . . 0.0 111.243 174.741 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 mp -66.87 152.8 44.94 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 117.771 -1.572 . . . . 0.0 106.886 166.602 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.8 -24.05 67.56 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -170.401 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -173.66 161.34 3.91 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.931 1.692 . . . . 0.0 112.157 171.197 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -36.92 -34.55 0.08 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 130.504 3.521 . . . . 0.0 113.523 166.251 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 22.1 t60 -62.82 -52.44 63.14 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.707 1.203 . . . . 0.0 110.425 177.854 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -41.65 93.64 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 120.471 1.487 . . . . 0.0 111.076 175.206 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.26 -35.04 69.25 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 178.104 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 3.2 ptm85 -74.21 -39.1 63.36 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 177.566 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.15 -44.41 84.22 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.452 1.024 . . . . 0.0 110.058 176.144 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -54.33 -42.27 70.01 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.248 0.619 . . . . 0.0 111.597 169.76 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -60.83 -19.84 56.3 Favored Glycine 0 CA--C 1.541 1.683 0 C-N-CA 124.858 1.218 . . . . 0.0 115.184 177.037 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . 0.253 9.7 pt-20 -121.14 25.49 9.53 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.343 1.571 . . . . 0.0 112.626 165.961 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 58.0 tp 66.54 -49.3 0.45 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 131.229 3.812 . . . . 0.0 113.058 -173.363 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 33.5 t -153.48 -51.76 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 C-N-CA 128.649 2.78 . . . . 0.0 107.87 169.502 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 175.54 -22.06 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.992 1.317 . . . . 0.0 114.452 -160.619 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 8.4 p -74.49 26.64 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 O-C-N 120.247 -1.533 . . . . 0.0 113.508 -178.283 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 61.18 28.05 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.919 0 C-N-CA 124.346 1.058 . . . . 0.0 111.319 176.137 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.8 mp 75.13 111.35 0.07 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 130.247 3.419 . . . . 0.0 113.435 -171.902 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.075 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 163.307 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.0 tp . . . . . 0 CA--C 1.542 0.666 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -49.05 -39.09 26.14 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.17 1.788 . . . . 0.0 112.354 169.888 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -14.76 56.16 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 126.109 1.764 . . . . 0.0 112.845 -176.862 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -72.01 -58.01 3.8 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.782 0.833 . . . . 0.0 108.954 167.006 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -57.65 -32.46 65.28 Favored Glycine 0 C--N 1.337 0.622 0 CA-C-O 118.681 -1.066 . . . . 0.0 112.263 -169.789 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.42 -22.26 65.54 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.044 1.422 . . . . 0.0 111.552 177.267 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -80.78 -17.14 51.87 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.324 -1.485 . . . . 0.0 113.699 172.325 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.7 mp -103.34 -18.14 14.98 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.527 0.731 . . . . 0.0 112.224 172.425 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' B' ' 12' ' ' ALA . . . -65.77 15.63 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 129.366 3.066 . . . . 0.0 116.355 177.071 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.97 145.38 30.39 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 126.554 1.942 . . . . 0.0 109.418 -177.168 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -62.48 -84.96 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.68 1 C-N-CA 126.059 4.506 . . . . 0.0 112.309 -169.298 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 85.8 m -44.45 -40.72 5.73 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 126.203 1.801 . . . . 0.0 111.282 170.857 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.8 ttp180 -74.6 -32.65 62.42 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 116.249 1.944 . . . . 0.0 116.249 -168.667 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 50.5 t -63.37 -39.79 95.49 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 120.377 1.444 . . . . 0.0 109.616 168.287 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 39.2 mtt180 -65.17 -40.1 93.83 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.429 1.092 . . . . 0.0 111.459 176.63 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 8.7 mt -47.6 -56.45 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-N 119.623 1.101 . . . . 0.0 110.981 167.541 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 74.6 mt -60.04 -44.65 94.51 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.263 -1.335 . . . . 0.0 112.695 -178.222 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -66.09 -31.38 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 120.18 1.355 . . . . 0.0 113.251 174.456 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.78 7.34 21.01 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.789 2.035 . . . . 0.0 114.433 173.611 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.553 HD22 ' HA ' ' A' ' 76' ' ' ALA . 7.1 mt -101.44 -28.91 12.31 Favored 'General case' 0 N--CA 1.435 -1.177 0 C-N-CA 126.917 2.087 . . . . 0.0 113.054 167.374 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 mt -62.41 -42.14 99.21 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 124.435 1.085 . . . . 0.0 109.169 168.588 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -124.59 86.96 2.64 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.9 2.08 . . . . 0.0 110.91 169.91 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -171.34 -86.21 0.06 OUTLIER Glycine 0 N--CA 1.474 1.216 0 C-N-CA 127.263 2.363 . . . . 0.0 113.227 174.415 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 18.5 m 37.36 38.31 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 127.485 2.314 . . . . 0.0 116.79 -179.267 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.409 ' HB2' ' HG2' ' A' ' 39' ' ' GLN . 9.4 m -83.76 -79.53 0.2 Allowed 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 126.374 1.87 . . . . 0.0 110.568 -176.729 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -147.83 145.34 20.86 Favored Pre-proline 0 N--CA 1.475 0.784 0 C-N-CA 125.696 1.598 . . . . 0.0 110.209 -172.226 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.97 -10.34 22.55 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.023 2.482 . . . . 0.0 116.676 -169.138 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.65 -2.39 40.28 Favored Glycine 0 CA--C 1.539 1.562 0 CA-C-N 119.885 1.22 . . . . 0.0 114.871 169.219 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.43 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -60.46 -29.4 69.02 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.034 1.334 . . . . 0.0 113.292 -171.959 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 29.4 mt -49.97 -28.28 6.6 Favored 'General case' 0 C--O 1.218 -0.588 0 C-N-CA 125.878 1.671 . . . . 0.0 111.808 179.602 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -75.07 -32.95 61.61 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -173.616 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.89 -36.57 28.01 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.153 0.501 . . . . 0.0 110.697 169.037 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.43 ' CD2' HE22 ' A' ' 39' ' ' GLN . 11.3 t60 -73.39 -31.59 63.98 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 -174.131 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.8 mt -96.09 -19.43 19.42 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.692 1.597 . . . . 0.0 112.676 172.66 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.07 -5.12 20.53 Favored Glycine 0 CA--C 1.536 1.386 0 CA-C-O 118.832 -0.982 . . . . 0.0 113.594 -168.471 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -73.71 133.71 43.4 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.608 1.563 . . . . 0.0 109.891 175.578 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.4 t -60.83 146.02 47.81 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.646 1.112 . . . . 0.0 111.511 -177.283 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.428 ' CD ' ' H ' ' A' ' 48' ' ' ARG . 0.0 OUTLIER -55.0 -29.72 57.94 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 -174.659 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.2 m -63.86 -48.76 75.45 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.059 0.845 . . . . 0.0 112.374 170.408 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -64.37 -46.27 84.13 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.901 1.68 . . . . 0.0 110.968 178.039 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 1.2 t -56.66 -44.57 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 124.17 0.988 . . . . 0.0 111.905 170.181 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 97.2 p -67.62 -38.38 83.83 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.725 1.148 . . . . 0.0 113.971 179.423 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -56.94 -52.19 66.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.748 1.219 . . . . 0.0 109.839 174.976 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -72.15 -27.59 62.69 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 120.825 -1.172 . . . . 0.0 113.983 177.464 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 34.6 mt -67.85 -33.13 74.17 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 121.473 1.942 . . . . 0.0 112.566 169.59 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.7 m -59.51 -34.59 72.8 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.404 0.682 . . . . 0.0 112.006 -177.939 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 34.1 t -75.87 -43.07 47.33 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.673 -0.642 . . . . 0.0 111.912 173.624 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.3 tp -71.32 -39.4 71.43 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.589 1.556 . . . . 0.0 112.848 -169.243 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -74.09 -7.86 54.05 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.605 1.162 . . . . 0.0 111.766 173.186 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -100.05 -40.39 3.08 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.749 1.642 . . . . 0.0 113.452 172.997 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.3 m -75.35 1.11 14.64 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.043 1.737 . . . . 0.0 112.688 170.661 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.24 2.92 80.78 Favored Glycine 0 N--CA 1.467 0.709 0 C-N-CA 127.42 2.438 . . . . 0.0 116.494 166.778 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 76.5 mt -71.43 -20.04 62.16 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.623 1.712 . . . . 0.0 113.893 -175.001 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.454 HG12 ' CD1' ' A' ' 30' ' ' LEU . 6.3 m -126.97 140.35 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.226 1.411 . . . . 0.0 113.791 -178.559 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.1 t -141.33 142.24 29.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.974 -170.821 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.14 148.02 23.24 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.357 1.463 . . . . 0.0 113.582 171.833 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -135.49 178.6 6.91 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.124 1.769 . . . . 0.0 106.964 167.923 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -96.11 128.79 43.34 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 166.368 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -19.43 60.06 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.25 1.02 . . . . 0.0 112.492 168.948 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 128.16 -40.95 1.65 Allowed Glycine 0 N--CA 1.471 1.002 0 C-N-CA 125.526 1.536 . . . . 0.0 112.381 172.85 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -91.94 -38.1 12.47 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.599 1.959 . . . . 0.0 110.733 171.819 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.23 -175.84 4.59 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.945 2.098 . . . . 0.0 110.693 177.793 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.6 151.42 5.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 C-N-CA 123.481 0.712 . . . . 0.0 109.838 168.013 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -120.91 -173.31 2.57 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 126.918 2.087 . . . . 0.0 108.861 167.234 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.521 ' CE2' HD21 ' A' ' 30' ' ' LEU . 0.8 OUTLIER -145.07 161.29 39.81 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.65 1.18 . . . . 0.0 108.122 -179.393 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.553 ' HA ' HD22 ' A' ' 30' ' ' LEU . . . -166.9 159.49 13.54 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 120.669 1.577 . . . . 0.0 112.887 -168.957 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -60.7 137.11 58.22 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 165.668 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.32 -23.38 66.73 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.785 1.402 . . . . 0.0 114.785 -173.8 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -159.23 161.72 36.09 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.267 1.027 . . . . 0.0 113.17 168.722 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 54.6 p -42.91 -35.33 1.17 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.572 1.949 . . . . 0.0 112.76 166.877 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -48.81 77.68 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.581 1.552 . . . . 0.0 112.764 177.661 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.7 mt -69.65 -47.24 64.03 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.75 1.159 . . . . 0.0 109.003 179.226 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.03 -16.82 3.12 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.853 1.661 . . . . 0.0 114.552 172.437 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -79.23 -67.05 0.79 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.821 1.248 . . . . 0.0 109.996 176.373 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.72 -32.49 72.72 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 178.941 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 tp -68.17 -32.61 72.98 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.766 1.627 . . . . 0.0 111.441 169.662 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.17 -36.52 9.87 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 127.273 2.368 . . . . 0.0 115.632 -172.02 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.83 -9.76 58.86 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 119.75 1.775 . . . . 0.0 112.853 169.17 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.2 tt 67.87 142.31 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 127.002 2.121 . . . . 0.0 108.031 -170.906 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 33.9 m -69.71 19.41 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 O-C-N 120.328 -1.483 . . . . 0.0 114.091 -175.107 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 47.3 mm-40 77.08 -13.88 0.9 Allowed 'General case' 0 N--CA 1.447 -0.598 0 O-C-N 120.685 -1.26 . . . . 0.0 113.707 156.519 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.2 p -68.38 35.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 126.966 2.106 . . . . 0.0 115.605 -177.105 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.3 t 69.07 4.76 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 125.941 1.696 . . . . 0.0 112.529 173.055 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.8 mp 97.34 105.49 0.01 OUTLIER 'General case' 0 C--N 1.348 0.521 0 C-N-CA 131.302 3.841 . . . . 0.0 110.259 -170.447 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.76 66.05 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 126.962 2.105 . . . . 0.0 114.459 176.462 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.1 m -52.49 138.19 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 O-C-N 121.568 -0.707 . . . . 0.0 110.412 168.563 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -59.35 -30.99 68.79 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.396 0.678 . . . . 0.0 112.44 -168.449 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.1 m 70.61 151.46 0.1 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 128.315 2.646 . . . . 0.0 111.633 178.524 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -87.36 1.34 53.6 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.859 1.664 . . . . 0.0 114.151 175.261 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.2 146.91 35.77 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 115.073 1.509 . . . . 0.0 115.073 -166.998 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -94.48 17.96 0.86 Allowed 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 124.029 3.153 . . . . 0.0 114.438 -178.325 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.5 t . . . . . 0 CA--C 1.547 0.85 0 CA-C-O 124.65 2.167 . . . . 0.0 113.893 -177.871 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.538 0.517 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.526 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 12' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' A' ' 19' ' ' ALA . . . -51.51 -45.88 63.03 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.009 0.924 . . . . 0.0 111.533 167.701 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -30.24 67.14 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.226 1.81 . . . . 0.0 111.934 175.442 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -81.39 -46.71 14.24 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.056 -1.027 . . . . 0.0 111.358 172.619 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.59 -32.3 68.82 Favored Glycine 0 C--O 1.219 -0.83 0 C-N-CA 124.493 1.044 . . . . 0.0 111.803 -178.165 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.6 -32.28 72.05 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.001 1.401 . . . . 0.0 111.171 173.739 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -80.63 -20.58 42.84 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 176.189 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.5 mp -101.78 -23.04 14.25 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 118.951 0.796 . . . . 0.0 112.761 175.198 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -83.64 37.76 0.6 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.372 1.469 . . . . 0.0 114.877 178.132 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.94 142.39 24.53 Favored Pre-proline 0 CA--C 1.55 0.947 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 168.181 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -59.0 -85.38 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.785 1 C-N-CA 125.793 4.329 . . . . 0.0 112.676 -167.482 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 58.9 m -49.58 -33.93 16.38 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 126.357 1.863 . . . . 0.0 112.507 170.09 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 23' ' ' ARG . . . . . 0.509 ' HG2' HD13 ' B' ' 58' ' ' LEU . 18.2 ttp180 -72.08 -38.87 69.33 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -170.824 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 37.1 t -56.93 -39.95 75.46 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.249 0.931 . . . . 0.0 110.369 168.709 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 16.1 mtt-85 -64.59 -38.92 92.65 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-O 118.485 -0.769 . . . . 0.0 113.061 175.161 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 26' ' ' ILE . . . . . 0.416 HG13 ' HA ' ' B' ' 23' ' ' ARG . 3.0 mt -52.09 -49.61 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 CA-C-N 120.069 1.304 . . . . 0.0 111.835 169.426 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 92.6 mt -65.4 -47.12 77.4 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.939 -178.242 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.24 -33.85 65.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 118.911 0.778 . . . . 0.0 112.562 178.099 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.1 -9.25 59.07 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.84 1.256 . . . . 0.0 113.419 174.265 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.557 HD21 ' CD2' ' B' ' 75' ' ' TYR . 5.6 mt -82.9 -37.96 23.52 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 117.361 -1.304 . . . . 0.0 112.353 167.079 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.2 mt -55.82 -46.22 78.14 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 125.195 1.56 . . . . 0.0 110.754 175.498 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -107.03 46.41 0.93 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 129.037 2.935 . . . . 0.0 110.453 177.762 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -150.9 -84.29 0.05 OUTLIER Glycine 0 N--CA 1.47 0.952 0 N-CA-C 116.996 1.559 . . . . 0.0 116.996 -176.261 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 34.9 m 49.57 -12.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 C-N-CA 129.175 2.99 . . . . 0.0 118.849 -168.348 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 51.9 m -37.01 -82.23 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 127.016 2.126 . . . . 0.0 116.368 -167.368 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 36' ' ' TYR . . . . . 0.459 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 7.3 m-85 -149.64 143.88 17.23 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 126.364 1.865 . . . . 0.0 109.809 -174.656 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -65.7 -7.18 15.69 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 124.07 3.18 . . . . 0.0 116.88 -168.686 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.9 -14.3 21.42 Favored Glycine 0 CA--C 1.536 1.366 0 CA-C-N 120.078 1.308 . . . . 0.0 115.161 171.053 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . 0.459 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 0.9 OUTLIER -69.92 -19.85 63.38 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.146 1.535 . . . . 0.0 115.146 -169.072 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 20.7 mt -44.51 -32.28 1.36 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.019 1.328 . . . . 0.0 112.333 175.928 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.16 -40.41 77.2 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -178.078 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.72 -43.38 37.68 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.141 0.496 . . . . 0.0 110.92 174.747 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -64.78 -24.09 67.45 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.79 1.236 . . . . 0.0 113.792 -177.011 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 20.4 mt -109.39 -18.12 13.63 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.224 1.809 . . . . 0.0 113.799 179.043 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.48 -9.59 54.35 Favored Glycine 0 CA--C 1.536 1.346 0 CA-C-O 118.383 -1.232 . . . . 0.0 114.487 -169.941 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.04 131.94 45.11 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.889 2.076 . . . . 0.0 111.786 177.541 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 6.1 t -59.81 140.49 56.53 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 119.985 -1.697 . . . . 0.0 109.242 168.935 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 48' ' ' ARG . . . . . 0.44 ' HD3' ' H ' ' B' ' 48' ' ' ARG . 0.0 OUTLIER -59.58 -21.0 59.7 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -174.497 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 5.7 m -64.44 -48.55 74.9 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.946 1.248 . . . . 0.0 111.272 169.488 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -70.46 -38.9 74.53 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.538 -0.726 . . . . 0.0 111.23 176.248 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -62.15 -35.87 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 O-C-N 120.877 -1.139 . . . . 0.0 111.978 172.352 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 96.2 p -67.91 -30.22 69.49 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 120.038 1.29 . . . . 0.0 114.404 175.661 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 55.5 t-20 -60.3 -59.87 4.72 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.678 0.791 . . . . 0.0 110.589 178.94 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -67.94 -19.37 64.97 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 176.511 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 40.0 mt -73.78 -29.24 62.08 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 121.377 1.899 . . . . 0.0 112.493 169.493 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 45.4 m -61.88 -29.18 70.02 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.429 0.559 . . . . 0.0 111.807 175.942 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.4 t -80.37 -50.72 9.76 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 118.881 0.764 . . . . 0.0 111.388 169.163 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 58' ' ' LEU . . . . . 0.509 HD13 ' HG2' ' B' ' 23' ' ' ARG . 6.7 tp -58.12 -41.05 82.8 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.099 0.96 . . . . 0.0 113.016 -172.642 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.498 ' HG2' HG23 ' B' ' 64' ' ' VAL . 82.8 mtt180 -82.34 -6.42 59.25 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.545 1.538 . . . . 0.0 113.167 179.353 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -97.74 -43.96 2.78 Favored Glycine 0 N--CA 1.472 1.04 0 C-N-CA 124.758 1.171 . . . . 0.0 111.666 172.086 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 80.8 m -75.87 9.03 2.6 Favored 'General case' 0 CA--C 1.557 1.212 0 C-N-CA 127.463 2.305 . . . . 0.0 113.849 177.329 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.19 11.34 81.9 Favored Glycine 0 N--CA 1.471 1.022 0 C-N-CA 128.242 2.829 . . . . 0.0 117.216 167.493 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 95.5 mt -80.82 -21.88 40.47 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 118.799 1.3 . . . . 0.0 114.105 -173.846 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.498 HG23 ' HG2' ' B' ' 59' ' ' ARG . 5.2 m -137.63 149.51 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 125.303 1.441 . . . . 0.0 113.915 -174.601 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 77.3 t -145.01 147.17 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -176.996 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.72 147.98 28.96 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 127.737 2.415 . . . . 0.0 112.065 169.8 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -136.78 170.61 15.8 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.379 1.872 . . . . 0.0 107.395 175.658 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 68' ' ' TYR . . . . . 0.416 ' HA ' ' HA ' ' B' ' 73' ' ' VAL . 0.4 OUTLIER -81.41 133.0 35.35 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 162.929 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.52 -9.1 58.64 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 119.279 0.945 . . . . 0.0 112.842 167.985 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 126.29 -15.55 6.81 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 126.224 1.869 . . . . 0.0 113.754 173.452 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.48 -40.57 0.51 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.042 2.137 . . . . 0.0 110.616 -172.887 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -127.64 177.45 6.78 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 128.468 2.707 . . . . 0.0 108.063 167.738 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 73' ' ' VAL . . . . . 0.416 ' HA ' ' HA ' ' B' ' 68' ' ' TYR . 2.3 m -86.48 143.55 11.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 123.152 0.581 . . . . 0.0 109.609 165.731 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 12.3 ptt180 -106.17 -176.44 3.08 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 127.127 2.171 . . . . 0.0 108.64 172.202 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.557 ' CD2' HD21 ' B' ' 30' ' ' LEU 0.254 0.2 OUTLIER -143.76 171.54 14.07 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 124.709 1.204 . . . . 0.0 109.696 171.618 . . . . . . . . 4 4 . 1 . 030 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . 0.513 ' HA ' HD22 ' B' ' 30' ' ' LEU . . . -174.27 159.36 3.12 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.622 1.569 . . . . 0.0 111.687 -169.38 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -60.51 142.22 55.54 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 164.864 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.43 -23.26 65.7 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -174.841 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -157.56 159.36 37.04 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 168.366 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 56.6 p -44.25 -34.93 2.06 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 113.683 -1.598 . . . . 0.0 112.002 165.295 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.93 -45.65 93.85 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.582 1.553 . . . . 0.0 111.915 -179.489 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 9.0 mt -69.06 -45.64 69.88 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.447 1.021 . . . . 0.0 109.53 174.684 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.63 -20.73 50.22 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.965 1.306 . . . . 0.0 113.797 178.008 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -75.11 -66.52 0.75 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.591 1.556 . . . . 0.0 110.404 177.518 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.33 -36.26 79.65 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.022 0.828 . . . . 0.0 113.208 178.632 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 49.8 tp -61.89 -38.07 86.97 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.724 1.21 . . . . 0.0 111.13 169.494 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -78.97 -42.69 11.98 Favored Glycine 0 C--N 1.341 0.815 0 C-N-CA 127.509 2.481 . . . . 0.0 114.968 -171.754 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.22 -12.02 60.98 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.142 1.471 . . . . 0.0 112.484 168.843 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 89' ' ' LEU . . . . . 0.416 HD23 ' H ' ' B' ' 91' ' ' GLN . 9.7 tt 72.22 142.41 0.06 Allowed 'General case' 0 C--N 1.342 0.279 0 C-N-CA 127.554 2.341 . . . . 0.0 108.849 175.539 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 33.7 m -60.4 12.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 116.819 2.155 . . . . 0.0 116.819 -173.489 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 91' ' ' GLN . . . . . 0.416 ' H ' HD23 ' B' ' 89' ' ' LEU . 26.0 mm-40 78.43 -18.79 0.48 Allowed 'General case' 0 CA--C 1.535 0.367 0 O-C-N 120.347 -1.47 . . . . 0.0 114.281 155.865 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 2.8 p -66.8 32.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 126.795 2.038 . . . . 0.0 115.132 177.517 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 61.77 10.95 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 C-N-CA 125.645 1.578 . . . . 0.0 113.509 -179.686 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 10.1 mp 86.04 115.67 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 131.35 3.86 . . . . 0.0 109.709 -168.58 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.785 0 CA-C-O 121.475 0.655 . . . . 0.0 110.688 167.172 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.44 -6.39 55.17 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -175.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.502 HH11 ' HB2' ' B' ' 102' ' ' CYS . 5.6 mmp_? -90.47 -50.57 5.87 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.704 1.202 . . . . 0.0 108.96 167.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -44.01 -71.86 0.07 Allowed 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 127.87 2.468 . . . . 0.0 109.981 177.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -83.09 -8.19 85.95 Favored Glycine 0 CA--C 1.526 0.744 0 C-N-CA 119.112 -1.518 . . . . 0.0 115.259 -168.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.36 -45.66 53.68 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.482 1.641 . . . . 0.0 108.245 168.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -75.24 -23.4 57.52 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 118.084 -0.96 . . . . 0.0 112.804 174.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 18' ' ' LEU . 4.8 tp -80.71 -34.89 34.21 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.508 1.049 . . . . 0.0 112.249 179.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -104.7 71.3 0.97 Allowed 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 122.256 1.027 . . . . 0.0 110.463 169.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.488 ' CG ' ' HE ' ' A' ' 23' ' ' ARG . 4.0 t70 -132.59 143.17 47.6 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.93 1.292 . . . . 0.0 110.284 171.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -41.06 -68.21 0.1 Allowed 'Trans proline' 0 C--N 1.356 0.969 1 C-N-CA 127.012 5.141 . . . . 0.0 113.75 -173.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -82.23 -32.86 29.53 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 116.896 -1.525 . . . . 0.0 110.801 -175.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.488 ' HE ' ' CG ' ' A' ' 20' ' ' ASP . 16.7 mtm180 -67.72 -41.48 83.46 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 116.256 -1.831 . . . . 0.0 113.893 -177.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 38.7 t -55.52 -42.72 74.92 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 121.658 2.026 . . . . 0.0 110.545 170.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.89 -45.18 94.87 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.156 0.982 . . . . 0.0 113.184 175.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.6 mt -53.69 -56.55 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 124.395 1.078 . . . . 0.0 110.366 171.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 90.1 mt -61.66 -40.76 96.07 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.835 0.854 . . . . 0.0 111.713 -169.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.6 p -73.99 -30.3 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 175.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.21 -23.89 47.29 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.053 0.941 . . . . 0.0 113.522 174.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.438 ' O ' HG13 ' A' ' 34' ' ' VAL . 4.4 tp -63.35 -44.26 95.34 Favored 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 121.09 -1.006 . . . . 0.0 110.987 173.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -47.86 -49.06 30.64 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 128.396 2.678 . . . . 0.0 112.226 177.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -93.6 14.6 18.42 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 127.444 2.298 . . . . 0.0 112.619 -179.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -134.95 -85.82 0.22 Allowed Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.568 1.556 . . . . 0.0 114.442 -175.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.556 HG12 ' HA ' ' A' ' 76' ' ' ALA . 27.8 m 41.38 30.28 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 126.771 2.029 . . . . 0.0 115.388 -168.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 2.3 m -80.39 -86.53 0.08 Allowed 'General case' 0 C--O 1.224 -0.266 0 O-C-N 121.822 -0.549 . . . . 0.0 110.654 -178.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -135.43 161.97 60.09 Favored Pre-proline 0 CA--C 1.538 0.5 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -169.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -54.07 124.15 15.24 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.377 2.718 . . . . 0.0 110.476 174.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.37 3.3 88.58 Favored Glycine 0 CA--C 1.528 0.882 0 CA-C-O 117.25 -1.861 . . . . 0.0 114.815 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.49 -30.58 70.7 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 121.012 2.406 . . . . 0.0 111.276 169.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.5 mt -53.7 -20.13 5.02 Favored 'General case' 0 C--O 1.223 -0.295 0 C-N-CA 124.984 1.314 . . . . 0.0 112.674 172.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.29 -34.78 75.77 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.825 0.739 . . . . 0.0 111.319 176.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.43 -45.64 53.26 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.065 0.546 . . . . 0.0 111.159 175.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -60.17 -32.41 71.04 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 177.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 35.7 mt -103.3 -20.16 14.21 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -174.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.71 7.07 68.55 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.027 0.823 . . . . 0.0 113.905 -169.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.6 mt -108.69 150.48 27.5 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.945 1.298 . . . . 0.0 110.959 -174.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.0 p -60.87 145.74 49.03 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.315 0.578 . . . . 0.0 111.667 -169.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 40.5 ptt180 -59.54 -32.88 70.73 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 -177.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.4 m -64.6 -54.82 26.01 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.553 0.741 . . . . 0.0 111.29 169.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 55.9 t-20 -55.75 -54.1 48.58 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.794 1.238 . . . . 0.0 111.177 -178.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 97.4 t -58.38 -40.11 76.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 O-C-N 121.457 -0.777 . . . . 0.0 111.8 176.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 47.2 m -71.4 -28.65 64.16 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 114.217 1.191 . . . . 0.0 114.217 -177.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -49.27 -46.91 46.93 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.004 1.322 . . . . 0.0 111.59 173.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 3.9 m80 -65.28 -27.05 68.36 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 60.3 mt -67.52 -31.03 70.86 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 118.833 0.742 . . . . 0.0 111.118 176.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 68.7 m -62.94 -8.07 6.45 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 174.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.434 ' CB ' HH11 ' A' ' 23' ' ' ARG . 43.2 t -99.16 -46.76 5.45 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 118.942 0.792 . . . . 0.0 111.514 164.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.4 tp -58.26 -36.08 72.71 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.178 2.591 . . . . 0.0 113.515 -168.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 80.2 mtm-85 -68.18 -41.71 81.04 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.626 0.771 . . . . 0.0 110.867 175.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -73.19 -36.66 55.89 Favored Glycine 0 N--CA 1.472 1.05 0 C-N-CA 124.094 0.854 . . . . 0.0 111.498 -177.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 27.4 m -67.26 -2.89 6.58 Favored 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 125.889 1.676 . . . . 0.0 113.398 168.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.22 -4.92 65.02 Favored Glycine 0 N--CA 1.47 0.929 0 C-N-CA 127.06 2.267 . . . . 0.0 114.829 174.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 73.5 mt -73.88 -20.71 60.33 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -169.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.6 m -134.21 144.99 33.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 C-N-CA 125.194 1.398 . . . . 0.0 111.941 177.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.4 t -127.23 138.43 54.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 125.161 1.384 . . . . 0.0 109.72 176.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.51 136.08 33.29 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.822 0.849 . . . . 0.0 111.003 173.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.98 179.79 5.38 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 126.938 2.095 . . . . 0.0 108.133 -175.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -119.26 147.83 43.82 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.945 1.698 . . . . 0.0 108.371 165.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.27 1.3 pp20? -119.66 -148.93 0.42 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.694 1.198 . . . . 0.0 111.578 176.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -70.38 -18.36 75.16 Favored Glycine 0 CA--C 1.535 1.341 0 CA-C-N 121.52 1.964 . . . . 0.0 115.251 -175.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 11.5 mmt180 -148.68 -17.82 0.32 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.538 1.681 . . . . 0.0 115.538 -177.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.55 -179.83 7.15 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 122.221 2.282 . . . . 0.0 112.335 -178.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 29.7 m -84.31 149.17 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.403 1.081 . . . . 0.0 111.253 172.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 5.1 ptt180 -126.67 170.93 11.6 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.782 1.233 . . . . 0.0 110.299 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -127.3 125.28 40.57 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.743 1.217 . . . . 0.0 109.611 169.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.556 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -128.73 153.81 46.99 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 125.547 1.539 . . . . 0.0 111.638 -177.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 82.8 mt -58.4 151.69 19.38 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 122.83 0.452 . . . . 0.0 109.858 170.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -49.03 -41.87 36.32 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.006 1.322 . . . . 0.0 114.031 -172.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -170.57 166.43 8.22 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 127.412 2.285 . . . . 0.0 109.135 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.1 m -36.24 -37.98 0.13 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 129.687 3.195 . . . . 0.0 112.297 165.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -44.19 -60.1 2.05 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 127.343 2.257 . . . . 0.0 113.394 171.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 13.4 mt -76.51 -34.98 58.58 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 119.255 0.934 . . . . 0.0 110.607 -177.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.17 -32.38 72.12 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 118.826 0.739 . . . . 0.0 112.733 176.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -77.47 -59.54 2.74 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.0 0.92 . . . . 0.0 110.941 176.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.85 -34.56 76.19 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tt -66.51 -46.44 76.23 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.238 -0.914 . . . . 0.0 108.858 168.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.02 -11.0 69.53 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 127.165 2.317 . . . . 0.0 117.078 -176.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -71.08 -40.03 71.81 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-N 121.728 2.764 . . . . 0.0 108.079 165.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 46.4 tp 90.91 112.62 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 131.628 3.971 . . . . 0.0 106.827 -167.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.5 m -39.31 -3.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 130.404 3.482 . . . . 0.0 117.925 169.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 78.57 -28.79 0.15 Allowed 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 128.696 2.798 . . . . 0.0 112.814 164.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 8.0 p -59.18 35.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 C-N-CA 129.484 3.114 . . . . 0.0 115.697 173.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.0 t 73.84 5.06 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.891 0 C-N-CA 128.436 2.694 . . . . 0.0 112.025 169.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 85.1 104.52 0.05 OUTLIER 'General case' 0 C--N 1.346 0.439 0 C-N-CA 130.578 3.551 . . . . 0.0 106.226 -169.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.99 122.37 14.14 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.644 -0.66 . . . . 0.0 110.947 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.4 t -129.86 157.5 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 126.699 2.0 . . . . 0.0 106.688 168.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -54.52 123.6 13.58 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.724 0.809 . . . . 0.0 110.455 168.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -151.11 145.26 25.34 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 125.601 1.56 . . . . 0.0 108.728 -169.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 28.5 t0 -85.91 67.2 9.94 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.303 1.441 . . . . 0.0 110.529 -171.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -120.8 136.69 25.67 Favored Pre-proline 0 CA--C 1.551 1.012 0 O-C-N 121.195 -0.94 . . . . 0.0 111.171 176.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -85.63 -166.59 0.34 Allowed 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 124.755 3.637 . . . . 0.0 114.877 -166.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 8.6 t -126.68 -176.79 3.79 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 126.32 1.848 . . . . 0.0 112.307 173.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 13.6 t 69.42 127.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 128.814 2.846 . . . . 0.0 112.374 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.22 147.28 53.56 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.075 1.35 . . . . 0.0 112.67 176.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 59.43 19.76 8.1 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 124.263 1.025 . . . . 0.0 113.66 177.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.471 0.596 0 C-N-CA 125.47 1.508 . . . . 0.0 112.325 -169.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.423 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.0 tt -44.69 -52.25 8.46 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 125.612 1.565 . . . . 0.0 113.006 -176.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.14 1.5 18.06 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.219 1.562 . . . . 0.0 115.219 -177.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -107.08 -54.02 2.53 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 126.795 2.038 . . . . 0.0 110.138 168.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -43.3 -56.67 3.39 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 127.513 2.325 . . . . 0.0 110.41 174.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.66 -35.08 62.58 Favored Glycine 0 C--N 1.339 0.706 0 C-N-CA 120.357 -0.925 . . . . 0.0 113.64 -172.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.31 -38.01 71.75 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.363 1.082 . . . . 0.0 109.912 -179.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -76.51 -32.53 58.35 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 117.192 -1.385 . . . . 0.0 113.221 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.8 mp -81.14 -37.07 29.43 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 120.886 1.676 . . . . 0.0 112.435 178.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -90.95 70.55 6.42 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.532 1.06 . . . . 0.0 111.858 173.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -146.06 141.29 16.41 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 125.702 1.601 . . . . 0.0 110.49 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -45.43 -62.56 0.43 Allowed 'Trans proline' 0 C--N 1.357 0.979 1 C-N-CA 126.574 4.849 . . . . 0.0 113.053 -173.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 1.2 p -84.01 -38.83 20.41 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-O 116.813 -1.565 . . . . 0.0 110.714 -175.06 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 25.1 mtm180 -67.51 -36.35 80.87 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 121.195 1.816 . . . . 0.0 114.02 -175.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 43.5 t -56.34 -47.44 78.81 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 121.073 1.761 . . . . 0.0 109.784 169.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.1 -36.31 81.34 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.054 1.341 . . . . 0.0 113.249 177.264 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 3.2 mt -60.41 -61.93 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.109 0.964 . . . . 0.0 109.565 171.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 90.8 mt -56.95 -43.58 81.69 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 124.318 1.012 . . . . 0.0 111.168 -169.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 6.3 p -69.51 -31.52 49.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 113.766 1.025 . . . . 0.0 113.766 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.34 -16.65 48.49 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.163 0.892 . . . . 0.0 113.27 175.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 3.5 tp -71.8 -37.72 70.35 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.223 -0.923 . . . . 0.0 112.288 172.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -45.8 -47.97 15.65 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.254 2.222 . . . . 0.0 111.65 170.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -100.17 22.39 11.49 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 127.23 2.212 . . . . 0.0 112.704 176.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -128.81 -95.1 0.8 Allowed Glycine 0 N--CA 1.476 1.305 0 C-N-CA 126.0 1.762 . . . . 0.0 114.67 -173.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . 0.612 HG12 ' HA ' ' B' ' 76' ' ' ALA . 32.9 m 39.16 35.39 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 128.095 2.558 . . . . 0.0 116.64 -169.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 88.9 m -82.18 -106.8 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 122.91 0.484 . . . . 0.0 111.07 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -125.54 165.57 25.88 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 -169.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -55.47 124.25 15.82 Favored 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 122.557 2.171 . . . . 0.0 110.684 177.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.15 -1.34 88.85 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 117.82 -1.545 . . . . 0.0 115.267 -175.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -26.09 64.55 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 121.054 2.427 . . . . 0.0 113.663 177.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 10.3 mt -64.94 -18.61 65.39 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 123.752 0.821 . . . . 0.0 111.735 177.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.7 -36.98 72.7 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.86 0.754 . . . . 0.0 112.188 174.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.82 -41.43 68.21 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.838 0.745 . . . . 0.0 111.234 174.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -64.26 -33.21 75.3 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 177.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 38.5 mt -104.7 -21.15 13.43 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.933 1.086 . . . . 0.0 113.933 -172.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.29 -1.48 42.16 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 124.959 1.266 . . . . 0.0 113.944 -169.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 86.8 mt -93.73 153.25 18.43 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 125.28 1.432 . . . . 0.0 110.552 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 29.9 p -63.75 150.65 44.07 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 121.214 -0.929 . . . . 0.0 111.924 -169.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 40.9 ptt180 -59.43 -24.77 63.78 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 175.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 4.4 m -68.51 -59.8 2.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.52 1.528 . . . . 0.0 110.463 168.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -48.51 -56.76 7.44 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.359 1.864 . . . . 0.0 111.363 178.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 24.5 t -67.07 -35.31 74.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 O-C-N 121.085 -1.009 . . . . 0.0 112.732 -174.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 52.8 m -68.74 -28.83 67.17 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 34.5 t-20 -51.14 -51.41 53.85 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.855 1.262 . . . . 0.0 111.222 172.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -68.07 -28.43 67.35 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.963 -1.086 . . . . 0.0 113.086 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 92.9 mt -65.04 -30.21 71.17 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.646 -0.659 . . . . 0.0 111.236 173.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 66.3 m -67.63 -7.13 24.04 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 53.3 t -95.71 -44.18 7.56 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.672 0.789 . . . . 0.0 110.544 164.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 7.7 tp -64.14 -37.83 88.85 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 127.621 2.368 . . . . 0.0 113.179 -168.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 75.9 mtm-85 -70.93 -22.43 62.24 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.13 0.572 . . . . 0.0 112.001 174.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -86.55 -37.95 8.5 Favored Glycine 0 N--CA 1.473 1.164 0 C-N-CA 124.86 1.219 . . . . 0.0 111.423 178.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 48.2 m -68.26 -4.21 13.44 Favored 'General case' 0 CA--C 1.56 1.348 0 C-N-CA 125.906 1.683 . . . . 0.0 112.032 168.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.23 -22.75 6.77 Favored Glycine 0 N--CA 1.47 0.955 0 C-N-CA 128.479 2.942 . . . . 0.0 114.868 177.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 89.8 mt -52.59 -22.16 4.68 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 129.285 3.034 . . . . 0.0 116.235 -168.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.95 138.42 54.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 125.02 1.328 . . . . 0.0 109.648 172.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 41.4 t -114.27 122.56 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 125.073 1.349 . . . . 0.0 108.812 178.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -88.41 119.29 28.71 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.609 1.164 . . . . 0.0 109.7 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.446 ' HB ' ' HG2' ' B' ' 74' ' ' ARG . 0.2 OUTLIER -123.7 -177.17 3.66 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 127.059 2.144 . . . . 0.0 109.711 -167.686 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -123.08 142.59 50.71 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.699 2.0 . . . . 0.0 108.784 166.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -113.25 -149.37 0.45 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.442 1.497 . . . . 0.0 111.813 176.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -71.21 -19.92 77.71 Favored Glycine 0 CA--C 1.535 1.342 0 O-C-N 119.801 -1.812 . . . . 0.0 114.81 -173.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 36.8 mmt180 -144.81 -18.6 0.52 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.547 1.539 . . . . 0.0 115.087 -177.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.47 -179.17 7.0 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 121.704 2.047 . . . . 0.0 113.174 -175.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 18.6 m -87.25 150.94 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 124.553 1.141 . . . . 0.0 111.345 177.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . 0.446 ' HG2' ' HB ' ' B' ' 67' ' ' THR . 15.1 ptt180 -135.85 169.75 17.08 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.995 0.918 . . . . 0.0 110.761 -174.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 40.0 m-85 -123.64 113.89 19.27 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 168.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.612 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -109.29 156.06 20.41 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.727 1.211 . . . . 0.0 111.161 177.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 82.8 mt -59.17 150.02 26.56 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.754 0.707 . . . . 0.0 109.499 169.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -51.57 -35.55 41.64 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.393 1.077 . . . . 0.0 113.818 -171.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -173.31 168.69 4.61 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.882 2.473 . . . . 0.0 109.176 175.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -34.07 -35.6 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 129.655 3.182 . . . . 0.0 112.307 164.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -37.64 -67.41 0.19 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 127.703 2.401 . . . . 0.0 113.518 169.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 16.6 mt -77.24 -35.61 55.26 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 118.975 -0.536 . . . . 0.0 109.766 -174.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.92 -30.79 66.2 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 173.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.8 -60.05 2.3 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.362 -0.836 . . . . 0.0 111.112 175.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.91 -29.17 70.03 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -176.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.63 -32.21 47.3 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 120.78 -1.2 . . . . 0.0 111.433 169.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.27 -18.76 79.86 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 126.525 2.012 . . . . 0.0 115.367 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.58 -32.73 64.28 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 120.688 2.244 . . . . 0.0 108.99 165.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 39.7 tp 77.28 127.09 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 130.652 3.581 . . . . 0.0 108.388 -169.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . 0.424 HG23 HG12 ' B' ' 92' ' ' VAL . 12.8 m -44.03 -7.24 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 127.993 2.517 . . . . 0.0 116.734 169.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 73.63 -21.1 0.27 Allowed 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 127.215 2.206 . . . . 0.0 114.054 165.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.424 HG12 HG23 ' B' ' 90' ' ' VAL . 5.9 p -60.48 41.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 129.881 3.272 . . . . 0.0 114.792 171.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER 67.64 -0.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 C-N-CA 128.708 2.803 . . . . 0.0 113.633 177.461 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.0 tt 89.49 105.7 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 130.394 3.478 . . . . 0.0 105.431 -168.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.23 118.03 5.44 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 122.794 0.438 . . . . 0.0 111.063 -178.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 1.9 t -119.74 158.38 21.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 125.499 1.519 . . . . 0.0 108.525 169.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -56.9 138.54 53.64 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 166.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.83 150.27 13.42 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.178 -0.951 . . . . 0.0 109.029 -174.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -84.84 74.28 10.51 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.583 0.753 . . . . 0.0 110.498 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -119.09 142.33 31.93 Favored Pre-proline 0 CA--C 1.542 0.667 0 O-C-N 121.668 -0.645 . . . . 0.0 110.426 169.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -81.97 -171.07 1.09 Allowed 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 124.478 3.452 . . . . 0.0 112.959 -168.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . 0.502 ' HB2' HH11 ' A' ' 13' ' ' ARG . 8.5 t -127.83 177.26 6.95 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.824 1.25 . . . . 0.0 111.096 168.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 6.5 t 66.82 133.44 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 127.976 2.51 . . . . 0.0 110.758 -170.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.85 154.07 23.02 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.703 1.601 . . . . 0.0 112.351 172.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 54.0 22.76 3.59 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 125.081 1.352 . . . . 0.0 113.75 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.47 0.553 0 O-C-N 120.475 -1.391 . . . . 0.0 111.816 -173.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.467 ' HB2' ' HB2' ' B' ' 100' ' ' GLN . . . . . . . . 0 N--CA 1.464 0.27 0 CA-C-O 121.263 0.554 . . . . 0.0 110.035 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -67.23 -21.62 65.73 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.327 -0.858 . . . . 0.0 113.144 -168.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.47 -39.76 80.82 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 118.818 0.735 . . . . 0.0 111.734 167.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 24.2 mtp180 -60.02 -32.13 70.6 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 121.029 -1.044 . . . . 0.0 112.317 174.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.39 -43.6 98.43 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.281 1.032 . . . . 0.0 111.578 177.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -74.53 -33.98 54.98 Favored Glycine 0 N--CA 1.474 1.179 0 CA-C-N 118.59 0.632 . . . . 0.0 112.695 176.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 16.3 mtp180 -55.24 -49.66 71.44 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.304 1.042 . . . . 0.0 109.721 170.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.76 -28.39 63.61 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 mp -85.92 -20.28 29.24 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.252 0.933 . . . . 0.0 113.325 -177.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -96.88 16.92 17.97 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 172.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.28 165.17 9.27 Favored Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 125.931 1.692 . . . . 0.0 112.05 168.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -69.34 -115.57 0.0 OUTLIER 'Trans proline' 0 CA--C 1.554 1.502 1 C-N-CA 126.314 4.676 . . . . 0.0 111.519 172.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -37.5 -35.7 0.14 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 128.626 2.771 . . . . 0.0 115.245 169.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.536 HH12 ' CB ' ' A' ' 57' ' ' CYS . 6.4 ttm-85 -64.12 -38.45 91.12 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 120.008 1.277 . . . . 0.0 112.974 178.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.9 t -58.35 -43.61 88.43 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 119.501 1.046 . . . . 0.0 109.855 174.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -38.05 89.69 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 173.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 6.2 mm -57.95 -47.83 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 125.433 1.493 . . . . 0.0 111.337 171.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.3 mt -65.49 -43.61 89.63 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.52 -0.738 . . . . 0.0 112.075 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.4 p -71.81 -24.17 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 CA-C-N 119.076 0.853 . . . . 0.0 112.243 175.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.0 -38.03 79.03 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.439 0.696 . . . . 0.0 111.214 171.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.492 HD23 ' HA ' ' A' ' 30' ' ' LEU . 25.4 mt -71.99 -33.5 68.16 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -178.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -39.55 -50.96 2.23 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.322 2.249 . . . . 0.0 112.94 170.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -97.7 -20.36 17.65 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.575 1.15 . . . . 0.0 113.107 173.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.95 15.93 54.84 Favored Glycine 0 N--CA 1.469 0.897 0 C-N-CA 126.661 2.077 . . . . 0.0 116.552 -165.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 1.8 m -50.47 74.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 127.251 2.22 . . . . 0.0 115.575 171.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 9.0 t -144.44 -54.22 0.33 Allowed 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.474 1.657 . . . . 0.0 115.474 -174.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 12.3 p90 -158.24 157.08 28.83 Favored Pre-proline 0 N--CA 1.481 1.1 0 N-CA-C 116.801 2.149 . . . . 0.0 116.801 177.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -53.94 127.89 27.46 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.943 2.429 . . . . 0.0 108.737 168.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.93 -3.08 62.26 Favored Glycine 0 CA--C 1.53 1.021 0 CA-C-O 117.484 -1.731 . . . . 0.0 115.006 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.87 -34.38 62.92 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 120.595 2.198 . . . . 0.0 110.902 169.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.695 HD12 ' H ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -62.16 -17.79 59.0 Favored 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 127.147 2.179 . . . . 0.0 112.204 -178.441 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.07 -43.99 97.06 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.028 0.531 . . . . 0.0 111.002 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.05 -38.69 75.88 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.806 -0.559 . . . . 0.0 111.957 173.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -73.49 -15.6 61.31 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 -177.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 30.0 mt -110.53 -24.84 10.33 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.435 1.494 . . . . 0.0 113.842 174.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.56 6.89 88.85 Favored Glycine 0 CA--C 1.533 1.197 0 CA-C-N 119.554 1.07 . . . . 0.0 112.514 -168.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.8 mt -110.93 148.94 31.4 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 124.355 1.062 . . . . 0.0 111.693 -170.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.48 HG23 ' H ' ' A' ' 50' ' ' ASN . 3.4 t -58.31 149.71 23.8 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.795 0.838 . . . . 0.0 112.839 -172.057 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.7 mtm-85 -48.43 -37.14 16.37 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.977 1.711 . . . . 0.0 111.632 172.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.6 m -60.79 -60.01 4.48 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.281 1.032 . . . . 0.0 111.376 175.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.48 ' H ' HG23 ' A' ' 47' ' ' THR . 7.9 m-20 -67.97 -34.37 76.43 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.603 -0.685 . . . . 0.0 111.011 -175.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.9 t -57.21 -52.78 52.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 123.448 0.699 . . . . 0.0 111.191 169.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 13.1 p -72.67 -26.79 61.76 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -177.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -49.63 -48.38 49.2 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.355 1.074 . . . . 0.0 111.438 174.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 72.2 m-70 -78.8 -18.21 54.46 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 177.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 56.9 mt -70.72 -21.46 62.54 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 120.995 1.725 . . . . 0.0 112.042 172.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.0 t -63.21 -53.29 55.43 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.534 1.061 . . . . 0.0 110.908 176.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.536 ' CB ' HH12 ' A' ' 23' ' ' ARG . 48.9 t -78.94 12.81 1.99 Allowed 'General case' 0 CA--C 1.561 1.367 0 C-N-CA 125.557 1.543 . . . . 0.0 112.611 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -106.96 -52.22 2.8 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 126.821 2.048 . . . . 0.0 111.216 175.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 44.7 mtm105 -81.78 -25.76 34.99 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.692 0.797 . . . . 0.0 112.422 -170.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.503 ' HA3' ' HB2' ' B' ' 104' ' ' ALA . . . -92.64 -31.11 9.01 Favored Glycine 0 N--CA 1.474 1.233 0 C-N-CA 124.034 0.826 . . . . 0.0 113.715 178.073 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 41.5 m -82.39 -5.92 58.94 Favored 'General case' 0 CA--C 1.567 1.618 0 C-N-CA 126.065 1.746 . . . . 0.0 113.596 173.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.75 -3.68 83.25 Favored Glycine 0 N--CA 1.478 1.456 0 C-N-CA 126.831 2.158 . . . . 0.0 116.891 170.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.7 mt -56.62 -22.31 33.19 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.997 1.719 . . . . 0.0 114.195 177.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.9 m -143.97 149.68 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 C-N-CA 126.689 1.996 . . . . 0.0 111.842 177.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 97.7 t -115.61 143.13 26.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 126.464 1.905 . . . . 0.0 109.276 176.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -99.2 123.25 43.34 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.975 0.91 . . . . 0.0 111.953 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -124.36 162.54 23.62 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.645 1.178 . . . . 0.0 109.348 -178.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -91.86 126.55 36.99 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 164.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.258 0.0 OUTLIER -90.85 4.03 52.87 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -179.544 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 109.25 -15.79 32.77 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 125.124 1.345 . . . . 0.0 113.32 175.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.58 -45.08 2.2 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 128.197 2.599 . . . . 0.0 111.602 172.162 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -139.69 169.11 18.33 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.312 2.245 . . . . 0.0 110.917 -168.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 7.1 p -83.24 145.16 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 O-C-N 121.328 -0.857 . . . . 0.0 109.877 167.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 33.1 ptt180 -134.54 172.91 12.26 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.457 1.103 . . . . 0.0 111.829 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -122.77 124.62 43.75 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.483 1.113 . . . . 0.0 110.651 173.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -123.63 143.18 50.39 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.122 1.369 . . . . 0.0 110.768 -177.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.2 tp -52.14 143.73 13.71 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.589 1.156 . . . . 0.0 111.492 177.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -45.79 -38.87 7.62 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 115.907 1.817 . . . . 0.0 115.907 -173.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -176.41 168.32 2.75 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.515 1.926 . . . . 0.0 109.803 -175.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.3 p -41.94 -31.54 0.35 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.852 2.061 . . . . 0.0 112.174 164.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -46.81 -67.04 0.32 Allowed 'General case' 0 C--N 1.345 0.37 0 C-N-CA 127.249 2.22 . . . . 0.0 113.566 169.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 13.8 mt -68.09 -34.71 76.91 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 119.527 1.058 . . . . 0.0 109.813 178.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.29 -32.29 73.87 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.819 0.736 . . . . 0.0 112.357 -172.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.2 -58.84 3.03 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.911 0.884 . . . . 0.0 112.31 170.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.75 -28.41 69.86 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.958 1.254 . . . . 0.0 113.59 -174.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.99 -33.13 21.17 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.906 0.882 . . . . 0.0 112.611 172.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.05 -31.86 75.83 Favored Glycine 0 CA--C 1.539 1.583 0 C-N-CA 125.064 1.316 . . . . 0.0 113.155 175.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 25.0 tp10 -62.67 -23.36 67.07 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.467 1.907 . . . . 0.0 111.299 166.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 46.2 tp 81.67 128.26 0.05 OUTLIER 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 130.305 3.442 . . . . 0.0 107.047 -174.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 76.3 t -65.06 5.81 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 125.433 1.493 . . . . 0.0 114.544 -169.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.42 ' C ' ' H ' ' A' ' 93' ' ' VAL . 2.5 tp-100 88.07 -26.86 0.07 Allowed 'General case' 0 C--O 1.217 -0.619 0 O-C-N 120.12 -1.612 . . . . 0.0 111.191 132.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.3 p -63.97 35.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 130.327 3.451 . . . . 0.0 112.666 167.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.42 ' H ' ' C ' ' A' ' 91' ' ' GLN . 0.2 OUTLIER 59.18 8.36 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 C-N-CA 128.007 2.523 . . . . 0.0 114.047 176.653 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 96.63 111.24 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 131.141 3.776 . . . . 0.0 106.791 -166.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.51 96.57 0.17 Allowed 'General case' 0 CA--C 1.535 0.391 0 O-C-N 121.925 -0.485 . . . . 0.0 110.895 175.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.0 t -52.98 147.44 2.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 167.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.17 34.58 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 129.526 3.13 . . . . 0.0 113.665 -175.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.2 p -100.34 129.03 46.28 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 126.153 1.781 . . . . 0.0 111.421 -176.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -127.35 153.83 45.72 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.379 166.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -170.63 163.03 5.84 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 126.569 1.948 . . . . 0.0 108.904 -167.032 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -64.76 155.11 69.17 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.187 1.925 . . . . 0.0 110.15 169.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -93.04 -149.4 0.26 Allowed 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 122.179 0.99 . . . . 0.0 113.43 -172.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 5.3 t 50.41 52.81 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 125.855 1.662 . . . . 0.0 110.193 175.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.452 ' HB2' ' HA3' ' B' ' 60' ' ' GLY . . . 77.18 -12.89 1.0 Allowed 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 127.024 2.13 . . . . 0.0 116.434 178.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -60.77 167.12 2.92 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.595 1.089 . . . . 0.0 113.249 -177.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.5 mtm180 . . . . . 0 N--CA 1.469 0.503 0 C-N-CA 125.394 1.477 . . . . 0.0 110.974 -169.153 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.545 0 CA-C-O 121.614 0.721 . . . . 0.0 111.108 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -65.93 -21.32 66.43 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -167.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.24 -31.74 72.34 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 120.27 1.396 . . . . 0.0 112.511 168.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 5.6 mtm180 -61.43 -32.75 72.73 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.374 -0.829 . . . . 0.0 111.835 173.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -50.78 -57.84 7.4 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.85 1.26 . . . . 0.0 109.498 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.3 -34.03 88.84 Favored Glycine 0 CA--C 1.53 1.03 0 O-C-N 121.803 -0.561 . . . . 0.0 112.827 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 17.5 mtp180 -69.6 -11.52 60.9 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.035 1.334 . . . . 0.0 114.16 173.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -110.53 -8.11 14.67 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.756 1.622 . . . . 0.0 113.763 170.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -96.79 -29.98 13.44 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 119.909 1.231 . . . . 0.0 113.197 175.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -88.53 36.42 0.79 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.47 1.108 . . . . 0.0 112.604 173.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.554 ' CG ' ' HE ' ' B' ' 23' ' ' ARG . 0.1 OUTLIER -78.6 167.04 38.44 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 128.217 2.607 . . . . 0.0 112.46 172.882 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -69.12 -115.63 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.358 1 C-N-CA 126.686 4.924 . . . . 0.0 111.767 169.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -42.17 -33.67 0.64 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 128.314 2.645 . . . . 0.0 114.412 176.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.581 HH12 ' CB ' ' B' ' 57' ' ' CYS . 6.9 ttm-85 -59.92 -32.14 70.49 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 117.957 -1.021 . . . . 0.0 112.91 178.237 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 1.6 m -53.37 -56.64 15.08 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.403 1.002 . . . . 0.0 109.716 169.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -35.57 80.78 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 117.799 -1.096 . . . . 0.0 112.189 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 5.2 mm -53.74 -50.96 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 CA-C-N 120.778 1.626 . . . . 0.0 112.279 170.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 42.6 mt -69.21 -40.84 77.74 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.555 -0.736 . . . . 0.0 112.062 -174.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 12.5 p -74.38 -25.25 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-N 118.995 0.816 . . . . 0.0 112.276 175.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.3 -27.92 68.95 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.1 -1.0 . . . . 0.0 111.996 170.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.506 ' O ' HG13 ' B' ' 34' ' ' VAL . 4.9 mp -67.82 -51.08 52.75 Favored 'General case' 0 C--O 1.226 -0.16 0 CA-C-O 117.176 -1.392 . . . . 0.0 111.598 168.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 4.7 mt -44.48 -46.03 9.5 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.767 1.227 . . . . 0.0 112.022 169.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -81.07 3.52 23.0 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 126.932 2.093 . . . . 0.0 113.998 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -153.12 -63.31 0.01 OUTLIER Glycine 0 N--CA 1.478 1.452 0 N-CA-C 118.049 1.98 . . . . 0.0 118.049 -167.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . 0.506 HG13 ' O ' ' B' ' 30' ' ' LEU . 16.0 m 33.42 40.37 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 127.854 2.462 . . . . 0.0 115.915 -169.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 3.6 t -96.74 -60.84 1.51 Allowed 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 -169.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -158.97 159.22 29.43 Favored Pre-proline 0 N--CA 1.479 1.008 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 -174.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -60.09 124.54 15.46 Favored 'Trans proline' 0 C--N 1.356 0.93 0 C-N-CA 123.112 2.542 . . . . 0.0 110.368 175.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.28 -4.62 85.3 Favored Glycine 0 CA--C 1.527 0.832 0 CA-C-O 117.423 -1.765 . . . . 0.0 114.331 -175.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . 0.551 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -55.94 -36.05 67.33 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 120.002 1.901 . . . . 0.0 109.776 169.322 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.668 ' H ' HD12 ' B' ' 40' ' ' LEU . 0.3 OUTLIER -60.94 -18.92 59.7 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 125.916 1.686 . . . . 0.0 112.574 179.799 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.99 -58.29 5.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 118.397 0.544 . . . . 0.0 110.222 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.34 -33.08 74.74 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 122.669 0.387 . . . . 0.0 111.286 176.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . 0.551 ' CD2' HE22 ' B' ' 39' ' ' GLN . 0.6 OUTLIER -71.94 -13.28 61.59 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 179.77 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 33.5 mt -117.85 -23.66 7.44 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.969 1.707 . . . . 0.0 113.721 177.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.7 12.04 84.03 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 124.633 1.111 . . . . 0.0 111.808 -167.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 94.8 mt -124.82 132.48 53.33 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 118.599 1.199 . . . . 0.0 112.209 -169.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 8.7 t -48.87 145.96 3.55 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.134 1.774 . . . . 0.0 115.448 -169.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 38.8 mtm-85 -49.68 -34.96 20.01 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.726 2.01 . . . . 0.0 112.508 177.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 5.9 m -61.72 -59.33 5.33 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.588 0.755 . . . . 0.0 110.989 174.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -64.59 -37.24 86.87 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.029 0.932 . . . . 0.0 111.534 -178.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.1 t -55.76 -49.93 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 C-N-CA 123.611 0.764 . . . . 0.0 111.177 169.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 15.4 p -76.38 -25.42 54.56 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.82 1.415 . . . . 0.0 114.82 -176.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -51.3 -49.14 61.86 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.461 1.104 . . . . 0.0 110.969 170.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 60.3 m-70 -75.79 -22.4 56.42 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 173.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 91.6 mt -67.71 -23.07 65.24 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 121.008 1.731 . . . . 0.0 112.221 171.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.8 t -62.41 -53.55 53.2 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.718 1.144 . . . . 0.0 111.336 178.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . 0.581 ' CB ' HH12 ' B' ' 23' ' ' ARG 0.265 42.2 t -82.79 15.47 2.65 Favored 'General case' 0 CA--C 1.559 1.32 0 CA-C-O 122.417 1.104 . . . . 0.0 111.705 -178.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.486 ' CD1' ' HD3' ' B' ' 23' ' ' ARG . 1.3 tp -105.28 -51.18 3.07 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 127.638 2.375 . . . . 0.0 111.708 173.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 29.9 mtm105 -89.63 -8.33 52.76 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.597 1.159 . . . . 0.0 112.656 -170.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . 0.452 ' HA3' ' HB2' ' A' ' 104' ' ' ALA . . . -106.35 -29.84 4.64 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.356 1.455 . . . . 0.0 113.291 172.117 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 97.8 m -87.11 8.99 21.31 Favored 'General case' 0 CA--C 1.563 1.475 0 C-N-CA 126.067 1.747 . . . . 0.0 113.293 171.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.37 -13.84 14.45 Favored Glycine 0 N--CA 1.476 1.334 0 C-N-CA 126.825 2.155 . . . . 0.0 117.017 170.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 91.5 mt -48.79 -26.14 2.22 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.479 1.912 . . . . 0.0 114.88 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 4.0 m -136.99 150.64 26.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 C-N-CA 126.186 1.794 . . . . 0.0 111.688 173.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 90.2 t -118.76 148.59 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 126.659 1.984 . . . . 0.0 108.661 170.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.92 135.12 51.92 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.784 1.234 . . . . 0.0 112.406 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.4 p -120.35 -178.49 3.7 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.811 1.244 . . . . 0.0 110.836 176.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -97.63 135.01 40.05 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 104.866 -2.272 . . . . 0.0 104.866 160.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.57 -11.94 23.11 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 115.146 1.535 . . . . 0.0 115.146 177.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 117.55 -34.15 4.65 Favored Glycine 0 N--CA 1.474 1.176 0 C-N-CA 124.85 1.214 . . . . 0.0 112.874 176.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -96.75 -35.39 11.0 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 125.85 1.66 . . . . 0.0 111.454 169.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -155.05 -141.74 0.1 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 128.046 2.538 . . . . 0.0 110.382 -177.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 15.2 m -133.65 152.9 35.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 127.152 2.181 . . . . 0.0 108.583 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 7.2 ptt85 -135.04 173.83 11.28 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.077 0.853 . . . . 0.0 111.751 -173.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -121.71 141.96 50.64 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.531 1.132 . . . . 0.0 109.063 168.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.502 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -142.42 145.06 33.4 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.851 1.261 . . . . 0.0 109.003 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 tp -51.91 147.26 7.24 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.41 1.084 . . . . 0.0 111.05 175.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -49.57 -43.01 45.86 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 115.0 1.481 . . . . 0.0 115.0 -175.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -168.36 163.44 12.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.934 1.694 . . . . 0.0 110.61 -174.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 97.3 p -40.81 -33.92 0.34 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.624 2.37 . . . . 0.0 113.468 167.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -58.98 -54.95 41.38 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.344 1.058 . . . . 0.0 113.817 175.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 20.2 mt -66.37 -31.35 72.07 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.465 1.029 . . . . 0.0 109.746 177.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.22 -32.22 73.72 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 118.512 0.596 . . . . 0.0 109.512 178.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 2.8 mmt85 -71.57 -57.09 4.71 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.709 1.204 . . . . 0.0 111.123 168.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.45 -32.56 62.87 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.942 1.246 . . . . 0.0 114.036 -177.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -87.97 -37.47 16.36 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 172.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -81.42 -42.93 8.87 Favored Glycine 0 CA--C 1.539 1.533 0 C-N-CA 124.767 1.175 . . . . 0.0 113.984 -171.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -71.06 -35.88 72.09 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.8 1.24 . . . . 0.0 108.29 166.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 21.6 tp 93.76 144.34 0.02 OUTLIER 'General case' 0 C--N 1.342 0.268 0 C-N-CA 130.736 3.614 . . . . 0.0 111.434 168.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 1.5 m -53.2 -14.91 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 126.162 1.785 . . . . 0.0 113.897 171.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 65.42 -13.18 0.13 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 127.026 2.131 . . . . 0.0 114.011 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 1.3 p -58.02 24.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 130.635 3.574 . . . . 0.0 117.423 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.3 t 65.63 13.96 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 126.949 2.1 . . . . 0.0 111.358 171.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 78.75 116.15 0.06 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 127.604 2.362 . . . . 0.0 108.123 -167.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.68 87.72 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 169.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -57.73 147.46 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 C-N-CA 124.992 1.317 . . . . 0.0 110.928 168.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -50.39 58.32 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.061 1 C-N-CA 131.832 4.053 . . . . 0.0 115.021 170.236 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 16.5 p -135.48 123.73 23.13 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 120.764 -1.21 . . . . 0.0 112.224 176.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -126.37 156.75 40.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 114.275 -1.329 . . . . 0.0 108.294 165.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . 0.467 ' HB2' ' HB2' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -168.31 164.3 8.23 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 124.585 1.154 . . . . 0.0 109.357 -166.845 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -64.26 156.33 60.28 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 121.602 1.535 . . . . 0.0 109.264 167.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -101.02 -148.81 0.37 Allowed 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 122.189 0.995 . . . . 0.0 112.989 -169.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 4.7 t 51.43 50.54 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 125.533 1.533 . . . . 0.0 110.149 176.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . 0.503 ' HB2' ' HA3' ' A' ' 60' ' ' GLY . . . 85.27 -16.93 0.45 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 128.266 2.627 . . . . 0.0 116.225 177.115 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 75.1 mt-10 -61.36 173.57 0.87 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.911 1.285 . . . . 0.0 114.45 -173.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 . . . . . 0 N--CA 1.471 0.606 0 C-N-CA 127.328 2.251 . . . . 0.0 110.483 -169.394 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.827 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.499 ' H ' HD22 ' A' ' 11' ' ' LEU . 2.8 mm? -52.4 -39.59 61.08 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 115.489 1.663 . . . . 0.0 115.489 -166.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.46 -36.78 52.55 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.799 1.181 . . . . 0.0 111.722 174.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 mmt180 -62.89 -28.19 69.88 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.136 1.374 . . . . 0.0 112.562 177.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -47.85 -57.54 5.52 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.877 1.671 . . . . 0.0 109.337 168.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -76.85 -14.72 82.29 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-O 119.065 -0.853 . . . . 0.0 113.722 -178.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 76.6 mmt-85 -66.97 -62.59 1.36 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 166.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.13 -38.2 85.55 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.603 1.961 . . . . 0.0 114.905 -173.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.2 mp -79.66 -14.16 58.98 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 119.571 1.078 . . . . 0.0 112.538 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -118.88 24.26 10.95 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.452 1.101 . . . . 0.0 112.064 170.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -90.17 148.66 39.81 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 104.91 -2.255 . . . . 0.0 104.91 165.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -54.56 -99.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 0.979 1 C-N-CA 126.788 4.992 . . . . 0.0 113.777 -166.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.4 p -46.76 -36.88 7.74 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 126.155 1.782 . . . . 0.0 112.157 169.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -65.45 -36.87 85.21 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.179 0.899 . . . . 0.0 111.466 -174.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 52.4 t -67.38 -45.14 77.13 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.157 -0.964 . . . . 0.0 110.65 166.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.91 -43.08 69.41 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 121.743 -0.598 . . . . 0.0 112.535 178.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.6 mm -55.58 -50.42 66.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.617 1.567 . . . . 0.0 111.59 171.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 85.4 mt -61.47 -40.71 95.52 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.157 0.889 . . . . 0.0 112.015 -177.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 7.3 p -80.72 -32.6 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.1 -28.19 61.24 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.743 0.817 . . . . 0.0 112.522 173.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.44 ' O ' HG13 ' A' ' 34' ' ' VAL . 17.7 tp -66.33 -39.49 89.27 Favored 'General case' 0 N--CA 1.437 -1.088 0 CA-C-O 116.644 -1.646 . . . . 0.0 111.601 169.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -47.33 -62.43 1.43 Allowed 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.703 2.001 . . . . 0.0 110.1 175.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -83.3 26.24 0.66 Allowed 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 126.595 1.958 . . . . 0.0 113.04 174.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.25 -87.25 0.31 Allowed Glycine 0 C--N 1.337 0.63 0 C-N-CA 125.783 1.659 . . . . 0.0 112.738 -177.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.521 HG12 ' HA ' ' A' ' 76' ' ' ALA . 30.7 m 39.66 41.3 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 127.455 2.302 . . . . 0.0 114.575 -170.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -90.68 -68.16 0.8 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -177.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 24.1 p90 -159.25 157.76 27.74 Favored Pre-proline 0 N--CA 1.475 0.781 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -170.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -56.74 128.85 31.65 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.451 2.1 . . . . 0.0 109.276 171.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.74 -0.61 81.47 Favored Glycine 0 CA--C 1.534 1.226 0 CA-C-O 117.738 -1.59 . . . . 0.0 114.818 -175.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.514 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -59.1 -37.89 78.23 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 120.631 2.215 . . . . 0.0 110.898 170.865 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.5 mt -60.84 -17.8 52.0 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.564 1.145 . . . . 0.0 112.126 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.33 -31.84 73.1 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 118.698 0.681 . . . . 0.0 111.316 174.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.14 -50.43 19.45 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.429 0.692 . . . . 0.0 111.042 173.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.514 ' CD2' HE22 ' A' ' 39' ' ' GLN . 12.1 m-70 -57.78 -37.39 73.61 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 178.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.7 mt -98.29 -23.22 15.74 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.772 0.829 . . . . 0.0 113.196 -174.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.14 6.49 74.46 Favored Glycine 0 CA--C 1.534 1.273 0 CA-C-N 119.568 1.077 . . . . 0.0 113.919 -170.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.9 mp -96.93 155.44 16.78 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 118.143 0.971 . . . . 0.0 111.442 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.601 HG23 ' H ' ' A' ' 50' ' ' ASN . 1.4 t -58.21 144.7 39.86 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.971 0.508 . . . . 0.0 111.698 -179.287 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 29.9 mtt85 -55.24 -24.24 26.76 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.084 1.354 . . . . 0.0 111.947 171.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.9 m -65.33 -62.92 1.25 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.096 1.358 . . . . 0.0 111.275 170.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.601 ' H ' HG23 ' A' ' 47' ' ' THR . 3.7 m120 -66.12 -36.9 84.36 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.386 -0.821 . . . . 0.0 111.234 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.41 -31.8 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 O-C-N 120.327 -1.483 . . . . 0.0 113.045 169.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.3 m -75.47 -37.33 60.34 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.327 1.421 . . . . 0.0 113.209 171.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -54.58 -49.22 70.91 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 123.521 0.728 . . . . 0.0 110.154 172.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 16.7 m80 -64.27 -20.91 66.38 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 65.2 mt -88.98 -18.83 26.61 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 117.033 -1.461 . . . . 0.0 114.443 174.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 55.3 m -53.47 -58.0 8.68 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 121.988 2.176 . . . . 0.0 112.114 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 40.5 t -66.01 -45.13 82.64 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 122.853 1.311 . . . . 0.0 110.344 -176.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.84 -41.33 57.69 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 127.916 2.487 . . . . 0.0 113.356 -178.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.7 mtm180 -84.33 -21.04 31.11 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -177.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -95.7 -45.08 3.0 Favored Glycine 0 N--CA 1.473 1.145 0 CA-C-N 119.275 0.943 . . . . 0.0 113.879 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 51.7 m -66.04 -13.91 60.77 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 124.987 1.315 . . . . 0.0 111.831 174.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 97.45 14.36 41.53 Favored Glycine 0 C--N 1.346 1.1 0 C-N-CA 127.427 2.442 . . . . 0.0 115.848 167.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.9 mt -71.11 -28.62 64.44 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.772 1.286 . . . . 0.0 113.562 179.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 3.5 m -140.81 159.11 23.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 126.007 1.723 . . . . 0.0 111.901 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 2.9 t -140.85 160.59 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 125.487 1.515 . . . . 0.0 110.137 -172.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -86.08 146.45 26.61 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.842 1.257 . . . . 0.0 112.344 169.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -140.73 174.63 10.33 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.715 1.606 . . . . 0.0 107.396 169.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 28.6 m-85 -111.32 127.47 55.65 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.153 0.981 . . . . 0.0 111.948 169.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -80.66 14.75 1.97 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.858 0.863 . . . . 0.0 110.984 165.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 80.52 -56.34 4.7 Favored Glycine 0 C--N 1.343 0.937 0 C-N-CA 126.415 1.959 . . . . 0.0 112.067 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -76.05 -18.73 59.1 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.173 1.789 . . . . 0.0 112.568 177.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -164.08 167.3 20.45 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.8 2.04 . . . . 0.0 109.763 -173.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 34.3 m -87.04 154.98 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 O-C-N 121.725 -0.609 . . . . 0.0 110.078 167.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.4 ' HD2' ' HB ' ' A' ' 34' ' ' VAL . 20.4 ptt180 -132.67 169.43 16.67 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 125.321 1.448 . . . . 0.0 109.169 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -108.15 162.03 14.44 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 164.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.521 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -152.47 151.14 30.4 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.81 1.644 . . . . 0.0 110.214 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.2 tp -64.03 148.08 50.6 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.059 0.944 . . . . 0.0 109.249 169.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -76.75 -8.0 56.45 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 117.641 2.46 . . . . 0.0 117.641 -169.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -179.54 164.38 1.28 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 127.644 2.377 . . . . 0.0 111.883 172.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 26.4 t -47.65 -28.87 2.59 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 127.235 2.214 . . . . 0.0 112.448 166.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -49.14 -65.07 0.63 Allowed 'General case' 0 C--N 1.341 0.223 0 C-N-CA 125.51 1.524 . . . . 0.0 112.082 169.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.9 mt -68.29 -34.22 75.76 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 118.976 0.807 . . . . 0.0 110.138 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.98 -43.81 91.38 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 119.21 0.914 . . . . 0.0 111.207 -174.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.93 -31.69 40.07 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-O 117.906 -1.045 . . . . 0.0 112.574 179.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.94 -42.86 59.94 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 120.457 1.48 . . . . 0.0 112.518 176.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.18 -43.06 74.96 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.364 -0.835 . . . . 0.0 110.102 174.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.91 -30.47 65.72 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 125.855 1.693 . . . . 0.0 113.394 -174.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -62.79 -25.61 68.31 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 125.029 1.332 . . . . 0.0 111.499 166.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.499 ' C ' ' H ' ' A' ' 91' ' ' GLN . 27.8 tp 77.55 148.39 0.1 Allowed 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 129.139 2.975 . . . . 0.0 107.877 -167.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 4.3 m -57.1 5.09 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 120.396 -1.44 . . . . 0.0 113.969 165.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.499 ' H ' ' C ' ' A' ' 89' ' ' LEU . 28.7 mm-40 71.9 -43.28 0.56 Allowed 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 130.66 3.584 . . . . 0.0 111.026 -175.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -55.47 103.21 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 125.939 1.696 . . . . 0.0 112.937 -171.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.4 t 61.82 -31.03 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 C-N-CA 130.606 3.562 . . . . 0.0 117.651 168.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 tm? 109.38 93.03 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.509 1 C-N-CA 132.278 4.231 . . . . 0.0 101.858 -163.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.492 ' H ' HD11 ' A' ' 89' ' ' LEU . . . -62.61 82.57 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 -169.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.7 t -63.11 149.58 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 126.835 2.054 . . . . 0.0 111.889 169.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -59.45 -6.82 1.15 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 128.88 2.872 . . . . 0.0 115.403 175.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 17.7 p -75.97 113.38 13.41 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.426 1.091 . . . . 0.0 112.294 -175.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -75.44 69.5 2.22 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.864 1.266 . . . . 0.0 110.353 168.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.94 145.34 72.37 Favored Pre-proline 0 CA--C 1.55 0.949 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.478 173.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -63.83 136.1 51.58 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 123.111 2.54 . . . . 0.0 113.47 -168.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.0 t -70.16 66.36 0.28 Allowed 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 127.347 2.259 . . . . 0.0 111.106 -178.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 9.0 p -34.21 -51.08 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 N-CA-C 117.604 2.446 . . . . 0.0 117.604 -166.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -89.57 133.65 34.5 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 119.631 1.105 . . . . 0.0 111.336 174.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 55.49 35.1 24.42 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.043 1.337 . . . . 0.0 114.15 -172.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? . . . . . 0 CA--C 1.539 0.548 0 C-N-CA 125.257 1.423 . . . . 0.0 114.523 -174.232 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.834 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.535 HD22 ' H ' ' B' ' 11' ' ' LEU . 2.9 mm? -45.35 -41.95 9.48 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.864 2.065 . . . . 0.0 116.011 -167.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.13 -52.38 14.42 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.48 1.036 . . . . 0.0 111.568 173.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -53.85 -35.17 61.2 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.405 1.482 . . . . 0.0 113.188 178.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.499 ' CD2' HD22 ' B' ' 63' ' ' LEU . 2.5 tm? -50.28 -56.36 11.54 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 127.597 2.359 . . . . 0.0 110.347 169.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.62 -19.61 78.0 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-O 118.858 -0.968 . . . . 0.0 113.781 177.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 57.8 mmt-85 -66.75 -49.4 66.07 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.447 1.623 . . . . 0.0 108.624 168.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.96 -37.22 72.78 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.955 1.702 . . . . 0.0 113.971 -178.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 7.0 mp -72.52 -14.84 61.74 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.382 0.992 . . . . 0.0 113.156 176.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -121.84 29.45 7.11 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.107 0.963 . . . . 0.0 112.681 170.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -90.87 153.2 45.17 Favored Pre-proline 0 CA--C 1.539 0.539 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 165.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -54.8 -94.36 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.781 1 C-N-CA 126.224 4.616 . . . . 0.0 113.38 -168.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 16.5 p -51.7 -31.01 24.35 Favored 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 126.492 1.917 . . . . 0.0 112.625 170.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.87 -42.18 77.37 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.553 1.069 . . . . 0.0 111.726 -176.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 39.0 t -61.93 -42.72 99.43 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 119.003 0.819 . . . . 0.0 109.988 167.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -46.52 81.82 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 118.21 -0.9 . . . . 0.0 113.116 175.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.4 mm -55.81 -51.77 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 CA-C-N 120.487 1.494 . . . . 0.0 110.091 173.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 79.6 mt -59.68 -42.67 93.44 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 118.635 -0.698 . . . . 0.0 112.408 -177.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 7.1 p -80.45 -30.23 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 118.874 0.761 . . . . 0.0 112.731 -178.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.39 -35.95 68.57 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.586 -0.696 . . . . 0.0 112.215 173.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 20.0 tp -61.76 -37.97 86.27 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 117.068 -1.444 . . . . 0.0 112.5 177.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -44.24 -53.77 6.32 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 128.365 2.666 . . . . 0.0 112.28 -177.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -88.26 -15.47 35.73 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.732 1.613 . . . . 0.0 112.447 179.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.39 -77.54 1.26 Allowed Glycine 0 C--N 1.338 0.682 0 C-N-CA 124.901 1.239 . . . . 0.0 112.281 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . 0.425 HG12 ' HA ' ' B' ' 76' ' ' ALA . 29.4 m 37.45 41.21 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 126.582 1.953 . . . . 0.0 114.509 -169.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -87.67 -72.78 0.51 Allowed 'General case' 0 N--CA 1.467 0.413 0 O-C-N 121.727 -0.608 . . . . 0.0 112.046 -173.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 49.4 p90 -155.82 157.49 31.43 Favored Pre-proline 0 CA--C 1.538 0.506 0 CA-C-O 118.761 -0.638 . . . . 0.0 112.571 -170.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -60.49 125.04 16.34 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.576 2.184 . . . . 0.0 109.703 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.95 -1.54 88.81 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-O 117.564 -1.687 . . . . 0.0 114.763 -174.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . 0.437 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -56.81 -36.27 69.73 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.336 2.068 . . . . 0.0 111.015 169.751 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mt -61.51 -18.49 59.34 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.218 1.007 . . . . 0.0 112.133 -177.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.35 -34.36 75.15 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 118.596 0.635 . . . . 0.0 111.026 175.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.77 -38.66 32.69 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.133 0.973 . . . . 0.0 112.741 175.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . 0.437 ' CD2' HE22 ' B' ' 39' ' ' GLN . 4.0 m-70 -62.18 -34.7 76.93 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 172.265 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 26.2 mt -103.55 -23.08 13.53 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -173.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.54 8.29 85.9 Favored Glycine 0 CA--C 1.533 1.216 0 CA-C-N 119.194 0.907 . . . . 0.0 114.015 -170.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 9.3 mp -104.64 155.73 18.6 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 118.404 1.102 . . . . 0.0 112.395 -177.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.536 HG23 ' H ' ' B' ' 50' ' ' ASN . 1.6 t -59.47 145.68 43.03 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.11 0.964 . . . . 0.0 112.282 -179.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 29.5 mtm180 -57.19 -24.08 52.0 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.14 1.376 . . . . 0.0 112.469 169.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.9 m -59.76 -59.29 5.66 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.587 1.155 . . . . 0.0 109.856 169.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . 0.536 ' H ' HG23 ' B' ' 47' ' ' THR . 2.7 m120 -72.67 -42.51 64.21 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.969 0.908 . . . . 0.0 110.831 -177.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.5 t -53.79 -40.53 44.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 120.565 1.53 . . . . 0.0 111.924 171.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 50.5 m -68.66 -39.52 80.6 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 120.078 1.308 . . . . 0.0 113.441 175.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -57.99 -48.55 79.68 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.932 0.893 . . . . 0.0 111.259 172.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 19.4 m170 -60.63 -38.49 84.95 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 118.034 -0.984 . . . . 0.0 112.097 173.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 42.7 mt -70.89 -21.22 62.42 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.11 1.364 . . . . 0.0 114.115 174.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . 0.487 ' HA ' HH21 ' B' ' 59' ' ' ARG . 0.2 OUTLIER -61.14 -59.35 5.48 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 121.476 1.944 . . . . 0.0 112.711 -172.282 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -73.21 -26.35 61.11 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 122.121 0.962 . . . . 0.0 111.487 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.22 -48.17 71.36 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.62 1.568 . . . . 0.0 111.216 169.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.487 HH21 ' HA ' ' B' ' 56' ' ' SER . 76.5 mtm180 -82.81 -21.54 34.47 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.537 1.135 . . . . 0.0 112.48 178.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -78.29 -60.45 2.68 Favored Glycine 0 N--CA 1.469 0.891 0 CA-C-N 119.381 0.991 . . . . 0.0 113.234 177.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 20.8 m -67.89 -7.94 32.41 Favored 'General case' 0 CA--C 1.564 1.495 0 C-N-CA 125.236 1.414 . . . . 0.0 114.106 -178.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.87 7.99 54.72 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 127.008 2.242 . . . . 0.0 115.87 171.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.499 HD22 ' CD2' ' B' ' 14' ' ' LEU . 1.7 mt -66.5 -26.38 67.14 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.77 1.628 . . . . 0.0 112.98 -176.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 3.0 m -142.38 159.75 19.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 127.417 2.287 . . . . 0.0 110.723 174.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 4.8 t -133.91 167.04 27.22 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 C-N-CA 126.185 1.794 . . . . 0.0 109.449 176.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.33 130.43 50.6 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.652 1.581 . . . . 0.0 111.84 171.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.478 HG22 ' H ' ' B' ' 68' ' ' TYR . 1.3 m -120.64 -178.23 3.66 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.637 1.575 . . . . 0.0 108.223 178.177 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.478 ' H ' HG22 ' B' ' 67' ' ' THR . 29.7 m-85 -116.21 131.46 56.94 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.332 1.053 . . . . 0.0 112.005 169.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.52 10.29 18.23 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.579 0.752 . . . . 0.0 110.484 165.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.9 -56.45 4.94 Favored Glycine 0 C--N 1.344 0.984 0 C-N-CA 125.956 1.741 . . . . 0.0 112.182 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -70.49 -19.98 62.89 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.645 1.578 . . . . 0.0 112.553 174.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -165.2 168.47 17.05 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.121 2.168 . . . . 0.0 109.621 -174.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 32.9 m -88.3 156.73 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 O-C-N 121.489 -0.757 . . . . 0.0 110.226 167.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . 0.439 ' HG2' ' HB ' ' B' ' 67' ' ' THR . 24.2 ptt180 -132.92 173.13 11.72 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.503 1.121 . . . . 0.0 109.034 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -111.59 160.53 17.12 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 164.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.425 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -156.16 152.87 28.42 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 125.649 1.58 . . . . 0.0 110.295 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 tp -63.25 158.39 20.28 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.417 1.487 . . . . 0.0 112.594 176.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.67 -29.88 60.09 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 116.958 2.207 . . . . 0.0 116.958 -175.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 10.0 t70 168.63 166.37 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 129.425 3.09 . . . . 0.0 109.4 -169.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 45.2 t -46.11 -33.21 3.36 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.435 1.894 . . . . 0.0 112.121 166.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -45.76 -64.66 0.68 Allowed 'General case' 0 C--N 1.343 0.287 0 C-N-CA 125.208 1.403 . . . . 0.0 112.878 171.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 14.5 mt -68.07 -31.91 71.87 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.416 1.007 . . . . 0.0 110.848 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.27 -45.23 94.2 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.416 1.007 . . . . 0.0 110.286 -176.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.95 -40.24 28.49 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.569 0.748 . . . . 0.0 112.765 179.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.2 -33.58 71.88 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.797 1.18 . . . . 0.0 113.733 179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.13 -42.34 47.17 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.47 -0.769 . . . . 0.0 110.193 170.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.05 -39.06 54.8 Favored Glycine 0 CA--C 1.538 1.519 0 C-N-CA 125.6 1.571 . . . . 0.0 114.222 -169.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.84 -31.67 59.45 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 119.116 1.458 . . . . 0.0 109.662 166.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 19.3 tp 82.14 160.8 0.14 Allowed 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 128.98 2.912 . . . . 0.0 111.296 169.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . 0.511 HG23 HG12 ' B' ' 92' ' ' VAL . 15.9 m -57.07 8.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 127.21 2.204 . . . . 0.0 114.648 169.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 71.56 -20.39 0.24 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.461 1.905 . . . . 0.0 114.895 171.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.511 HG12 HG23 ' B' ' 90' ' ' VAL . 2.5 p -54.56 29.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 C-N-CA 131.393 3.877 . . . . 0.0 118.301 -176.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.2 t 69.26 15.72 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 125.533 1.533 . . . . 0.0 111.379 171.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 2.1 tm? 101.63 107.3 0.01 OUTLIER 'General case' 0 C--N 1.35 0.601 0 C-N-CA 130.583 3.553 . . . . 0.0 109.055 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.04 88.91 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.873 0 O-C-N 120.94 -1.1 . . . . 0.0 110.998 168.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 15.3 t -65.38 149.13 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 125.916 1.687 . . . . 0.0 110.312 173.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -57.91 -2.58 0.16 Allowed 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 127.284 2.234 . . . . 0.0 115.24 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 38.0 p -87.05 118.98 26.79 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.864 1.266 . . . . 0.0 111.976 -178.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -76.97 67.1 2.92 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 122.655 1.217 . . . . 0.0 109.769 167.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -54.68 134.9 64.45 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 172.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -57.59 136.77 77.8 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.382 2.721 . . . . 0.0 112.895 -169.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 9.0 t -65.7 55.35 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 128.786 2.835 . . . . 0.0 111.331 175.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 7.5 p -25.49 -58.11 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 128.772 2.829 . . . . 0.0 115.034 -166.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.46 110.68 13.75 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 118.861 0.755 . . . . 0.0 109.448 168.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . 0.26 73.0 mt-10 78.0 30.37 0.45 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 126.414 1.885 . . . . 0.0 113.737 171.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? . . . . . 0 CA--C 1.539 0.523 0 C-N-CA 124.739 1.216 . . . . 0.0 112.562 170.08 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.424 0 CA-C-O 121.846 0.832 . . . . 0.0 109.909 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -59.72 -30.06 68.56 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 -170.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.59 -32.04 49.34 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 120.293 1.406 . . . . 0.0 112.91 172.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.0 mmt85 -66.94 -18.36 65.34 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 120.312 -1.492 . . . . 0.0 113.017 177.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.554 HD21 HD21 ' A' ' 63' ' ' LEU . 3.1 tm? -70.28 -39.22 75.02 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.6 1.16 . . . . 0.0 110.807 172.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.08 -40.83 99.7 Favored Glycine 0 C--N 1.341 0.86 0 N-CA-C 111.099 -0.8 . . . . 0.0 111.099 171.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.6 tmm_? -57.25 -46.03 83.4 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.212 1.006 . . . . 0.0 109.674 171.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.73 -19.63 65.1 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 116.916 -1.516 . . . . 0.0 113.578 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 mp -98.4 -16.35 19.31 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 171.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.86 -34.17 51.81 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.633 1.973 . . . . 0.0 114.3 169.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -50.85 136.37 26.74 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 125.098 1.359 . . . . 0.0 111.203 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -60.01 -77.34 0.02 OUTLIER 'Trans proline' 0 CA--C 1.537 0.647 1 C-N-CA 125.47 4.113 . . . . 0.0 113.23 -169.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.443 ' HB ' ' CD2' ' A' ' 54' ' ' HIS . 24.6 m -53.98 -36.7 63.18 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 117.59 -1.195 . . . . 0.0 110.408 174.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.32 -43.0 82.7 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.915 1.234 . . . . 0.0 113.336 -175.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 11.8 t -54.43 -44.63 72.62 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.601 1.16 . . . . 0.0 110.276 168.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -43.68 93.98 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-O 117.857 -1.068 . . . . 0.0 112.444 175.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -54.44 -50.45 57.68 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 C-N-CA 125.948 1.699 . . . . 0.0 111.061 174.528 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 14.9 mt -52.57 -39.39 61.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 118.671 -0.68 . . . . 0.0 112.573 -176.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.08 -20.26 26.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 118.807 0.731 . . . . 0.0 112.559 -177.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.39 -6.93 59.43 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 114.219 1.192 . . . . 0.0 114.219 174.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -105.91 -13.26 15.55 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 169.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.47 -48.35 64.72 Favored 'General case' 0 C--N 1.317 -0.844 0 C-N-CA 127.394 2.277 . . . . 0.0 108.773 165.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -135.86 96.06 3.35 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 128.514 2.726 . . . . 0.0 107.932 175.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 159.59 -95.8 0.14 Allowed Glycine 0 N--CA 1.468 0.78 0 C-N-CA 124.824 1.202 . . . . 0.0 111.105 176.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.0 m 51.4 33.13 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 178.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 2.4 m -80.55 -65.58 0.99 Allowed 'General case' 0 C--O 1.222 -0.364 0 O-C-N 121.199 -0.938 . . . . 0.0 111.284 178.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -150.96 157.5 35.41 Favored Pre-proline 0 N--CA 1.47 0.533 0 CA-C-O 117.731 -1.128 . . . . 0.0 111.069 -172.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -59.07 -18.1 41.76 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 122.892 2.395 . . . . 0.0 114.166 169.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -86.91 -12.27 68.83 Favored Glycine 0 CA--C 1.536 1.403 0 CA-C-O 118.494 -1.17 . . . . 0.0 115.252 170.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.87 -36.67 56.6 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.884 1.842 . . . . 0.0 112.051 -170.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.686 HD12 ' H ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -66.71 -19.4 65.75 Favored 'General case' 0 C--O 1.217 -0.616 0 C-N-CA 123.14 0.576 . . . . 0.0 110.919 -174.546 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.8 -36.75 79.82 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.387 -0.82 . . . . 0.0 112.734 -177.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -75.0 -47.76 27.53 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 122.794 0.437 . . . . 0.0 110.926 170.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -57.68 -35.72 70.97 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.766 1.226 . . . . 0.0 113.919 -176.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.434 HD12 HG22 ' A' ' 51' ' ' VAL . 65.7 mt -94.53 -15.27 24.29 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 127.598 2.359 . . . . 0.0 112.324 -178.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.33 10.96 54.88 Favored Glycine 0 CA--C 1.53 1.023 0 C-N-CA 124.291 0.948 . . . . 0.0 112.976 -170.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.4 mt -117.22 149.99 39.49 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 124.107 0.963 . . . . 0.0 111.427 -169.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 12.7 p -61.75 147.31 46.61 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.833 -0.542 . . . . 0.0 110.115 -172.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -59.15 -20.33 52.77 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 177.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.0 m -73.94 -46.53 43.64 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.138 0.975 . . . . 0.0 112.085 169.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -65.09 -44.2 89.62 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.364 1.065 . . . . 0.0 111.889 175.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.434 HG22 HD12 ' A' ' 44' ' ' LEU . 23.2 t -61.53 -40.87 87.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.725 1.21 . . . . 0.0 111.391 173.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 70.7 m -64.04 -41.35 97.44 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 119.921 1.237 . . . . 0.0 112.717 172.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -55.11 -48.93 72.93 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 123.491 0.716 . . . . 0.0 111.48 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . 0.443 ' CD2' ' HB ' ' A' ' 22' ' ' THR 0.272 11.2 m-70 -80.4 -22.98 40.71 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.811 1.412 . . . . 0.0 114.811 176.45 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 31.4 mt -65.16 -30.5 71.42 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.773 1.624 . . . . 0.0 110.619 166.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.6 t -50.76 -59.81 3.71 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.568 1.076 . . . . 0.0 112.857 -173.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 9.0 t -78.29 -11.02 59.91 Favored 'General case' 0 CA--C 1.554 1.112 0 O-C-N 121.476 -0.765 . . . . 0.0 112.227 174.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.9 tp -68.15 -36.28 79.42 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 122.065 2.211 . . . . 0.0 109.882 168.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.0 mtp180 -81.34 -12.77 58.92 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.37 1.868 . . . . 0.0 111.131 173.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -88.48 -60.84 1.5 Allowed Glycine 0 C--N 1.34 0.8 0 C-N-CA 125.044 1.307 . . . . 0.0 111.006 176.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 96.1 m -59.2 8.13 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 128.361 2.664 . . . . 0.0 115.022 171.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.23 -3.55 14.67 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 126.202 1.858 . . . . 0.0 115.743 177.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.554 HD21 HD21 ' A' ' 14' ' ' LEU . 75.4 mt -59.65 -29.53 68.1 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 126.398 1.879 . . . . 0.0 114.555 -174.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.38 137.25 58.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 125.16 1.384 . . . . 0.0 111.95 173.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.6 t -118.06 139.86 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 C-N-CA 125.849 1.66 . . . . 0.0 109.298 174.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -89.01 149.58 23.19 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.556 1.142 . . . . 0.0 113.461 177.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 m -171.16 157.79 5.25 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 126.442 1.897 . . . . 0.0 108.05 -176.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -73.1 143.79 47.24 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 118.903 0.774 . . . . 0.0 112.529 171.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.438 ' CD ' ' H ' ' A' ' 70' ' ' GLY 0.289 2.2 pp20? -84.75 -124.42 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 117.034 -1.46 . . . . 0.0 107.654 165.264 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.438 ' H ' ' CD ' ' A' ' 69' ' ' GLU . . . -77.29 -28.82 57.35 Favored Glycine 0 CA--C 1.537 1.416 0 CA-C-N 121.919 2.145 . . . . 0.0 114.286 171.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.49 -29.02 0.07 Allowed 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 119.15 1.475 . . . . 0.0 114.818 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -81.99 168.86 17.41 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 125.711 1.605 . . . . 0.0 111.011 169.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 26.7 m -98.84 146.78 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 123.272 0.629 . . . . 0.0 110.181 169.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -129.83 168.64 16.28 Favored 'General case' 0 CA--C 1.522 -0.115 0 C-N-CA 125.432 1.493 . . . . 0.0 111.626 -171.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -121.6 129.0 52.54 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 124.97 1.308 . . . . 0.0 109.215 170.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -143.05 153.44 42.95 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 125.333 1.453 . . . . 0.0 111.398 -173.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 68.7 mt -64.42 147.24 53.09 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -177.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.35 -28.71 61.26 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -172.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -163.8 159.54 21.36 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 123.148 1.451 . . . . 0.0 112.931 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 96.0 p -43.42 -36.34 1.91 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 128.646 2.778 . . . . 0.0 113.815 167.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -50.78 -52.68 38.5 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 125.201 1.4 . . . . 0.0 112.59 172.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.9 mt -71.43 -53.4 14.12 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.31 -36.52 61.33 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.661 1.185 . . . . 0.0 113.0 -177.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -74.92 -57.42 3.92 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 117.726 -1.131 . . . . 0.0 111.974 -177.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.7 -27.33 68.84 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.466 1.03 . . . . 0.0 112.869 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 60.1 tp -69.35 -41.15 76.98 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.565 1.146 . . . . 0.0 111.469 169.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -78.47 -38.36 25.05 Favored Glycine 0 N--CA 1.469 0.88 0 C-N-CA 126.692 2.091 . . . . 0.0 115.129 -172.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -82.94 -16.6 46.74 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 118.637 1.219 . . . . 0.0 113.014 171.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 43.5 tp 67.95 140.94 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 128.841 2.856 . . . . 0.0 112.241 178.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 34.7 m -63.64 22.19 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.434 1.893 . . . . 0.0 114.656 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 81.08 -26.91 0.14 Allowed 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 125.98 1.712 . . . . 0.0 112.949 158.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.406 ' CG2' HD12 ' B' ' 11' ' ' LEU . 4.1 p -54.44 23.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 C-N-CA 131.57 3.948 . . . . 0.0 118.135 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 68.56 11.69 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 O-C-N 120.379 -1.45 . . . . 0.0 112.459 167.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.1 tt 84.94 100.93 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 129.389 3.076 . . . . 0.0 109.369 -172.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.93 108.13 0.98 Allowed 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 -175.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -66.89 150.42 11.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 125.125 1.37 . . . . 0.0 113.843 169.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -87.41 146.22 25.96 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.423 1.889 . . . . 0.0 108.621 165.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -173.01 136.29 0.65 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.557 1.943 . . . . 0.0 109.164 -177.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.0 p30 -67.48 -31.12 71.05 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 129.783 3.233 . . . . 0.0 112.115 169.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.09 168.26 2.3 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 128.501 2.721 . . . . 0.0 113.378 172.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -68.49 158.73 56.42 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 123.017 2.478 . . . . 0.0 112.848 -172.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 31.4 p -47.49 -57.42 5.4 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 123.418 1.58 . . . . 0.0 106.793 165.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -176.84 -56.15 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.479 1 C-N-CA 131.826 4.05 . . . . 0.0 108.134 167.545 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -87.25 56.63 4.06 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.628 1.171 . . . . 0.0 112.563 175.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -140.87 -177.31 5.02 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.002 2.121 . . . . 0.0 107.174 172.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.079 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 176.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.393 0 CA-C-O 121.247 0.546 . . . . 0.0 111.27 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.406 HD12 ' CG2' ' A' ' 92' ' ' VAL . 4.0 mm? -64.28 -18.64 64.77 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 114.487 1.291 . . . . 0.0 114.487 -176.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.91 -39.46 62.78 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 120.975 1.716 . . . . 0.0 110.027 167.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 67.8 mtt180 -72.25 -13.35 61.5 Favored 'General case' 0 CA--C 1.55 0.976 0 O-C-N 120.334 -1.479 . . . . 0.0 113.58 178.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -69.59 -41.85 75.21 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 120.14 1.336 . . . . 0.0 109.751 169.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -60.37 -38.54 94.87 Favored Glycine 0 N--CA 1.47 0.958 0 O-C-N 120.911 -1.118 . . . . 0.0 111.91 172.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -58.09 -38.86 77.23 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.711 -0.876 . . . . 0.0 110.659 172.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.12 -12.93 61.07 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 117.86 -1.067 . . . . 0.0 113.77 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 12.4 mt -93.7 -25.71 17.33 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.205 0.911 . . . . 0.0 112.258 169.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.67 -20.54 49.98 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.641 1.976 . . . . 0.0 114.638 168.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.474 ' CG ' ' HE ' ' B' ' 23' ' ' ARG . 9.7 t70 -56.92 130.09 78.71 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 127.287 2.235 . . . . 0.0 109.371 178.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -49.03 -83.0 0.02 OUTLIER 'Trans proline' 0 C--O 1.237 0.452 1 C-N-CA 126.925 5.083 . . . . 0.0 114.003 -165.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.435 ' HB ' ' CG ' ' B' ' 54' ' ' HIS . 59.8 m -59.6 -32.63 70.57 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 116.652 -1.642 . . . . 0.0 110.89 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.474 ' HE ' ' CG ' ' B' ' 20' ' ' ASP . 23.7 mtm180 -62.27 -42.41 99.31 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 121.136 1.789 . . . . 0.0 114.441 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 6.7 t -52.47 -47.84 66.25 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.689 0.757 . . . . 0.0 110.413 173.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.57 -42.47 82.51 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.488 1.115 . . . . 0.0 112.849 175.016 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -53.21 -52.12 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 C-N-CA 126.585 1.954 . . . . 0.0 110.263 176.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 25.4 mt -54.73 -37.34 65.77 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 123.556 0.742 . . . . 0.0 112.167 -172.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -64.03 -22.15 30.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 118.928 0.785 . . . . 0.0 112.821 178.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.14 -5.11 59.19 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.031 1.332 . . . . 0.0 114.286 173.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -106.8 -19.57 13.6 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 124.867 1.267 . . . . 0.0 113.562 170.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.24 -48.06 77.25 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 127.191 2.197 . . . . 0.0 108.953 164.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -135.12 93.56 3.01 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 128.324 2.649 . . . . 0.0 108.462 175.096 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . 161.86 -92.73 0.11 Allowed Glycine 0 N--CA 1.468 0.773 0 C-N-CA 124.552 1.073 . . . . 0.0 112.145 173.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 4.0 m 51.4 35.86 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 2.7 m -81.8 -66.88 0.83 Allowed 'General case' 0 C--O 1.223 -0.336 0 O-C-N 121.185 -0.947 . . . . 0.0 111.694 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -147.98 157.17 43.71 Favored Pre-proline 0 CA--C 1.537 0.465 0 CA-C-O 117.738 -1.125 . . . . 0.0 110.685 -174.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -59.1 -14.25 22.77 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 123.299 2.666 . . . . 0.0 114.599 171.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -93.89 -14.3 52.61 Favored Glycine 0 CA--C 1.535 1.336 0 CA-C-O 118.242 -1.31 . . . . 0.0 115.465 170.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.65 -34.13 73.57 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.262 2.031 . . . . 0.0 112.108 -170.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.653 ' H ' HD12 ' B' ' 40' ' ' LEU . 0.2 OUTLIER -66.81 -19.01 65.66 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 123.75 0.82 . . . . 0.0 110.511 -172.984 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.52 -37.32 80.78 Favored 'General case' 0 CA--C 1.547 0.833 0 O-C-N 120.891 -1.131 . . . . 0.0 112.174 -177.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.04 -46.83 27.3 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.168 0.587 . . . . 0.0 111.361 171.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -58.72 -32.31 69.08 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -176.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.406 HD12 HG22 ' B' ' 51' ' ' VAL . 69.2 mt -98.93 -20.24 16.9 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 127.128 2.171 . . . . 0.0 112.674 -177.21 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.4 13.52 77.22 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 124.807 1.194 . . . . 0.0 112.964 -170.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 76.3 mt -118.69 151.36 38.12 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 118.229 1.014 . . . . 0.0 111.96 -169.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.8 p -62.89 145.53 54.94 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.497 -0.752 . . . . 0.0 109.783 -173.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -61.39 -17.39 53.9 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 176.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 6.0 m -73.42 -47.94 37.8 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.212 1.005 . . . . 0.0 111.68 169.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -66.17 -45.42 80.94 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.756 0.822 . . . . 0.0 111.134 175.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . 0.406 HG22 HD12 ' B' ' 44' ' ' LEU . 5.3 t -58.3 -40.02 76.28 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-O 117.929 -1.034 . . . . 0.0 112.218 171.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 67.8 m -67.34 -41.04 85.85 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 121.005 1.729 . . . . 0.0 112.676 174.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -57.99 -47.65 82.35 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.488 0.715 . . . . 0.0 111.218 177.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . 0.435 ' CG ' ' HB ' ' B' ' 22' ' ' THR . 79.0 m-70 -75.75 -26.11 57.13 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 121.262 -0.899 . . . . 0.0 113.329 175.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 38.3 mt -66.07 -29.43 69.77 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 121.077 1.762 . . . . 0.0 111.193 167.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.2 t -51.33 -57.93 7.56 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.593 1.088 . . . . 0.0 113.375 -172.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 34.2 t -79.69 -9.79 59.69 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 123.542 0.737 . . . . 0.0 112.672 172.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 6.2 tp -67.03 -37.57 84.36 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 121.965 2.166 . . . . 0.0 109.063 167.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 22.6 mtp-105 -82.2 -7.28 59.62 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.08 2.152 . . . . 0.0 111.429 174.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -91.14 -64.35 1.18 Allowed Glycine 0 C--N 1.342 0.863 0 C-N-CA 125.936 1.732 . . . . 0.0 111.358 173.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 67.8 m -61.1 13.79 0.01 OUTLIER 'General case' 0 CA--C 1.563 1.472 0 C-N-CA 128.227 2.611 . . . . 0.0 115.238 172.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.06 -2.36 6.97 Favored Glycine 0 N--CA 1.474 1.216 0 C-N-CA 126.439 1.971 . . . . 0.0 115.836 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.45 HD23 HD13 ' B' ' 82' ' ' LEU . 52.7 mt -59.27 -28.26 66.57 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.845 1.658 . . . . 0.0 113.8 -175.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -129.46 137.32 57.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 125.243 1.417 . . . . 0.0 112.636 172.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 75.1 t -116.0 136.75 51.91 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 C-N-CA 126.289 1.836 . . . . 0.0 109.566 171.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.68 145.56 28.71 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 122.192 0.996 . . . . 0.0 112.457 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 41.1 m -158.68 159.44 35.32 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 126.048 1.739 . . . . 0.0 107.206 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -83.63 144.2 29.59 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 119.481 1.037 . . . . 0.0 111.771 170.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.269 2.6 pp20? -88.39 -141.48 0.13 Allowed 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 165.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -69.82 -23.09 77.06 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 121.636 2.016 . . . . 0.0 114.572 177.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.72 -30.12 0.07 Allowed 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 -89.36 171.92 9.4 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 126.826 2.05 . . . . 0.0 112.068 174.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 19.7 m -96.13 150.21 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.315 0.646 . . . . 0.0 109.742 167.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -137.57 163.54 30.94 Favored 'General case' 0 CA--C 1.521 -0.139 0 C-N-CA 125.73 1.612 . . . . 0.0 110.935 -171.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -119.54 127.83 53.37 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 125.238 1.415 . . . . 0.0 109.187 174.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -141.15 156.06 46.0 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.348 1.459 . . . . 0.0 110.971 -175.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 61.8 mt -63.85 148.38 49.5 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.155 0.502 . . . . 0.0 111.751 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -73.0 -28.07 62.16 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 -173.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -167.16 160.12 13.52 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.06 1.344 . . . . 0.0 111.715 -178.078 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 94.6 p -41.7 -35.91 0.87 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 128.134 2.574 . . . . 0.0 113.448 167.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -48.38 -54.76 12.79 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 126.08 1.752 . . . . 0.0 112.784 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . 0.45 HD13 HD23 ' B' ' 63' ' ' LEU . 7.5 mt -75.32 -47.07 29.49 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.629 -0.7 . . . . 0.0 109.474 -177.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.42 -36.08 53.45 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.103 0.961 . . . . 0.0 113.026 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -76.03 -56.13 4.95 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.888 1.275 . . . . 0.0 111.865 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.81 -28.96 66.49 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 176.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 61.1 tp -77.64 -37.5 49.89 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.426 1.89 . . . . 0.0 112.524 171.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -80.95 -42.37 9.69 Favored Glycine 0 N--CA 1.469 0.837 0 C-N-CA 126.035 1.779 . . . . 0.0 113.915 -169.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -80.69 -23.74 39.35 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 117.967 0.884 . . . . 0.0 111.372 168.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 19.8 tp 68.76 160.71 0.19 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 129.464 3.106 . . . . 0.0 111.398 178.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . 0.407 HG23 HG12 ' B' ' 92' ' ' VAL . 17.8 m -58.92 12.22 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 125.857 1.663 . . . . 0.0 114.087 167.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 73.82 -17.75 0.43 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 126.146 1.778 . . . . 0.0 114.229 168.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.407 HG12 HG23 ' B' ' 90' ' ' VAL . 1.6 p -59.49 20.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 C-N-CA 128.187 2.595 . . . . 0.0 116.863 177.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.4 t 65.87 23.45 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 C-N-CA 125.373 1.469 . . . . 0.0 113.656 165.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 tt 79.34 92.56 0.06 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 127.47 2.308 . . . . 0.0 110.203 -176.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.68 130.07 42.75 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 178.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -84.94 148.64 4.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.755 1.222 . . . . 0.0 111.174 168.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -79.96 151.38 30.08 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.106 0.962 . . . . 0.0 109.476 166.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -174.31 144.31 0.92 Allowed 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.832 1.653 . . . . 0.0 109.225 -171.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 7.0 p30 -79.96 -22.54 42.47 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 130.465 3.506 . . . . 0.0 112.946 171.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.28 -176.64 0.26 Allowed Pre-proline 0 CA--C 1.556 1.177 0 C-N-CA 126.784 2.033 . . . . 0.0 113.596 -176.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -76.19 151.67 34.56 Favored 'Trans proline' 0 C--N 1.352 0.753 0 CA-C-N 122.505 1.93 . . . . 0.0 111.383 177.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 26.4 p -44.77 -56.18 4.7 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-O 123.534 1.635 . . . . 0.0 107.998 166.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -176.33 -57.85 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.593 1 C-N-CA 132.459 4.304 . . . . 0.0 107.396 169.637 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -88.96 50.85 2.03 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.082 1.353 . . . . 0.0 113.367 178.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -135.71 -173.47 3.37 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.026 1.73 . . . . 0.0 107.907 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . 0.268 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.017 0 O-C-N 119.468 -2.02 . . . . 0.0 115.524 175.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.619 0 CA-C-O 120.813 0.339 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.651 ' H ' HD12 ' A' ' 11' ' ' LEU . 5.4 mp -47.4 -56.41 6.98 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 126.886 2.075 . . . . 0.0 113.199 -169.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.21 -34.38 76.35 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 121.173 -0.955 . . . . 0.0 112.356 178.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -58.27 -31.48 67.48 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 120.983 -1.073 . . . . 0.0 112.893 -176.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -49.57 -58.08 5.9 Favored 'General case' 0 C--O 1.225 -0.228 0 C-N-CA 126.119 1.768 . . . . 0.0 110.576 173.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -61.3 -35.01 90.29 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-N 118.77 0.714 . . . . 0.0 112.186 -173.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.8 -50.42 62.69 Favored 'General case' 0 C--O 1.221 -0.434 0 C-N-CA 124.043 0.937 . . . . 0.0 110.538 173.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.99 -22.93 64.98 Favored 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -177.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -88.19 -24.76 23.21 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 119.107 0.867 . . . . 0.0 112.133 170.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.45 31.74 1.48 Allowed 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 125.652 1.581 . . . . 0.0 112.574 167.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.56 167.29 21.28 Favored Pre-proline 0 CA--C 1.542 0.646 0 C-N-CA 125.528 1.531 . . . . 0.0 107.407 167.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.76 -105.9 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 123.975 3.117 . . . . 0.0 109.997 174.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.7 m -63.85 -14.76 55.87 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 125.626 1.57 . . . . 0.0 113.078 -178.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.75 -37.86 87.53 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 120.285 1.402 . . . . 0.0 111.765 169.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 19.8 t -64.93 -40.18 94.64 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 118.901 0.773 . . . . 0.0 110.593 172.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 13.5 mmp_? -59.69 -51.4 69.96 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.941 0.896 . . . . 0.0 112.77 172.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.3 mm -47.7 -57.16 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 124.279 1.032 . . . . 0.0 110.835 170.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 86.9 mt -60.8 -50.4 73.62 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.022 0.828 . . . . 0.0 112.092 -176.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.4 p -72.12 -27.07 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -174.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.3 -26.23 28.7 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.358 0.663 . . . . 0.0 112.685 173.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.499 ' O ' HG13 ' A' ' 34' ' ' VAL . 7.8 mt -63.2 -41.76 99.21 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 117.879 -1.057 . . . . 0.0 112.154 170.007 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -40.13 -51.89 2.6 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.93 2.492 . . . . 0.0 114.492 -177.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -97.8 -16.08 19.99 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.613 1.565 . . . . 0.0 112.459 173.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.09 -46.9 9.75 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 125.388 1.471 . . . . 0.0 115.069 -174.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.546 HG12 ' HA ' ' A' ' 76' ' ' ALA . 15.9 m 3.48 58.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 131.245 3.818 . . . . 0.0 118.603 -178.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 55.6 m -118.65 -57.86 2.01 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.517 1.927 . . . . 0.0 111.669 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -149.02 148.77 28.16 Favored Pre-proline 0 N--CA 1.474 0.728 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -171.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -55.53 -45.34 40.4 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 122.7 2.266 . . . . 0.0 112.406 172.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -74.89 -6.55 78.86 Favored Glycine 0 CA--C 1.532 1.14 0 CA-C-O 118.836 -0.98 . . . . 0.0 114.541 178.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -65.42 -33.74 76.66 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.159 1.48 . . . . 0.0 111.875 -175.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.49 HD21 ' HG ' ' A' ' 30' ' ' LEU . 2.2 mt -64.39 -6.97 8.18 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 123.443 0.697 . . . . 0.0 112.043 -175.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.84 -39.96 95.47 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 122.638 0.375 . . . . 0.0 110.462 172.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.77 -38.85 62.07 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.608 0.763 . . . . 0.0 111.59 171.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.412 ' HD2' HD23 ' A' ' 40' ' ' LEU . 2.4 m-70 -61.63 -23.73 66.24 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 177.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 69.0 mt -119.81 -16.3 8.75 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.076 1.35 . . . . 0.0 113.941 -173.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.78 10.31 67.4 Favored Glycine 0 CA--C 1.537 1.423 0 CA-C-N 118.99 0.814 . . . . 0.0 112.925 -168.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 79.4 mt -104.86 158.26 16.65 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 118.574 1.187 . . . . 0.0 112.98 -171.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.2 t -66.4 153.37 42.96 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 122.103 0.954 . . . . 0.0 111.374 176.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -54.59 -22.47 13.45 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.348 1.459 . . . . 0.0 113.424 173.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.6 t -67.39 -56.71 8.57 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.336 0.971 . . . . 0.0 111.293 169.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -62.69 -37.58 87.02 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.47 1.108 . . . . 0.0 112.151 -178.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.8 t -58.16 -50.0 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 123.557 0.743 . . . . 0.0 111.024 169.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.4 m -63.34 -34.09 76.95 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 177.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -57.43 -52.63 64.59 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.722 1.609 . . . . 0.0 110.651 -178.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 49.1 m-70 -76.98 -19.0 57.85 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.343 1.238 . . . . 0.0 114.343 175.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 41.7 mt -76.05 -22.14 56.01 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 120.402 1.456 . . . . 0.0 112.845 169.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 88.9 p -52.2 -64.13 0.92 Allowed 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 120.648 1.567 . . . . 0.0 113.48 -175.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 51.0 t -64.69 -39.62 93.97 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.404 1.082 . . . . 0.0 110.785 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.5 tp -48.02 -40.65 23.41 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.673 1.589 . . . . 0.0 113.761 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.6 mtm180 -88.1 -17.0 31.99 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.928 1.291 . . . . 0.0 113.3 -175.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -93.3 -45.55 3.49 Favored Glycine 0 N--CA 1.477 1.4 0 C-N-CA 125.248 1.404 . . . . 0.0 111.959 175.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 55.5 m -75.23 7.58 3.32 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 127.151 2.181 . . . . 0.0 112.866 170.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 66.1 6.28 31.42 Favored Glycine 0 N--CA 1.468 0.827 0 C-N-CA 126.019 1.771 . . . . 0.0 117.083 169.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 47.2 mt -61.37 -19.95 62.45 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.4 1.6 . . . . 0.0 113.384 178.221 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.1 m -132.47 147.26 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 127.333 2.253 . . . . 0.0 111.862 169.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 82.8 t -128.82 137.37 57.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 126.791 2.036 . . . . 0.0 109.616 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.19 172.82 11.08 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 123.126 1.441 . . . . 0.0 114.346 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.7 m -160.72 149.16 16.37 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.92 1.288 . . . . 0.0 108.514 177.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -98.63 114.25 26.64 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.692 1.133 . . . . 0.0 110.869 168.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.46 ' CD ' ' HD3' ' A' ' 74' ' ' ARG . 12.1 mm-40 -93.52 34.36 1.18 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.144 1.778 . . . . 0.0 113.428 -173.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.33 -17.35 1.08 Allowed Glycine 0 CA--C 1.536 1.363 0 O-C-N 120.209 -1.557 . . . . 0.0 115.254 174.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -145.26 -17.09 0.49 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.28 1.432 . . . . 0.0 113.773 -178.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -152.61 -178.98 7.2 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 127.944 2.498 . . . . 0.0 107.105 175.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 16.3 m -108.85 155.48 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 C-N-CA 123.785 0.834 . . . . 0.0 109.212 168.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.46 ' HD3' ' CD ' ' A' ' 69' ' ' GLU . 2.2 ptt180 -122.95 175.21 6.7 Favored 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 124.76 1.224 . . . . 0.0 111.092 176.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.402 ' O ' HD22 ' A' ' 30' ' ' LEU . 39.1 m-85 -130.76 118.66 21.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.094 -1.412 . . . . 0.0 107.914 168.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.546 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -108.92 156.97 19.08 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 125.07 1.348 . . . . 0.0 109.396 174.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.2 tp -54.99 152.27 7.76 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.048 1.339 . . . . 0.0 111.377 172.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -45.54 -48.35 14.27 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.514 1.302 . . . . 0.0 114.514 -171.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -171.87 -179.96 2.57 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 122.122 0.963 . . . . 0.0 111.308 -176.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.6 p -42.78 -39.23 2.39 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.441 1.896 . . . . 0.0 112.309 167.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -54.19 -57.08 12.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.469 1.507 . . . . 0.0 113.262 177.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 18.4 mt -74.61 -34.87 62.92 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 119.9 1.227 . . . . 0.0 110.626 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.39 -21.92 66.73 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.457 0.571 . . . . 0.0 112.329 -178.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -81.58 -74.28 0.34 Allowed 'General case' 0 C--O 1.219 -0.515 0 CA-C-O 116.753 -1.594 . . . . 0.0 111.278 166.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.04 -21.91 66.71 Favored 'General case' 0 CA--C 1.555 1.168 0 CA-C-N 123.06 2.663 . . . . 0.0 115.974 -169.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.69 -42.62 50.57 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 120.553 1.524 . . . . 0.0 109.702 167.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -66.26 -32.32 81.74 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 127.912 2.672 . . . . 0.0 115.6 179.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.32 -27.25 62.04 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 126.85 2.06 . . . . 0.0 112.416 169.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 28.6 tp 71.29 97.95 0.07 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 128.408 2.683 . . . . 0.0 108.909 -170.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.464 HG23 HG12 ' A' ' 92' ' ' VAL . 33.6 m -51.62 11.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 129.414 3.086 . . . . 0.0 118.418 -176.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.5 mm-40 80.64 -28.58 0.13 Allowed 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 119.749 -1.844 . . . . 0.0 113.464 157.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.464 HG12 HG23 ' A' ' 90' ' ' VAL . 4.9 p -62.12 43.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 C-N-CA 128.755 2.822 . . . . 0.0 115.691 176.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 67.32 6.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 C-N-CA 127.609 2.364 . . . . 0.0 113.058 177.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.8 tt 71.97 93.71 0.08 Allowed 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 127.731 2.412 . . . . 0.0 107.414 -168.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.49 123.23 14.04 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.108 0.563 . . . . 0.0 112.326 -173.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 29.0 t -63.55 164.78 1.38 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 126.19 1.796 . . . . 0.0 110.149 169.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.88 19.27 0.02 OUTLIER 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 126.098 1.759 . . . . 0.0 113.905 172.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 16.3 p -109.39 131.58 54.93 Favored 'General case' 0 CA--C 1.516 -0.352 0 O-C-N 120.124 -1.61 . . . . 0.0 114.268 -173.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -87.89 131.31 34.62 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 105.81 -1.922 . . . . 0.0 105.81 162.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -132.84 137.88 30.66 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 105.675 -1.972 . . . . 0.0 105.675 -174.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -73.6 179.37 5.65 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 124.682 3.588 . . . . 0.0 113.367 -168.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.08 138.19 58.16 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-O 121.595 0.712 . . . . 0.0 111.178 178.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 21.3 t -68.23 -25.6 32.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 O-C-N 121.748 -0.595 . . . . 0.0 111.566 -171.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -86.47 -21.61 26.93 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 170.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -149.01 106.23 3.62 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.213 1.005 . . . . 0.0 111.542 -169.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.552 1.05 0 C-N-CA 126.356 1.862 . . . . 0.0 115.68 -170.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.013 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 29.3 mt -46.31 -66.05 0.46 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 128.819 2.848 . . . . 0.0 112.469 -169.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.31 -37.69 68.89 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 122.833 0.453 . . . . 0.0 112.166 173.221 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.33 -30.19 62.27 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -176.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -46.4 -60.93 2.04 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 127.199 2.2 . . . . 0.0 110.015 169.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.13 -21.96 70.36 Favored Glycine 0 C--N 1.338 0.684 0 CA-C-O 118.806 -0.997 . . . . 0.0 112.842 -172.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -53.81 8.79 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.388 1.094 . . . . 0.0 110.171 169.089 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.98 -22.77 65.9 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -174.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -87.97 -19.38 27.3 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.369 0.986 . . . . 0.0 112.093 169.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -82.31 63.65 6.59 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.009 1.324 . . . . 0.0 110.097 171.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.5 166.88 20.13 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 125.033 1.333 . . . . 0.0 112.73 -168.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -71.64 -116.82 0.01 OUTLIER 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 124.671 3.581 . . . . 0.0 107.781 165.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 42.4 p -60.19 -22.18 62.64 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 -173.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.423 ' CG ' HD13 ' B' ' 58' ' ' LEU . 4.5 ttp180 -61.57 -36.24 80.08 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 121.635 2.016 . . . . 0.0 112.23 174.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 48.7 t -69.25 -41.74 76.54 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 119.027 0.83 . . . . 0.0 111.577 168.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 17.1 mmp_? -58.97 -52.44 65.73 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.372 0.669 . . . . 0.0 112.075 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 18.3 mm -42.78 -56.16 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 125.837 1.655 . . . . 0.0 109.832 172.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 94.6 mt -62.71 -45.53 92.33 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 118.983 -0.532 . . . . 0.0 112.422 -175.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 8.4 p -74.24 -28.05 22.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 -178.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . 0.47 ' HB1' ' CD2' ' B' ' 43' ' ' HIS . . . -84.8 -25.75 27.96 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 175.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.506 HD23 ' HA ' ' B' ' 30' ' ' LEU . 9.0 mt -62.23 -43.05 99.72 Favored 'General case' 0 CA--C 1.52 -0.178 0 O-C-N 121.28 -0.888 . . . . 0.0 111.977 172.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -41.65 -45.18 3.34 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 129.137 2.975 . . . . 0.0 115.092 -174.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -117.35 13.17 14.48 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 126.059 1.744 . . . . 0.0 112.658 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.69 -69.34 0.77 Allowed Glycine 0 N--CA 1.472 1.093 0 C-N-CA 127.321 2.391 . . . . 0.0 112.806 176.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 29.43 41.13 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 128.599 2.76 . . . . 0.0 117.201 -177.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 94.2 m -84.07 -79.31 0.21 Allowed 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 125.443 1.497 . . . . 0.0 110.208 173.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.36 158.35 51.17 Favored Pre-proline 0 N--CA 1.482 1.143 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 -168.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.08 -34.69 93.39 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 123.162 2.574 . . . . 0.0 113.519 176.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -76.92 -12.43 84.61 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-O 118.419 -1.212 . . . . 0.0 113.916 175.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.12 -31.15 72.2 Favored 'General case' 0 C--N 1.348 0.502 0 CA-C-N 120.076 1.938 . . . . 0.0 112.424 -170.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.447 HD21 ' HG ' ' B' ' 30' ' ' LEU . 1.1 mt -69.06 -7.34 34.88 Favored 'General case' 0 C--N 1.342 0.258 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -175.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.0 -39.06 80.7 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 118.422 0.555 . . . . 0.0 110.651 169.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.79 -43.93 57.41 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.62 0.768 . . . . 0.0 111.867 172.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . 0.47 ' CD2' ' HB1' ' B' ' 29' ' ' ALA . 5.4 m-70 -59.13 -27.1 65.3 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 67.9 mt -111.83 -16.59 13.13 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.983 1.713 . . . . 0.0 113.533 -177.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.09 15.26 69.45 Favored Glycine 0 CA--C 1.536 1.367 0 CA-C-N 118.757 0.708 . . . . 0.0 112.708 -168.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 86.4 mt -108.76 171.04 7.66 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 118.753 1.276 . . . . 0.0 113.453 -173.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.9 t -69.98 151.09 45.99 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 122.026 0.917 . . . . 0.0 111.149 169.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -54.45 -18.92 4.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.686 1.594 . . . . 0.0 113.553 168.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 11.7 t -68.05 -58.62 4.2 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 119.066 0.848 . . . . 0.0 111.493 169.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -59.32 -36.73 76.16 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.452 -0.78 . . . . 0.0 112.531 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 42.1 t -57.83 -50.29 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 123.419 0.688 . . . . 0.0 111.027 170.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 41.2 m -68.7 -31.82 71.18 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -178.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 32.4 t-20 -57.43 -62.0 2.09 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.212 1.405 . . . . 0.0 109.806 178.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 55.6 m-70 -68.13 -24.53 65.02 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 121.034 -1.041 . . . . 0.0 112.876 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 73.7 mt -69.97 -19.19 63.37 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 119.711 1.141 . . . . 0.0 113.76 170.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 89.3 p -58.16 -48.17 81.11 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 121.075 1.761 . . . . 0.0 111.892 174.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 51.7 t -68.89 -46.23 68.91 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.566 0.621 . . . . 0.0 111.034 175.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.423 HD13 ' CG ' ' B' ' 23' ' ' ARG . 2.9 tp -57.52 -36.83 72.08 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.307 1.043 . . . . 0.0 113.357 -171.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -90.13 -16.38 29.7 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.242 1.417 . . . . 0.0 112.867 178.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -79.97 -51.71 4.95 Favored Glycine 0 N--CA 1.472 1.06 0 CA-C-N 119.38 0.991 . . . . 0.0 111.135 170.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 83.4 m -74.44 3.19 7.91 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 126.913 2.085 . . . . 0.0 113.903 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.53 3.95 50.24 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.006 1.288 . . . . 0.0 115.446 169.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 84.5 mt -57.85 -23.81 54.59 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.496 1.648 . . . . 0.0 112.619 176.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.8 m -126.73 147.6 31.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 126.742 2.017 . . . . 0.0 111.662 168.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 65.8 t -136.05 132.99 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 126.838 2.055 . . . . 0.0 109.589 -176.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.75 157.82 27.04 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.832 1.653 . . . . 0.0 113.488 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 15.7 m -165.29 140.73 5.22 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.547 1.539 . . . . 0.0 108.072 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -63.83 122.29 16.08 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.814 0.734 . . . . 0.0 111.479 172.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.469 ' CD ' ' H ' ' B' ' 72' ' ' GLN . 5.1 pt-20 -71.99 -21.66 61.54 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -178.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 116.25 4.67 17.92 Favored Glycine 0 CA--C 1.539 1.589 0 C-N-CA 125.52 1.534 . . . . 0.0 113.834 -168.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . 0.421 ' H ' ' HG2' ' B' ' 69' ' ' GLU . 29.2 ttm180 -155.5 -53.46 0.09 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.187 1.395 . . . . 0.0 111.493 175.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . 0.469 ' H ' ' CD ' ' B' ' 69' ' ' GLU . 9.4 mm-40 -116.37 -125.04 0.28 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.57 1.548 . . . . 0.0 108.181 167.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 11.5 p -149.13 137.07 14.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 C-N-CA 126.095 1.758 . . . . 0.0 107.182 -167.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.2 ptt85 -105.04 170.84 7.64 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.967 1.307 . . . . 0.0 109.034 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.454 ' O ' HD22 ' B' ' 30' ' ' LEU . 45.6 m-85 -129.27 116.14 18.68 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 168.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -108.43 169.18 8.81 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.773 1.229 . . . . 0.0 109.579 175.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 tp -59.88 162.07 5.85 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.987 0.915 . . . . 0.0 111.421 169.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -48.96 -54.42 15.62 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.981 0.912 . . . . 0.0 112.603 176.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -165.97 165.63 17.91 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.708 1.203 . . . . 0.0 110.945 -169.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 92.2 p -40.26 -37.5 0.65 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.615 2.366 . . . . 0.0 112.582 166.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -52.33 -58.45 6.63 Favored 'General case' 0 C--N 1.341 0.231 0 C-N-CA 125.165 1.386 . . . . 0.0 113.762 173.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 13.9 mt -70.36 -32.47 70.17 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.505 1.048 . . . . 0.0 110.011 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.5 -28.33 67.74 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.682 0.793 . . . . 0.0 111.769 -176.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.42 -71.11 0.46 Allowed 'General case' 0 C--O 1.22 -0.461 0 CA-C-O 116.63 -1.652 . . . . 0.0 111.407 168.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.9 -22.91 65.97 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 122.998 2.635 . . . . 0.0 115.253 -170.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.57 -46.55 25.81 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 121.049 -1.032 . . . . 0.0 110.356 167.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.24 -28.83 74.02 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 126.158 1.837 . . . . 0.0 115.304 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.11 -26.9 67.99 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.673 1.989 . . . . 0.0 112.257 168.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 34.7 tp 70.32 100.11 0.06 Allowed 'General case' 0 C--O 1.232 0.172 0 C-N-CA 128.481 2.712 . . . . 0.0 109.281 -172.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . 0.54 HG23 HG12 ' B' ' 92' ' ' VAL . 34.0 m -51.5 11.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 C-N-CA 129.431 3.092 . . . . 0.0 118.247 -178.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . 0.45 ' C ' ' H ' ' B' ' 93' ' ' VAL . 31.0 mm-40 77.84 -18.0 0.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 O-C-N 119.854 -1.779 . . . . 0.0 114.53 159.284 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.54 HG12 HG23 ' B' ' 90' ' ' VAL . 4.5 p -66.42 34.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 127.049 2.14 . . . . 0.0 113.452 168.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . 0.45 ' H ' ' C ' ' B' ' 91' ' ' GLN . 2.7 t 69.98 1.07 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.028 0 C-N-CA 127.381 2.273 . . . . 0.0 113.367 169.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 87.53 99.41 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 130.101 3.36 . . . . 0.0 107.135 -174.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.96 100.98 0.05 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.159 0.984 . . . . 0.0 113.137 -173.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 25.2 t -51.97 153.66 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 125.622 1.569 . . . . 0.0 110.205 168.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -66.75 32.17 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 126.907 2.083 . . . . 0.0 114.984 175.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 33.8 p -121.73 111.03 16.66 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 126.226 1.81 . . . . 0.0 112.815 -174.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -93.95 143.22 26.55 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 165.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -154.97 174.09 4.21 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 124.657 1.183 . . . . 0.0 108.265 -168.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -72.29 165.39 32.79 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.175 1.917 . . . . 0.0 112.661 -170.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -70.19 140.72 52.56 Favored 'General case' 0 CA--C 1.552 1.056 0 O-C-N 122.162 -0.336 . . . . 0.0 110.219 178.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 19.2 t -55.29 -22.92 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -166.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -100.6 -16.75 17.35 Favored 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 178.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -143.6 121.77 12.21 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.477 1.035 . . . . 0.0 110.658 -169.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.547 0.864 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -169.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.619 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 pp -65.71 -22.42 66.61 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.294 -0.866 . . . . 0.0 112.112 169.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.94 -56.83 9.69 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 169.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 -53.76 -36.37 62.29 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.369 1.068 . . . . 0.0 113.647 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.25 -64.92 0.75 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.492 1.517 . . . . 0.0 110.404 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.64 -19.18 76.32 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 118.927 -0.929 . . . . 0.0 113.531 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -65.55 -4.09 5.5 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.63 1.715 . . . . 0.0 113.328 174.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.4 -6.73 1.54 Allowed 'General case' 0 CA--C 1.547 0.865 0 CA-C-O 117.116 -1.421 . . . . 0.0 114.3 169.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.88 -31.61 17.25 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 121.394 1.906 . . . . 0.0 110.171 165.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.436 ' HB2' ' HA3' ' B' ' 15' ' ' GLY . . . -94.73 76.04 3.69 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.435 1.094 . . . . 0.0 111.913 -177.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.519 ' CG ' ' HE ' ' A' ' 23' ' ' ARG . 1.4 t70 -164.27 140.34 5.0 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 126.62 1.968 . . . . 0.0 111.239 -173.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -51.84 -60.59 0.72 Allowed 'Trans proline' 0 C--N 1.353 0.81 1 C-N-CA 125.463 4.109 . . . . 0.0 112.97 -171.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.9 m -79.15 -31.36 44.02 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 119.425 -0.321 . . . . 0.0 110.566 -173.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.519 ' HE ' ' CG ' ' A' ' 20' ' ' ASP . 67.1 mtm180 -69.23 -33.56 73.48 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 116.241 -1.838 . . . . 0.0 113.633 -173.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 44.5 t -57.67 -55.21 37.79 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 121.185 1.812 . . . . 0.0 110.29 168.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 44.3 mtt180 -45.2 -45.33 11.63 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.221 1.408 . . . . 0.0 112.998 169.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.5 mt -62.4 -58.41 7.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 CA-C-N 120.181 1.355 . . . . 0.0 111.156 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.13 -44.86 79.57 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.967 0.907 . . . . 0.0 110.883 -175.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.4 p -79.2 -29.39 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 124.496 1.118 . . . . 0.0 112.374 -174.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.73 -35.11 30.08 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 122.893 0.477 . . . . 0.0 112.022 175.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.506 ' O ' HG13 ' A' ' 34' ' ' VAL . 13.2 tp -67.29 -32.14 72.93 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 116.733 -1.603 . . . . 0.0 112.37 172.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -41.67 -45.31 3.39 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.431 1.892 . . . . 0.0 112.579 -178.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -99.9 -26.22 14.08 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.524 1.93 . . . . 0.0 112.724 169.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -83.01 -3.7 90.33 Favored Glycine 0 C--N 1.339 0.74 0 CA-C-O 116.591 -2.227 . . . . 0.0 117.101 -168.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.506 HG13 ' O ' ' A' ' 30' ' ' LEU . 16.7 m -29.91 45.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.663 1 C-N-CA 132.087 4.155 . . . . 0.0 120.564 171.445 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 2.4 t -107.78 -51.88 2.84 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 119.369 -2.082 . . . . 0.0 113.203 -175.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.3 p90 -158.24 157.78 29.34 Favored Pre-proline 0 N--CA 1.477 0.882 0 N-CA-C 115.347 1.61 . . . . 0.0 115.347 -178.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -55.83 128.77 31.67 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 122.223 1.949 . . . . 0.0 108.214 169.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.69 -3.61 68.36 Favored Glycine 0 CA--C 1.531 1.086 0 CA-C-O 116.639 -2.201 . . . . 0.0 115.413 -176.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.493 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -53.94 -37.3 63.72 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 121.475 2.638 . . . . 0.0 110.841 170.702 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 20.5 mt -53.14 -28.99 28.71 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 127.144 2.178 . . . . 0.0 112.488 176.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.79 -32.62 70.78 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 118.427 0.558 . . . . 0.0 110.89 -179.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.82 -45.62 27.96 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.687 0.795 . . . . 0.0 112.092 174.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.493 ' CD2' HE22 ' A' ' 39' ' ' GLN . 4.8 m-70 -58.8 -32.66 69.54 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 175.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 16.0 mt -102.37 -26.86 13.13 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -173.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.41 1.79 66.1 Favored Glycine 0 CA--C 1.533 1.215 0 CA-C-N 119.503 1.047 . . . . 0.0 113.975 -170.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.9 mp -99.52 147.44 25.31 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.104 0.952 . . . . 0.0 109.663 177.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 70.4 p -59.23 151.95 21.87 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 125.305 1.442 . . . . 0.0 111.184 -169.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.14 -20.34 57.94 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.308 171.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.3 m -73.62 -55.29 6.48 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.232 -0.918 . . . . 0.0 110.805 169.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -53.08 -56.45 16.11 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.402 1.081 . . . . 0.0 110.898 178.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 69.3 t -65.96 -24.5 34.11 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 O-C-N 120.904 -1.122 . . . . 0.0 112.428 -177.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.7 m -71.05 -36.69 72.42 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 120.54 1.518 . . . . 0.0 113.657 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -52.99 -50.48 64.1 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.675 0.79 . . . . 0.0 110.4 169.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -63.84 -36.06 82.68 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.381 1.073 . . . . 0.0 113.688 178.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 21.3 mt -72.51 -31.56 65.44 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 117.841 -1.076 . . . . 0.0 113.533 174.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.89 -46.7 43.08 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.821 1.191 . . . . 0.0 112.876 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 4.0 t -78.9 -35.63 43.28 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-O 121.601 0.715 . . . . 0.0 112.093 179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.6 tp -59.61 -38.44 81.29 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.738 1.215 . . . . 0.0 112.332 178.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 45.2 mtm105 -77.47 -30.0 52.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.372 1.069 . . . . 0.0 112.467 177.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.475 ' HA3' ' HB2' ' B' ' 104' ' ' ALA . . . -90.33 -40.39 5.76 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 124.59 1.091 . . . . 0.0 114.769 -173.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 69.9 m -71.6 -9.75 58.71 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 124.116 0.966 . . . . 0.0 111.828 171.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 91.17 20.76 37.67 Favored Glycine 0 C--N 1.344 0.976 0 C-N-CA 125.472 1.511 . . . . 0.0 115.851 168.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.3 mt -86.6 -23.09 25.87 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.622 1.711 . . . . 0.0 114.799 178.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.5 m -127.97 148.49 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 124.728 1.211 . . . . 0.0 111.214 169.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 25.6 t -137.45 148.96 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.383 1.473 . . . . 0.0 109.8 -178.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.97 160.88 30.06 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.262 1.425 . . . . 0.0 113.814 173.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.2 m -163.24 167.8 21.48 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.392 1.877 . . . . 0.0 108.426 173.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -101.68 121.19 41.58 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 165.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.27 -13.25 59.36 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -178.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 133.37 -26.01 3.57 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 125.762 1.648 . . . . 0.0 113.958 173.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 48.5 ttt-85 -132.62 -10.75 3.14 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.395 1.878 . . . . 0.0 112.737 172.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -148.79 160.05 43.57 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.892 2.077 . . . . 0.0 111.304 -177.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 23.4 m -82.91 145.0 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 O-C-N 121.44 -0.787 . . . . 0.0 109.757 168.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 7.1 ptt180 -131.2 165.62 22.93 Favored 'General case' 0 CA--C 1.518 -0.275 0 C-N-CA 124.769 1.228 . . . . 0.0 110.408 -172.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -107.65 148.64 29.1 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 163.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.436 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -147.67 156.97 43.32 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 123.397 0.679 . . . . 0.0 110.146 174.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tp -53.96 144.79 18.06 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 123.542 0.526 . . . . 0.0 110.172 170.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.97 -20.12 64.17 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 116.083 1.883 . . . . 0.0 116.083 -170.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -168.97 164.03 11.47 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.711 1.604 . . . . 0.0 112.367 173.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 50.7 m -51.49 -30.14 18.99 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.845 2.058 . . . . 0.0 112.574 168.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -52.82 -58.24 7.57 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 126.643 1.977 . . . . 0.0 112.334 171.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 19.1 mt -64.21 -44.19 92.7 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 177.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -56.94 -34.3 67.87 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 125.068 1.347 . . . . 0.0 111.444 -175.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.1 ttm-85 -74.22 -57.7 3.78 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 116.685 -1.626 . . . . 0.0 112.092 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.26 -22.91 64.73 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 122.103 2.229 . . . . 0.0 113.33 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 54.5 tp -71.64 -45.52 61.81 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.425 1.89 . . . . 0.0 110.69 168.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.53 -36.24 12.52 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 126.147 1.832 . . . . 0.0 115.088 -171.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -77.91 -5.51 51.32 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.34 1.456 . . . . 0.0 112.777 176.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 25.9 tp 60.79 89.46 0.07 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.657 2.383 . . . . 0.0 113.484 168.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.3 m -41.37 150.42 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 125.194 1.398 . . . . 0.0 112.4 176.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -72.0 2.9 4.94 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 -159.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.7 p -66.45 35.39 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 126.289 1.836 . . . . 0.0 114.221 174.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 61.08 20.01 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 126.396 1.879 . . . . 0.0 113.544 169.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 tt 94.93 106.96 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 129.337 3.055 . . . . 0.0 106.513 -167.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.79 89.5 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.97 0.908 . . . . 0.0 111.667 170.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.0 t -63.43 135.57 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 125.201 1.4 . . . . 0.0 110.266 171.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -62.57 6.26 0.1 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 127.547 2.339 . . . . 0.0 115.065 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.6 138.09 58.09 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 122.307 1.051 . . . . 0.0 110.612 176.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -92.92 153.6 18.69 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 113.438 -1.71 . . . . 0.0 107.595 164.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -161.16 136.17 5.55 Favored Pre-proline 0 N--CA 1.447 -0.575 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 174.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -60.59 165.34 11.64 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 121.331 1.354 . . . . 0.0 109.886 169.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 46.3 t -74.79 -129.79 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.143 0 CA-C-O 122.647 1.213 . . . . 0.0 110.189 170.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 27.4 t 76.19 -45.51 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 128.811 2.844 . . . . 0.0 113.341 168.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . 123.6 1.72 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 131.003 3.721 . . . . 0.0 113.748 177.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.6 -176.82 1.08 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.835 0.854 . . . . 0.0 112.133 174.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.473 0.679 0 C-N-CA 123.91 0.884 . . . . 0.0 109.111 169.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.401 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 pp -70.3 -23.78 62.91 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 176.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.93 -55.27 27.4 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.95 0.9 . . . . 0.0 109.982 169.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 24.5 ttm180 -60.07 -40.13 88.44 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 177.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -53.54 -59.27 4.81 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.451 1.1 . . . . 0.0 110.416 176.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . 0.436 ' HA3' ' HB2' ' A' ' 19' ' ' ALA . . . -73.26 -21.1 79.99 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-O 118.739 -1.034 . . . . 0.0 113.689 -177.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.83 -18.11 53.73 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 126.465 1.906 . . . . 0.0 114.179 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -123.83 -7.58 7.87 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 177.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 3.1 mt -87.56 -37.08 17.17 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 119.429 1.013 . . . . 0.0 110.911 167.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.6 77.45 5.67 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.647 1.179 . . . . 0.0 111.676 -177.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -163.78 139.16 4.97 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 125.219 1.408 . . . . 0.0 111.598 -171.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -51.46 -50.26 14.5 Favored 'Trans proline' 0 C--N 1.353 0.8 1 C-N-CA 125.677 4.251 . . . . 0.0 114.117 -172.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 45.7 m -91.83 -32.96 15.14 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 119.394 -0.336 . . . . 0.0 110.52 -172.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 74.1 mtm180 -68.74 -34.21 75.22 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 116.571 -1.68 . . . . 0.0 112.691 -177.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 45.9 t -55.13 -55.51 30.32 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 120.755 1.616 . . . . 0.0 110.637 168.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -48.07 -52.27 20.96 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.126 1.37 . . . . 0.0 112.47 172.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.5 mt -51.12 -58.83 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 CA-C-N 119.424 1.011 . . . . 0.0 111.234 174.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 93.4 mt -63.37 -41.84 98.82 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.222 1.009 . . . . 0.0 111.176 -169.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.7 p -75.98 -26.72 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.226 0.611 . . . . 0.0 112.399 178.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.61 -39.09 67.56 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 118.793 -0.622 . . . . 0.0 111.039 169.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.494 ' O ' HG13 ' B' ' 34' ' ' VAL . 2.1 tp -65.32 -26.62 68.13 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 -176.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 7.8 mt -45.95 -26.51 0.72 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 125.959 1.704 . . . . 0.0 112.205 168.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -113.64 -31.65 6.42 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 127.658 2.383 . . . . 0.0 111.522 167.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -82.51 15.57 29.26 Favored Glycine 0 C--N 1.335 0.477 0 C-N-CA 129.775 3.559 . . . . 0.0 115.204 -166.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . 0.494 HG13 ' O ' ' B' ' 30' ' ' LEU . 26.1 m -60.15 28.75 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.038 0 C-N-CA 126.111 1.765 . . . . 0.0 115.565 167.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.6 -73.11 0.46 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.434 1.494 . . . . 0.0 111.528 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 39.9 p90 -159.07 157.35 27.86 Favored Pre-proline 0 N--CA 1.474 0.726 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -169.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -57.29 121.27 9.76 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.628 2.218 . . . . 0.0 109.046 173.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.91 -5.66 83.2 Favored Glycine 0 CA--C 1.531 1.071 0 CA-C-O 117.572 -1.682 . . . . 0.0 115.024 -175.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . 0.536 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -57.67 -35.11 70.13 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 120.942 2.371 . . . . 0.0 111.402 172.114 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 23.0 mt -56.96 -25.33 57.69 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 125.216 1.406 . . . . 0.0 111.928 178.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.85 -32.75 73.12 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 121.883 -0.51 . . . . 0.0 111.461 -174.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.11 -49.12 18.26 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.486 0.714 . . . . 0.0 111.543 172.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . 0.536 ' CD2' HE22 ' B' ' 39' ' ' GLN . 2.8 m-70 -56.18 -32.92 64.78 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.217 1.191 . . . . 0.0 114.217 178.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 14.1 mt -104.02 -23.87 13.28 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.624 1.17 . . . . 0.0 113.118 -173.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.18 -6.67 49.24 Favored Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.533 1.063 . . . . 0.0 114.1 -171.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 10.6 mp -93.19 156.39 16.87 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.44 1.096 . . . . 0.0 109.539 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 71.2 p -71.91 154.7 41.05 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 122.448 1.118 . . . . 0.0 111.745 -170.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 -56.68 -25.34 53.68 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 114.875 -1.057 . . . . 0.0 112.099 169.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 15.3 m -71.82 -58.28 3.6 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.657 1.183 . . . . 0.0 110.633 169.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -53.27 -58.12 8.17 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.831 1.252 . . . . 0.0 111.676 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 88.7 t -63.33 -22.09 29.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 O-C-N 121.363 -0.836 . . . . 0.0 111.575 -175.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 50.1 m -68.69 -36.32 78.33 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 119.87 1.213 . . . . 0.0 113.93 178.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -56.72 -47.14 80.63 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 118.98 0.809 . . . . 0.0 111.61 169.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -63.69 -32.24 73.66 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.092 0.957 . . . . 0.0 112.621 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 43.4 mt -75.87 -32.92 59.93 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.084 1.354 . . . . 0.0 113.628 172.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 19.4 m -54.61 -39.02 67.47 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 120.292 1.405 . . . . 0.0 113.323 177.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 42.1 t -69.18 -47.86 63.76 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.524 1.056 . . . . 0.0 112.132 171.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.3 tp -58.25 -37.82 75.67 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.359 1.464 . . . . 0.0 112.0 -171.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 34.3 mtm105 -83.12 -7.03 59.69 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.842 1.657 . . . . 0.0 113.774 178.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -106.6 -37.95 2.32 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 125.558 1.551 . . . . 0.0 114.414 177.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 22.5 m -73.75 -13.54 60.97 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 124.928 1.291 . . . . 0.0 112.288 172.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.33 20.14 42.89 Favored Glycine 0 C--N 1.341 0.837 0 CA-C-O 118.355 -1.247 . . . . 0.0 114.572 172.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.05 -24.09 30.6 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 119.626 1.713 . . . . 0.0 113.825 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 3.5 m -127.72 147.28 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 124.336 1.054 . . . . 0.0 113.003 171.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 24.2 t -130.0 143.05 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 126.373 1.869 . . . . 0.0 110.808 -176.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.02 152.34 27.98 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.787 1.635 . . . . 0.0 112.936 174.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.9 m -161.02 172.26 17.2 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.393 1.477 . . . . 0.0 109.075 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -100.99 126.05 47.63 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 165.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.34 -14.38 59.02 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 114.474 1.287 . . . . 0.0 114.474 177.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 136.12 -26.77 3.08 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 126.201 1.858 . . . . 0.0 114.0 175.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 51.5 ttt-85 -136.42 -6.9 1.99 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.809 2.044 . . . . 0.0 112.977 174.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -150.36 160.23 43.88 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.17 2.188 . . . . 0.0 110.749 -178.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 33.6 m -82.4 148.02 5.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 O-C-N 121.509 -0.745 . . . . 0.0 110.565 169.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 3.0 ptt180 -132.52 167.99 19.02 Favored 'General case' 0 C--O 1.231 0.116 0 C-N-CA 125.43 1.492 . . . . 0.0 110.745 -171.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -112.16 160.58 17.44 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 164.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -160.28 150.61 18.37 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 120.742 -1.224 . . . . 0.0 111.257 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -49.94 129.65 20.71 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 169.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.23 0.41 2.8 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 -168.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -179.61 161.74 1.05 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 128.123 2.569 . . . . 0.0 110.644 169.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 43.4 m -48.35 -29.99 4.49 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.573 1.549 . . . . 0.0 111.797 168.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -49.08 -53.78 18.96 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 126.226 1.811 . . . . 0.0 113.526 171.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 13.3 mt -79.45 -41.41 27.62 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.919 -0.562 . . . . 0.0 109.818 -175.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.9 -36.11 59.03 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.033 0.533 . . . . 0.0 111.952 170.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 34.5 ttm-85 -75.93 -61.04 2.06 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-O 116.719 -1.61 . . . . 0.0 112.836 174.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.04 -20.74 66.28 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 122.5 2.409 . . . . 0.0 113.384 -176.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.15 -53.54 8.14 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.672 -0.643 . . . . 0.0 109.28 166.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.98 -28.36 70.65 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.374 1.464 . . . . 0.0 115.574 -171.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -78.38 -6.76 56.12 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.681 1.24 . . . . 0.0 112.051 169.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 30.6 tp 60.67 86.36 0.1 Allowed 'General case' 0 C--N 1.345 0.394 0 C-N-CA 127.623 2.369 . . . . 0.0 113.565 167.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.2 m -43.36 147.59 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 CA-C-O 122.667 1.222 . . . . 0.0 112.986 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . 0.481 ' C ' ' H ' ' B' ' 93' ' ' VAL . 20.1 mm-40 -68.54 6.62 0.78 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 117.021 2.23 . . . . 0.0 117.021 -163.054 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 6.1 p -66.28 32.11 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 126.476 1.911 . . . . 0.0 113.243 169.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . 0.481 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.4 OUTLIER 63.16 11.63 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 128.6 2.76 . . . . 0.0 114.359 171.499 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.6 tt 102.05 107.62 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 130.519 3.528 . . . . 0.0 105.35 -167.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.11 84.28 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.617 1.167 . . . . 0.0 111.812 174.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 4.5 t -55.86 133.15 19.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.138 0.975 . . . . 0.0 109.618 174.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -60.67 12.06 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 127.732 2.413 . . . . 0.0 115.578 176.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 29.8 p -67.27 135.89 54.07 Favored 'General case' 0 CA--C 1.519 -0.241 0 O-C-N 121.157 -0.964 . . . . 0.0 110.654 173.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -99.56 136.02 40.11 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 166.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.57 139.67 10.92 Favored Pre-proline 0 C--N 1.32 -0.702 0 N-CA-C 104.318 -2.475 . . . . 0.0 104.318 173.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -73.88 -173.12 1.28 Allowed 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.469 2.113 . . . . 0.0 112.059 -169.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 6.5 t -87.92 -161.51 0.73 Allowed 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 124.44 1.096 . . . . 0.0 111.695 177.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.6 t 62.58 32.99 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 125.434 1.494 . . . . 0.0 111.88 169.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . 0.475 ' HB2' ' HA3' ' A' ' 60' ' ' GLY . . . 71.38 -15.43 0.42 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 118.029 2.603 . . . . 0.0 118.029 169.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.55 179.74 0.15 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.306 1.842 . . . . 0.0 115.182 -170.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.472 0.641 0 O-C-N 121.307 -0.87 . . . . 0.0 111.556 170.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.616 0 CA-C-O 119.378 -0.344 . . . . 0.0 110.893 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.557 HD23 ' H ' ' A' ' 12' ' ' ALA . 1.1 pt? -51.67 -49.67 61.91 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 -169.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.557 ' H ' HD23 ' A' ' 11' ' ' LEU . . . -67.25 -18.72 65.34 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.661 1.584 . . . . 0.0 113.468 177.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.473 HH11 ' HG2' ' A' ' 13' ' ' ARG . 0.2 OUTLIER -86.11 -42.81 13.58 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 119.052 0.842 . . . . 0.0 109.421 167.738 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.55 -46.41 82.94 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.623 1.569 . . . . 0.0 112.25 -171.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.96 -18.39 68.7 Favored Glycine 0 CA--C 1.535 1.333 0 O-C-N 121.182 -0.949 . . . . 0.0 113.073 172.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 81.6 mtp180 -99.16 29.84 3.72 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 127.546 2.339 . . . . 0.0 111.314 170.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.93 -35.47 0.57 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.463 1.905 . . . . 0.0 111.898 169.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mt -95.78 -39.38 9.88 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 178.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -96.26 54.35 1.41 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.656 1.116 . . . . 0.0 109.54 170.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -132.42 138.28 31.82 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 126.933 2.093 . . . . 0.0 108.202 -168.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -52.61 -98.35 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.809 1 C-N-CA 126.66 4.907 . . . . 0.0 115.789 -164.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -57.95 -27.82 63.76 Favored 'General case' 0 C--O 1.223 -0.303 0 C-N-CA 125.571 1.548 . . . . 0.0 111.799 175.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.39 -36.04 63.5 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -174.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 14.1 t -65.85 -38.0 87.7 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.519 -1.363 . . . . 0.0 109.921 167.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -57.52 -38.55 74.84 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.056 0.942 . . . . 0.0 112.964 169.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.9 mm -62.11 -49.52 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 O-C-N 120.717 -1.24 . . . . 0.0 110.997 170.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 84.4 mt -58.61 -48.46 80.9 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.246 0.475 . . . . 0.0 112.157 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.2 p -68.51 -20.39 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 CA-C-N 118.986 0.812 . . . . 0.0 112.782 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.51 -16.84 60.24 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.351 1.061 . . . . 0.0 113.069 171.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.432 HD23 ' CG1' ' A' ' 64' ' ' VAL . 0.0 OUTLIER -93.39 -13.55 27.91 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 170.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.92 -20.92 64.3 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.211 163.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -116.99 -60.39 1.85 Allowed 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 127.456 2.302 . . . . 0.0 115.205 -177.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.37 -83.05 0.43 Allowed Glycine 0 C--N 1.343 0.948 0 C-N-CA 124.989 1.281 . . . . 0.0 114.313 -165.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.8 m 49.58 30.96 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 125.288 1.435 . . . . 0.0 113.768 178.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 1.6 m -77.81 -66.52 0.83 Allowed 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 178.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -140.88 156.63 68.57 Favored Pre-proline 0 C--O 1.238 0.465 0 CA-C-O 118.665 -0.683 . . . . 0.0 112.124 -169.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -59.13 115.37 2.52 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 122.509 2.139 . . . . 0.0 109.128 169.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 95.93 -0.88 62.84 Favored Glycine 0 CA--C 1.531 1.084 0 CA-C-O 117.552 -1.693 . . . . 0.0 115.93 -178.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.23 -30.47 71.53 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.949 2.374 . . . . 0.0 112.317 172.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.74 HD12 ' H ' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -56.5 -22.65 34.11 Favored 'General case' 0 C--O 1.222 -0.346 0 C-N-CA 124.431 1.093 . . . . 0.0 111.61 177.833 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.25 -36.99 79.03 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.482 0.713 . . . . 0.0 112.322 176.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.45 -38.06 74.43 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.372 0.533 . . . . 0.0 111.436 175.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -64.57 -38.12 89.92 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 175.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 32.9 mt -99.69 -14.67 18.82 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -172.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 64.8 25.36 70.49 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-O 118.717 -1.046 . . . . 0.0 112.281 -169.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 67.4 mt -126.95 134.53 50.38 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.266 1.027 . . . . 0.0 112.223 -176.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.3 p -50.18 156.81 0.75 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.101 1.36 . . . . 0.0 114.311 -168.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.6 ttm180 -53.24 -26.16 16.96 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.07 -1.423 . . . . 0.0 112.049 169.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.6 m -80.04 -47.23 15.2 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.063 -1.023 . . . . 0.0 111.778 175.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -60.07 -52.61 64.62 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.481 1.112 . . . . 0.0 110.266 176.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.4 t -58.84 -38.92 75.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 O-C-N 121.018 -1.051 . . . . 0.0 111.955 176.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 74.9 m -64.69 -39.72 94.15 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.916 1.234 . . . . 0.0 113.31 174.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -56.51 -52.55 64.32 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.676 0.79 . . . . 0.0 110.771 174.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 20.0 m80 -61.22 -39.77 91.53 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 48.7 mt -68.09 -25.85 65.53 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.171 -0.919 . . . . 0.0 112.968 175.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.4 t -59.42 -56.82 17.23 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 120.705 1.593 . . . . 0.0 113.637 -168.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 30.8 t -67.95 -28.78 67.76 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 122.209 -0.307 . . . . 0.0 111.764 172.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.4 tp -60.78 -35.42 76.4 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.915 0.886 . . . . 0.0 111.647 177.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 87.0 mtm-85 -74.83 -28.98 60.91 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.188 0.995 . . . . 0.0 112.026 172.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.39 -50.31 6.76 Favored Glycine 0 N--CA 1.472 1.072 0 CA-C-N 119.357 0.981 . . . . 0.0 113.129 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 18.2 m -67.53 -2.01 5.89 Favored 'General case' 0 CA--C 1.562 1.423 0 C-N-CA 126.826 2.05 . . . . 0.0 111.444 168.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.32 -0.62 16.23 Favored Glycine 0 C--N 1.343 0.959 0 C-N-CA 126.884 2.183 . . . . 0.0 115.191 173.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 77.5 mt -53.27 -25.67 15.39 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.13 1.772 . . . . 0.0 112.667 179.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.432 ' CG1' HD23 ' A' ' 30' ' ' LEU . 3.3 m -123.91 153.31 29.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 126.718 2.007 . . . . 0.0 109.641 164.045 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -142.32 155.28 18.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 C-N-CA 126.77 2.028 . . . . 0.0 109.891 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.6 151.93 28.8 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 122.706 1.241 . . . . 0.0 111.009 171.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.624 HG22 ' H ' ' A' ' 68' ' ' TYR . 8.0 m -158.11 -170.85 3.28 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 127.008 2.123 . . . . 0.0 105.959 173.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.624 ' H ' HG22 ' A' ' 67' ' ' THR . 47.6 m-85 -120.91 157.99 28.66 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 119.773 1.17 . . . . 0.0 113.418 174.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -110.49 -151.45 0.48 Allowed 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 126.641 1.976 . . . . 0.0 109.414 167.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.48 -12.49 56.22 Favored Glycine 0 CA--C 1.539 1.562 0 O-C-N 120.027 -1.671 . . . . 0.0 116.332 -172.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -164.54 -28.71 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.644 1.577 . . . . 0.0 113.307 173.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -99.48 170.64 8.47 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.801 1.64 . . . . 0.0 110.405 -177.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 26.0 m -80.81 160.87 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 O-C-N 121.92 -0.488 . . . . 0.0 111.54 168.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -126.61 171.78 10.83 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.394 1.877 . . . . 0.0 110.455 175.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -123.87 121.96 36.72 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.214 1.406 . . . . 0.0 107.963 167.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.13 167.53 17.44 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.866 1.266 . . . . 0.0 111.552 177.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 69.7 mt -60.61 156.7 15.98 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.573 0.749 . . . . 0.0 111.765 172.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.22 -51.36 68.35 Favored 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 125.948 1.699 . . . . 0.0 113.846 179.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -164.27 173.55 12.18 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 123.683 1.706 . . . . 0.0 114.258 -167.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 43.2 t -47.18 -42.42 19.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 113.168 -1.833 . . . . 0.0 113.308 170.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 55.9 m-70 -63.97 -42.47 97.25 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 116.938 -1.506 . . . . 0.0 113.478 -178.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 10.2 mt -71.9 -45.14 62.3 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 121.188 1.813 . . . . 0.0 109.846 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.99 -35.65 59.44 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.814 0.846 . . . . 0.0 111.782 175.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.401 ' HE ' ' CD ' ' A' ' 88' ' ' GLU . 0.4 OUTLIER -70.86 -67.27 0.52 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 128.398 2.679 . . . . 0.0 112.661 175.532 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.74 -30.25 70.43 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -173.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.04 -39.57 60.92 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.723 -0.611 . . . . 0.0 109.642 169.394 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -57.61 -45.06 93.64 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 125.897 1.713 . . . . 0.0 114.347 -178.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.401 ' CD ' ' HE ' ' A' ' 84' ' ' ARG . 2.0 pt-20 -87.84 3.76 47.09 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 174.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 39.0 tp 73.5 143.2 0.07 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 129.3 3.04 . . . . 0.0 111.64 177.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 31.2 m -38.25 -20.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 128.992 2.917 . . . . 0.0 116.367 176.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 86.82 -35.83 0.03 OUTLIER 'General case' 0 C--O 1.218 -0.594 0 C-N-CA 126.232 1.813 . . . . 0.0 108.963 161.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.521 HG21 ' CD2' ' B' ' 14' ' ' LEU . 8.7 p -62.62 36.67 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 128.915 2.886 . . . . 0.0 114.677 168.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.5 t 79.07 -25.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 128.7 2.8 . . . . 0.0 113.027 170.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 tt 110.59 99.05 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.636 1 C-N-CA 132.57 4.348 . . . . 0.0 104.582 -169.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.99 133.84 56.48 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 119.309 -0.377 . . . . 0.0 110.968 -178.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.1 t -74.76 137.14 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -166.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -60.68 -23.04 64.53 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.26 1.424 . . . . 0.0 114.72 173.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 59.0 p -64.82 117.08 7.01 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.382 1.073 . . . . 0.0 109.098 176.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -69.46 12.77 0.16 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.083 2.153 . . . . 0.0 114.447 -175.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 -74.16 159.29 84.21 Favored Pre-proline 0 CA--C 1.541 0.616 0 C-N-CA 125.674 1.59 . . . . 0.0 113.424 -167.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.85 135.92 43.23 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.376 2.718 . . . . 0.0 110.965 169.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 20.5 p -55.75 -45.59 78.0 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.833 0.853 . . . . 0.0 110.816 168.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 7.7 p 167.06 -31.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 131.329 3.852 . . . . 0.0 111.513 175.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.32 7.44 2.83 Favored 'General case' 0 CA--C 1.552 1.05 0 N-CA-C 115.262 1.578 . . . . 0.0 115.262 -174.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -142.66 162.0 36.61 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 127.246 2.218 . . . . 0.0 108.744 -177.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.581 0 O-C-N 121.161 -0.962 . . . . 0.0 111.346 169.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.508 0 CA-C-O 119.623 -0.227 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.551 HD23 ' H ' ' B' ' 12' ' ' ALA . 1.2 pt? -50.12 -53.32 28.22 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.687 1.195 . . . . 0.0 113.65 -171.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.551 ' H ' HD23 ' B' ' 11' ' ' LEU . . . -63.29 -21.9 66.54 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.541 1.536 . . . . 0.0 114.202 176.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . 0.534 HH11 ' HG2' ' B' ' 13' ' ' ARG . 1.3 mmt-85 -84.03 -41.11 17.58 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 119.607 1.094 . . . . 0.0 111.723 170.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.521 ' CD2' HG21 ' A' ' 92' ' ' VAL . 3.1 tm? -57.98 -52.73 64.31 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.709 1.604 . . . . 0.0 111.114 177.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.39 -22.48 69.45 Favored Glycine 0 CA--C 1.533 1.177 0 O-C-N 121.884 -0.51 . . . . 0.0 112.715 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 72.3 mtp180 -87.47 14.05 8.89 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 126.212 1.805 . . . . 0.0 112.508 173.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -125.19 -37.58 2.39 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.845 1.258 . . . . 0.0 112.354 168.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 24.5 mt -88.88 -25.75 21.97 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.541 -1.218 . . . . 0.0 113.078 178.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -115.9 55.16 0.8 Allowed 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 120.977 1.717 . . . . 0.0 110.705 168.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -133.43 143.9 49.99 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 127.587 2.355 . . . . 0.0 106.678 -174.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -57.54 -98.98 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.945 1 C-N-CA 125.698 4.266 . . . . 0.0 115.7 -163.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 1.3 p -53.08 -32.92 49.69 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.515 1.926 . . . . 0.0 112.42 172.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.84 -43.85 62.12 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.687 0.795 . . . . 0.0 112.906 -170.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 46.8 t -63.38 -39.26 94.04 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.193 0.906 . . . . 0.0 109.455 168.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -55.92 -33.24 64.5 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 120.582 -1.324 . . . . 0.0 113.973 171.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . 0.411 HG23 HD13 ' B' ' 40' ' ' LEU . 1.6 mm -62.06 -48.76 86.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 CA-C-N 120.23 1.377 . . . . 0.0 110.061 169.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 89.6 mt -58.56 -45.01 89.86 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.957 0.799 . . . . 0.0 112.066 176.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . 0.678 HG22 HD21 ' B' ' 86' ' ' LEU . 51.8 t -61.38 -47.25 94.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 126.424 1.889 . . . . 0.0 110.847 179.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.52 -36.21 63.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.89 0.876 . . . . 0.0 112.298 -177.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 16.6 tp -66.17 -35.35 80.24 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 117.486 -1.245 . . . . 0.0 112.103 -178.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -37.14 -45.71 0.64 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 129.492 3.117 . . . . 0.0 113.91 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -105.34 -16.96 14.6 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.065 1.746 . . . . 0.0 113.165 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.28 -71.42 1.23 Allowed Glycine 0 C--N 1.341 0.85 0 C-N-CA 124.658 1.123 . . . . 0.0 112.329 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . 0.454 HG12 ' HA ' ' B' ' 76' ' ' ALA . 34.6 m 33.45 36.43 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 -170.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.93 -76.27 0.3 Allowed 'General case' 0 N--CA 1.466 0.362 0 O-C-N 121.357 -0.84 . . . . 0.0 111.553 -177.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -145.74 158.15 50.11 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-O 118.648 -0.692 . . . . 0.0 112.82 -168.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -58.62 123.14 12.91 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.919 2.413 . . . . 0.0 110.162 172.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 88.19 -3.83 85.52 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 117.575 -1.68 . . . . 0.0 115.449 -174.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -32.82 71.08 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 120.493 2.146 . . . . 0.0 111.87 174.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.411 HD13 HG23 ' B' ' 26' ' ' ILE . 2.1 mt -59.52 -15.74 20.05 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 123.716 0.806 . . . . 0.0 112.246 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.9 -41.76 87.98 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.57 0.623 . . . . 0.0 111.159 175.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -75.57 -30.35 59.63 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.512 0.725 . . . . 0.0 112.418 176.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -69.01 -33.97 74.5 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 171.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 23.9 mt -106.59 -14.57 15.01 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -170.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.33 16.95 69.85 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-N 119.136 0.88 . . . . 0.0 113.008 -169.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 36.7 mt -117.65 139.63 50.74 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 118.506 1.153 . . . . 0.0 111.6 -175.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.2 p -59.67 161.68 5.92 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.388 0.675 . . . . 0.0 111.933 -172.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 20.7 ttm180 -58.61 -29.08 66.2 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 122.056 -0.403 . . . . 0.0 111.938 175.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 20.3 m -69.81 -46.07 66.5 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.386 0.994 . . . . 0.0 111.622 175.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -61.94 -55.19 32.02 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 122.821 0.449 . . . . 0.0 110.128 173.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.8 t -56.26 -40.73 67.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 121.002 -1.061 . . . . 0.0 112.976 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 49.7 m -66.17 -37.93 86.83 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.663 1.12 . . . . 0.0 112.865 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -55.54 -49.97 71.25 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.93 0.786 . . . . 0.0 110.89 172.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 20.6 m80 -64.17 -37.44 87.45 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 26.1 mt -73.27 -27.33 61.5 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 117.599 -1.191 . . . . 0.0 113.441 175.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.1 t -50.65 -63.71 1.04 Allowed 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 119.293 0.951 . . . . 0.0 112.608 -169.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.7 t -66.76 -33.79 76.41 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.541 0.736 . . . . 0.0 111.66 174.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 3.6 tp -53.34 -33.92 55.46 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.29 1.036 . . . . 0.0 112.47 178.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 79.9 mtm-85 -83.16 -21.54 33.51 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 173.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -80.73 -47.43 6.71 Favored Glycine 0 N--CA 1.475 1.273 0 CA-C-N 120.228 1.376 . . . . 0.0 111.825 176.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 3.3 m -62.93 -11.29 17.6 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.961 2.104 . . . . 0.0 112.388 168.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 59.65 28.09 64.83 Favored Glycine 0 C--N 1.345 1.083 0 C-N-CA 125.818 1.675 . . . . 0.0 113.477 -178.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 93.0 mt -73.15 -24.73 60.62 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 117.918 0.859 . . . . 0.0 111.167 168.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 4.5 m -130.28 159.68 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 C-N-CA 126.108 1.763 . . . . 0.0 110.284 168.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -145.5 155.44 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 126.016 1.726 . . . . 0.0 110.266 -172.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.28 150.77 24.55 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.073 1.349 . . . . 0.0 111.53 172.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 10.6 m -158.99 168.83 25.74 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 176.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -102.67 142.62 33.51 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.349 0.977 . . . . 0.0 111.197 168.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.261 1.6 pp20? -99.52 -155.74 0.52 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.35 1.06 . . . . 0.0 109.435 166.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -67.09 -14.95 64.49 Favored Glycine 0 CA--C 1.535 1.341 0 O-C-N 120.176 -1.577 . . . . 0.0 115.46 -171.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -159.19 -20.85 0.07 Allowed 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 118.95 1.375 . . . . 0.0 114.433 174.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -111.93 162.36 15.41 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.975 2.11 . . . . 0.0 110.994 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 17.6 m -82.1 152.4 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 O-C-N 121.468 -0.77 . . . . 0.0 109.377 167.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -129.15 168.67 15.8 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 122.594 1.188 . . . . 0.0 109.643 -178.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -113.16 148.2 35.86 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 164.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.454 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -149.55 157.8 43.6 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.307 1.043 . . . . 0.0 110.285 176.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -53.14 151.83 4.73 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.988 0.915 . . . . 0.0 110.651 168.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -49.66 -52.35 31.47 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.535 1.134 . . . . 0.0 113.775 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.35 179.81 3.76 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 122.818 1.294 . . . . 0.0 113.896 -167.115 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 24.5 t -49.3 -43.96 43.76 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.054 -1.43 . . . . 0.0 113.25 170.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -62.06 -48.42 80.31 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 117.664 -1.16 . . . . 0.0 112.926 -178.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 15.8 mt -68.72 -38.89 80.54 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 120.615 1.552 . . . . 0.0 109.954 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.35 -32.24 73.61 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.535 0.607 . . . . 0.0 110.994 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -69.56 -70.13 0.3 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 128.462 2.705 . . . . 0.0 110.936 171.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.72 -33.44 61.08 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 120.803 1.638 . . . . 0.0 114.555 -178.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.678 HD21 HG22 ' B' ' 28' ' ' VAL . 1.4 tt -77.65 -39.93 43.41 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 121.322 -0.861 . . . . 0.0 111.123 173.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.12 -46.77 90.23 Favored Glycine 0 CA--C 1.535 1.323 0 C-N-CA 125.634 1.588 . . . . 0.0 114.41 -173.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 12.8 pm0 -84.08 -0.49 52.05 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 119.255 1.528 . . . . 0.0 113.499 168.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 33.8 tp 72.85 135.35 0.05 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 129.563 3.145 . . . . 0.0 111.504 177.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 97.5 t -62.79 8.62 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 129.225 3.01 . . . . 0.0 113.716 -176.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 93.4 -35.85 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.611 -1.306 . . . . 0.0 110.82 129.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 7.7 p -56.48 35.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.043 1 C-N-CA 132.628 4.371 . . . . 0.0 115.626 171.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER 67.15 6.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.876 0 C-N-CA 126.698 1.999 . . . . 0.0 112.836 176.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 tt 78.54 105.4 0.07 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.762 2.425 . . . . 0.0 107.631 -168.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.92 128.02 35.01 Favored 'General case' 0 CA--C 1.551 1.007 0 O-C-N 121.563 -0.711 . . . . 0.0 110.336 174.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 2.5 t -84.87 139.43 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -164.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -60.33 -16.68 37.1 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.579 1.552 . . . . 0.0 115.127 173.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 41.7 p -68.75 106.11 2.54 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.495 1.118 . . . . 0.0 109.697 175.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -64.83 13.3 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 128.134 2.574 . . . . 0.0 114.9 178.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 89.8 mm-40 -74.47 161.97 75.77 Favored Pre-proline 0 CA--C 1.547 0.858 0 C-N-CA 127.096 2.158 . . . . 0.0 114.668 -167.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.45 130.73 20.24 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 124.681 3.587 . . . . 0.0 112.527 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 24.2 p -72.01 -41.54 67.45 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.212 1.005 . . . . 0.0 112.369 175.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 8.0 p 155.67 -41.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.066 1 C-N-CA 132.922 4.489 . . . . 0.0 112.234 169.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.99 -10.99 59.99 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -177.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.14 137.88 51.46 Favored 'General case' 0 N--CA 1.437 -1.107 0 C-N-CA 124.313 1.045 . . . . 0.0 108.559 168.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.444 0 C-N-CA 124.127 0.971 . . . . 0.0 111.635 178.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.774 0 N-CA-C 114.867 1.432 . . . . 0.0 114.867 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.9 mt -43.26 -54.58 4.49 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.69 1.196 . . . . 0.0 113.862 -168.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.45 -41.62 98.63 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -177.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -53.91 -51.05 64.98 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.668 1.187 . . . . 0.0 110.633 172.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.73 -47.18 73.11 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.759 1.223 . . . . 0.0 113.001 -178.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -66.61 -40.95 94.23 Favored Glycine 0 N--CA 1.473 1.133 0 CA-C-N 120.301 1.41 . . . . 0.0 111.303 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -40.4 92.18 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.15 1.38 . . . . 0.0 110.763 172.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.6 -3.18 4.21 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 114.725 1.379 . . . . 0.0 114.725 175.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.9 mp -115.29 -35.63 4.59 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.836 1.254 . . . . 0.0 111.836 166.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.91 98.93 11.89 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 128.113 2.565 . . . . 0.0 111.929 -176.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -161.66 172.13 5.99 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 127.421 2.288 . . . . 0.0 108.971 -169.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -74.27 -119.71 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 124.927 3.751 . . . . 0.0 110.482 172.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 68.4 m -50.15 -28.96 8.19 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 126.732 2.013 . . . . 0.0 113.227 176.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.94 -24.93 64.33 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 120.093 1.315 . . . . 0.0 113.479 174.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 30.0 t -74.23 -45.0 50.87 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 121.185 -0.947 . . . . 0.0 109.251 166.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.44 -44.75 76.61 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.498 -0.751 . . . . 0.0 112.726 173.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 7.2 mm -50.06 -51.24 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 CA-C-N 119.984 1.265 . . . . 0.0 110.714 169.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 25.5 mt -59.67 -45.34 92.36 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 117.249 -1.358 . . . . 0.0 112.87 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.5 m -66.55 -28.05 42.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 CA-C-N 121.267 1.849 . . . . 0.0 111.862 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.23 -20.0 45.62 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.057 1.343 . . . . 0.0 112.932 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 77.2 mt -63.02 -49.45 74.6 Favored 'General case' 0 N--CA 1.469 0.489 0 O-C-N 121.075 -1.015 . . . . 0.0 111.017 170.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -46.41 -53.48 10.97 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 129.304 3.042 . . . . 0.0 112.56 -169.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -105.72 22.79 14.95 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 127.444 2.298 . . . . 0.0 111.272 177.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.68 -84.7 0.96 Allowed Glycine 0 C--N 1.34 0.758 0 C-N-CA 126.456 1.979 . . . . 0.0 112.633 -178.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.474 HG12 ' HA ' ' A' ' 76' ' ' ALA . 23.7 m 30.71 39.2 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 127.245 2.218 . . . . 0.0 116.557 -171.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 34.6 m -89.52 -76.72 0.41 Allowed 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.236 -0.915 . . . . 0.0 112.718 -177.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -137.51 164.24 42.94 Favored Pre-proline 0 CA--C 1.546 0.813 0 CA-C-O 118.454 -0.784 . . . . 0.0 111.515 -174.28 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -66.3 -20.23 55.54 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.583 2.188 . . . . 0.0 114.379 -167.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.55 8.24 43.57 Favored Glycine 0 CA--C 1.535 1.302 0 CA-C-O 118.388 -1.229 . . . . 0.0 115.028 171.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -28.97 67.25 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 120.189 1.995 . . . . 0.0 113.899 -170.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.74 -18.38 59.52 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.359 0.664 . . . . 0.0 111.723 -177.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.52 -32.96 71.96 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.133 0.973 . . . . 0.0 112.249 174.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.5 -41.49 46.8 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.209 0.604 . . . . 0.0 111.478 176.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -63.63 -40.13 96.1 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 175.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 28.6 mt -92.62 -22.83 19.25 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -174.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.81 8.72 82.54 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 123.961 0.791 . . . . 0.0 112.644 -169.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 86.3 mt -103.73 152.01 22.34 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.305 1.442 . . . . 0.0 110.919 -171.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.5 p -63.94 154.53 33.66 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.543 0.737 . . . . 0.0 111.442 -171.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -56.88 -31.36 64.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 176.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.9 m -69.42 -49.69 52.8 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 123.883 0.873 . . . . 0.0 111.473 172.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -63.32 -37.11 86.0 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 119.133 0.879 . . . . 0.0 113.099 177.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.3 t -63.64 -50.78 76.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 C-N-CA 123.907 0.883 . . . . 0.0 111.381 169.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.3 m -63.48 -35.65 81.14 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 119.225 0.921 . . . . 0.0 113.212 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 43.8 m-20 -49.21 -37.15 21.93 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 125.726 1.611 . . . . 0.0 111.998 170.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 53.1 m-70 -100.58 2.99 42.32 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 115.505 1.668 . . . . 0.0 115.505 176.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 87.4 mt -92.07 -31.65 15.46 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.807 1.185 . . . . 0.0 111.754 165.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.8 t -45.98 -59.27 2.94 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -170.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 10.6 t -76.45 -21.08 56.37 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.6 tp -61.18 -36.36 79.65 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.613 1.165 . . . . 0.0 110.931 177.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 55.6 mtm180 -79.94 -20.29 46.0 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.147 1.379 . . . . 0.0 112.41 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.8 -41.39 4.7 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 124.984 1.278 . . . . 0.0 114.227 -177.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 58.5 m -74.8 -3.48 31.99 Favored 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 124.615 1.166 . . . . 0.0 112.305 170.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 92.04 -4.03 77.6 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 126.008 1.766 . . . . 0.0 116.312 169.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 78.4 mt -64.25 -28.99 70.11 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 120.582 2.191 . . . . 0.0 114.77 -173.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -122.12 132.45 70.97 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.406 0 C-N-CA 124.629 1.172 . . . . 0.0 110.455 175.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.8 t -120.66 133.23 68.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 C-N-CA 125.828 1.651 . . . . 0.0 107.971 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.98 144.5 50.47 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 122.953 1.359 . . . . 0.0 112.16 172.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 m -156.98 157.7 35.23 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 126.47 1.908 . . . . 0.0 106.405 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -91.83 135.33 34.0 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.929 1.241 . . . . 0.0 112.458 176.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.69 -11.95 59.83 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.156 0.582 . . . . 0.0 110.773 164.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 126.68 -44.45 1.24 Allowed Glycine 0 C--N 1.346 1.09 0 C-N-CA 126.831 2.158 . . . . 0.0 112.859 169.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.0 mtp-105 -92.6 -22.11 19.67 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.85 2.86 . . . . 0.0 111.502 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -156.66 168.48 27.29 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 127.525 2.33 . . . . 0.0 109.087 -169.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 33.3 m -85.15 158.08 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 123.436 0.694 . . . . 0.0 110.828 168.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -129.57 162.39 28.33 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 128.518 2.727 . . . . 0.0 109.0 172.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -108.06 110.95 22.77 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 168.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.474 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -109.88 145.98 35.9 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 123.901 0.88 . . . . 0.0 110.399 -179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 45.6 mt -56.11 145.34 26.21 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 123.17 0.294 . . . . 0.0 110.208 169.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.2 -32.77 73.22 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -167.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -155.82 159.81 39.71 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.639 1.976 . . . . 0.0 111.033 168.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.2 p -45.27 -30.47 1.25 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 128.534 2.733 . . . . 0.0 114.176 168.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -54.41 -45.97 73.07 Favored 'General case' 0 C--N 1.341 0.216 0 C-N-CA 125.01 1.324 . . . . 0.0 112.652 172.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 11.2 mt -74.08 -45.36 49.81 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 118.527 -0.749 . . . . 0.0 109.645 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.97 -31.53 60.81 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.157 0.983 . . . . 0.0 112.459 175.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.5 mtt-85 -72.44 -64.03 1.03 Allowed 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 125.194 1.398 . . . . 0.0 113.379 174.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.56 -12.23 59.9 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 120.429 1.468 . . . . 0.0 112.592 -176.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 60.2 tp -75.78 -53.27 8.76 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.245 1.818 . . . . 0.0 110.155 164.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.22 -41.15 8.13 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 128.183 2.802 . . . . 0.0 117.947 -168.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.47 -22.39 66.86 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 119.105 1.453 . . . . 0.0 111.274 169.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 35.6 tp 68.94 128.48 0.03 OUTLIER 'General case' 0 C--N 1.344 0.363 0 C-N-CA 129.657 3.183 . . . . 0.0 114.223 165.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.492 HG23 HG12 ' A' ' 92' ' ' VAL . 3.6 m -53.19 140.86 8.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-O 122.566 1.174 . . . . 0.0 109.849 174.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -74.78 -4.95 40.69 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -162.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.492 HG12 HG23 ' A' ' 90' ' ' VAL . 2.4 p -62.31 23.89 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 C-N-CA 127.585 2.354 . . . . 0.0 115.722 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.7 t 73.85 8.51 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 C-N-CA 126.7 2.0 . . . . 0.0 112.23 167.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 tt 82.56 93.52 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 128.676 2.79 . . . . 0.0 108.609 -170.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.77 160.29 32.87 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.595 0.758 . . . . 0.0 112.616 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 58.4 t -65.29 144.94 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 124.648 1.179 . . . . 0.0 111.914 173.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -66.28 49.53 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 127.22 2.208 . . . . 0.0 114.773 169.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.8 p -122.49 165.39 16.45 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.853 1.661 . . . . 0.0 112.422 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -118.59 138.38 52.61 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 112.906 -1.952 . . . . 0.0 106.366 163.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 70.0 mm-40 -155.53 150.64 20.89 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 127.581 2.352 . . . . 0.0 107.476 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.47 149.33 84.57 Favored 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 122.481 2.12 . . . . 0.0 116.025 -167.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 34.5 t -110.87 105.48 14.3 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 127.29 2.236 . . . . 0.0 108.475 175.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 12.0 p -178.71 -44.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 126.955 2.102 . . . . 0.0 111.94 -169.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . 65.13 -10.51 0.17 Allowed 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 117.711 2.486 . . . . 0.0 117.711 177.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.5 tm-20 -77.42 -35.61 53.97 Favored 'General case' 0 N--CA 1.442 -0.86 0 O-C-N 123.086 0.241 . . . . 0.0 111.358 166.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.227 -0.102 0 O-C-N 121.621 -0.675 . . . . 0.0 112.406 -177.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.809 0 N-CA-C 114.833 1.419 . . . . 0.0 114.833 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 12.1 mt -45.16 -47.47 12.34 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.137 1.375 . . . . 0.0 114.168 -169.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.02 -48.35 76.66 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.98 0.912 . . . . 0.0 111.901 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 -51.35 -50.06 60.23 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.022 1.329 . . . . 0.0 110.996 177.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -65.34 -52.59 52.82 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.395 1.078 . . . . 0.0 111.955 -175.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.81 -29.73 73.94 Favored Glycine 0 CA--C 1.527 0.823 0 CA-C-O 119.098 -0.834 . . . . 0.0 112.806 -178.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.73 -37.65 73.49 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 118.495 1.148 . . . . 0.0 110.758 174.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.31 -29.36 70.7 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 118.174 -0.917 . . . . 0.0 112.749 176.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 mp -93.0 -34.69 13.63 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 175.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -90.77 92.02 8.62 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.723 1.209 . . . . 0.0 110.606 -178.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -169.11 141.12 2.07 Favored Pre-proline 0 N--CA 1.47 0.575 0 C-N-CA 127.487 2.315 . . . . 0.0 107.361 -169.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . 0.414 ' HG2' ' H ' ' B' ' 22' ' ' THR . 58.8 Cg_endo -45.74 -82.07 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.848 1 C-N-CA 125.475 4.117 . . . . 0.0 113.272 -167.647 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.43 ' HB ' ' CD2' ' B' ' 54' ' ' HIS . 29.5 m -85.32 -22.39 28.53 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.777 1.231 . . . . 0.0 111.179 -173.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.47 ' HG2' HD13 ' B' ' 58' ' ' LEU . 24.5 ttp-105 -68.38 -37.35 80.32 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 120.779 1.627 . . . . 0.0 112.274 176.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 40.2 t -57.52 -46.84 83.34 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 167.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.29 -41.06 96.32 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 117.895 -1.05 . . . . 0.0 113.47 178.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 5.4 mm -57.47 -45.7 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 CA-C-N 120.903 1.683 . . . . 0.0 110.767 171.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 85.6 mt -60.78 -49.83 75.91 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 118.008 -0.996 . . . . 0.0 111.378 175.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 m -65.36 -31.04 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 CA-C-N 119.481 1.037 . . . . 0.0 111.951 -177.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.07 -26.67 48.3 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.412 1.085 . . . . 0.0 111.611 178.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 tp -66.49 -40.67 89.4 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-O 117.647 -1.168 . . . . 0.0 112.712 168.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.49 -53.42 11.26 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 127.357 2.263 . . . . 0.0 112.168 -179.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -102.76 25.69 8.92 Favored 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 127.903 2.481 . . . . 0.0 111.334 177.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -126.01 -91.43 0.82 Allowed Glycine 0 N--CA 1.465 0.596 0 C-N-CA 127.52 2.486 . . . . 0.0 111.676 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . 0.525 HG12 ' HA ' ' B' ' 76' ' ' ALA . 23.6 m 39.25 30.27 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 126.272 1.829 . . . . 0.0 114.12 -165.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 80.6 m -82.46 -150.83 0.09 Allowed 'General case' 0 N--CA 1.438 -1.059 0 CA-C-O 123.872 1.796 . . . . 0.0 107.617 168.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.64 162.2 75.4 Favored Pre-proline 0 C--N 1.311 -1.068 0 O-C-N 120.801 -1.187 . . . . 0.0 113.846 -166.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -61.1 -15.78 41.67 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.261 2.641 . . . . 0.0 114.9 -177.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.66 0.97 45.59 Favored Glycine 0 CA--C 1.536 1.396 0 CA-C-O 118.663 -1.076 . . . . 0.0 115.356 170.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . 0.5 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -63.5 -31.51 72.7 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.353 1.577 . . . . 0.0 113.783 -169.337 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mt -64.48 -16.98 63.41 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 123.803 0.841 . . . . 0.0 111.692 -176.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.89 -28.17 69.66 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.279 0.49 . . . . 0.0 112.22 173.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.04 -52.1 9.92 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.352 0.661 . . . . 0.0 111.069 171.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . 0.5 ' CD2' HE22 ' B' ' 39' ' ' GLN . 8.0 m-70 -58.77 -36.33 74.22 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 22.3 mt -98.11 -15.88 19.78 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -175.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.34 6.06 31.83 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-N 119.252 0.933 . . . . 0.0 113.345 -170.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 79.9 mt -102.2 156.6 17.46 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.81 1.244 . . . . 0.0 111.163 -172.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 31.0 p -65.48 154.69 37.82 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.034 0.534 . . . . 0.0 110.939 -170.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -55.34 -27.8 49.53 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.206 0.602 . . . . 0.0 112.181 171.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 4.1 m -70.42 -53.63 15.68 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.056 0.943 . . . . 0.0 111.032 171.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -58.2 -43.65 87.71 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 124.227 1.011 . . . . 0.0 112.232 177.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 7.7 t -60.68 -44.27 96.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 124.847 1.259 . . . . 0.0 111.947 170.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 65.0 m -64.19 -38.44 91.05 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 120.49 1.495 . . . . 0.0 112.968 175.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -57.01 -57.99 10.12 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.32 1.448 . . . . 0.0 110.611 176.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . 0.43 ' CD2' ' HB ' ' B' ' 22' ' ' THR . 63.4 m-70 -74.39 -18.81 60.61 Favored 'General case' 0 CA--C 1.553 1.068 0 CA-C-O 118.219 -0.896 . . . . 0.0 113.099 -179.4 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 28.7 mt -71.53 -37.92 71.12 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 121.059 1.754 . . . . 0.0 113.009 167.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 18.9 m -53.32 -52.66 58.44 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 120.652 1.569 . . . . 0.0 114.708 -171.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 3.3 t -68.56 -24.44 64.62 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 119.635 1.107 . . . . 0.0 112.924 -179.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.47 HD13 ' HG2' ' B' ' 23' ' ' ARG . 5.4 tp -70.08 -43.06 71.91 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 127.057 2.143 . . . . 0.0 110.845 177.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 70.4 mtm180 -81.83 -9.67 59.54 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.934 1.694 . . . . 0.0 112.255 176.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.61 -52.68 2.42 Favored Glycine 0 C--N 1.34 0.776 0 C-N-CA 124.583 1.087 . . . . 0.0 111.314 174.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 91.0 m -76.53 0.45 19.92 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 125.635 1.574 . . . . 0.0 115.124 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.22 29.6 49.56 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.414 1.007 . . . . 0.0 114.666 174.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 86.9 mt -89.06 -24.52 22.28 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.251 -1.146 . . . . 0.0 113.007 172.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 5.8 m -136.71 150.39 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.221 1.409 . . . . 0.0 111.618 176.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 60.0 t -141.43 140.81 31.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 125.182 1.393 . . . . 0.0 110.381 -169.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -77.75 141.42 39.3 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.136 0.969 . . . . 0.0 112.146 175.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.8 m -162.33 167.3 24.03 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 126.689 1.996 . . . . 0.0 107.262 -173.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -90.91 149.04 22.06 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 120.885 1.675 . . . . 0.0 113.143 172.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -99.55 11.27 39.61 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 125.687 1.595 . . . . 0.0 110.078 165.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 81.76 -56.05 4.91 Favored Glycine 0 C--N 1.343 0.926 0 C-N-CA 126.061 1.791 . . . . 0.0 111.196 -176.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 22.5 mtp-105 -69.51 -21.14 63.69 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.845 1.658 . . . . 0.0 113.523 178.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -174.43 173.33 2.98 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 128.243 2.617 . . . . 0.0 108.788 -167.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 3.4 m -79.13 162.04 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 C-N-CA 123.616 0.766 . . . . 0.0 109.736 166.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 22.1 ptt180 -147.35 164.7 32.45 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.88 1.272 . . . . 0.0 111.694 -178.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -106.11 120.89 42.98 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 165.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.525 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -114.1 153.17 29.95 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 125.008 1.323 . . . . 0.0 110.947 177.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 77.9 mt -59.06 148.81 29.64 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.477 0.58 . . . . 0.0 110.02 169.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -74.52 -9.57 58.71 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 115.91 1.819 . . . . 0.0 115.91 -169.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -177.32 157.91 1.39 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.897 2.879 . . . . 0.0 110.865 168.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 98.0 p -44.78 -32.51 1.57 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 128.517 2.727 . . . . 0.0 114.065 166.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -54.96 -47.05 75.04 Favored 'General case' 0 C--N 1.343 0.288 0 C-N-CA 124.361 1.064 . . . . 0.0 112.202 171.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 16.4 mt -70.83 -44.3 66.78 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 118.402 -0.809 . . . . 0.0 109.135 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.9 -35.24 57.84 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.557 0.743 . . . . 0.0 112.501 177.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 3.5 mtt-85 -71.74 -63.26 1.16 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.25 1.02 . . . . 0.0 113.624 174.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.63 -19.07 65.48 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.474 1.488 . . . . 0.0 112.852 -175.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 56.0 tp -72.86 -49.37 30.5 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.177 1.791 . . . . 0.0 111.005 167.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -82.24 -40.74 9.88 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 128.221 2.82 . . . . 0.0 116.758 -168.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -64.51 -23.48 67.29 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.429 1.614 . . . . 0.0 111.48 169.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 37.2 tp 70.56 132.03 0.03 OUTLIER 'General case' 0 C--N 1.344 0.354 0 C-N-CA 129.719 3.208 . . . . 0.0 113.675 167.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . 0.458 HG23 HG12 ' B' ' 92' ' ' VAL . 3.2 m -53.38 138.12 13.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-O 122.61 1.195 . . . . 0.0 110.173 176.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -69.72 -10.46 58.39 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 115.659 1.726 . . . . 0.0 115.659 -163.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.458 HG12 HG23 ' B' ' 90' ' ' VAL . 2.6 p -62.79 24.35 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 127.244 2.218 . . . . 0.0 115.632 -177.402 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.7 t 71.23 11.47 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 C-N-CA 125.073 1.349 . . . . 0.0 111.622 168.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.8 tt 77.99 99.89 0.07 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 128.859 2.863 . . . . 0.0 109.342 -170.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -76.48 160.03 29.86 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.785 0.834 . . . . 0.0 112.732 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 57.5 t -57.22 143.96 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 124.795 1.238 . . . . 0.0 110.32 170.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 22.8 p30 -76.3 50.17 0.62 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.989 1.716 . . . . 0.0 112.904 173.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 6.3 p -119.22 163.38 17.18 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.147 1.779 . . . . 0.0 111.96 174.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -113.62 137.35 51.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 112.818 -1.992 . . . . 0.0 106.915 164.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -155.94 150.92 20.77 Favored Pre-proline 0 CA--C 1.545 0.754 0 C-N-CA 127.023 2.129 . . . . 0.0 109.051 -173.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -70.7 154.35 64.06 Favored 'Trans proline' 0 CA--C 1.534 0.481 0 C-N-CA 123.374 2.716 . . . . 0.0 116.353 -166.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 33.7 t -106.02 124.13 49.09 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 127.438 2.295 . . . . 0.0 106.707 168.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 6.5 p 166.21 -38.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 C-N-CA 127.242 2.217 . . . . 0.0 111.261 -168.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . 73.19 -48.67 0.69 Allowed 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 127.565 2.346 . . . . 0.0 114.375 -177.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -81.91 -32.57 30.87 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -166.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? . . . . . 0 N--CA 1.465 0.299 0 O-C-N 121.402 -0.811 . . . . 0.0 109.573 169.289 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.723 0 CA-C-O 118.766 -0.635 . . . . 0.0 109.452 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 88.7 mt -35.89 -39.34 0.15 Allowed 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 127.601 2.361 . . . . 0.0 115.297 -178.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -45.89 -30.38 1.71 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.229 1.812 . . . . 0.0 114.824 174.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.5 mmt85 -68.09 -36.11 79.25 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 116.253 -1.832 . . . . 0.0 113.428 174.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -62.27 -48.29 80.59 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 121.807 2.094 . . . . 0.0 111.043 -179.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.27 -40.03 98.55 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 111.728 -0.549 . . . . 0.0 111.728 176.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.2 ttt180 -62.55 -33.93 75.91 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.737 0.815 . . . . 0.0 111.413 170.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.05 -19.31 64.87 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.29 1.405 . . . . 0.0 112.302 175.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.4 mp -92.21 -28.07 17.27 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.417 1.008 . . . . 0.0 112.964 169.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -100.53 -12.57 19.18 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 -172.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -56.77 140.55 75.59 Favored Pre-proline 0 CA--C 1.549 0.93 0 CA-C-N 119.922 1.237 . . . . 0.0 107.989 168.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -52.83 -77.2 0.02 OUTLIER 'Trans proline' 0 CA--C 1.533 0.432 1 C-N-CA 126.36 4.707 . . . . 0.0 112.076 -167.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.9 m -58.84 -26.35 64.1 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-O 117.513 -1.232 . . . . 0.0 111.775 177.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.6 mtt85 -65.96 -44.34 85.25 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.693 1.588 . . . . 0.0 112.604 177.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.7 t -54.1 -51.16 65.05 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.173 1.351 . . . . 0.0 110.347 171.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.4 ttt85 -62.67 -40.7 97.9 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.921 -178.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.0 mm -53.14 -56.88 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 125.413 1.485 . . . . 0.0 109.22 168.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 94.5 mt -62.33 -45.38 93.46 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 118.886 -0.578 . . . . 0.0 111.965 -172.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.1 p -69.85 -24.65 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 CA-C-N 119.333 0.97 . . . . 0.0 113.41 176.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.48 -8.56 59.74 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 121.153 -0.967 . . . . 0.0 113.441 170.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.468 HD23 ' HA ' ' A' ' 30' ' ' LEU . 11.4 mt -94.66 -9.53 34.64 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 115.913 1.82 . . . . 0.0 115.913 172.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.37 -13.14 61.4 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 128.724 2.81 . . . . 0.0 111.902 165.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -141.08 -46.8 0.39 Allowed 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.773 2.029 . . . . 0.0 113.963 -169.064 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.98 -66.17 2.31 Favored Glycine 0 C--N 1.339 0.746 0 C-N-CA 125.254 1.407 . . . . 0.0 112.955 -167.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 34.9 m 41.15 20.8 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 128.353 2.661 . . . . 0.0 117.418 171.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 67.0 m -85.28 -63.4 1.33 Allowed 'General case' 0 C--O 1.223 -0.31 0 O-C-N 120.486 -1.384 . . . . 0.0 111.899 -178.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -151.49 159.88 32.68 Favored Pre-proline 0 N--CA 1.473 0.723 0 N-CA-C 115.031 1.493 . . . . 0.0 115.031 -172.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -57.82 119.99 7.6 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.091 1.861 . . . . 0.0 107.56 168.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.57 0.17 84.48 Favored Glycine 0 CA--C 1.533 1.167 0 CA-C-O 117.297 -1.835 . . . . 0.0 115.483 -173.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -37.77 85.91 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 121.209 2.505 . . . . 0.0 109.971 168.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.9 mt -55.42 -27.29 46.91 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 125.962 1.705 . . . . 0.0 110.648 176.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.87 -30.3 68.9 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.301 -0.874 . . . . 0.0 113.071 -174.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.55 -53.68 7.73 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.661 0.784 . . . . 0.0 111.172 170.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -50.6 -35.39 30.03 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.2 mt -101.08 -13.87 18.02 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.86 1.264 . . . . 0.0 113.389 -173.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.15 13.05 66.61 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.337 0.97 . . . . 0.0 113.724 -173.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 53.9 mt -123.9 141.28 52.17 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.577 1.151 . . . . 0.0 110.114 -168.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.8 p -59.2 157.57 10.37 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -168.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -52.95 -28.63 24.51 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.909 0.884 . . . . 0.0 112.279 171.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.5 t -79.12 -36.68 40.23 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.06 -1.025 . . . . 0.0 112.832 175.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -68.33 -38.67 81.75 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.335 0.971 . . . . 0.0 111.888 171.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.8 t -57.12 -44.84 83.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.518 174.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.79 -39.17 93.16 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-N 120.483 1.492 . . . . 0.0 114.081 173.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -56.18 -32.96 64.84 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.214 1.005 . . . . 0.0 112.612 176.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 19.2 m-70 -94.56 -19.64 20.32 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 115.146 1.535 . . . . 0.0 115.146 172.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 47.1 mt -70.47 -28.67 65.18 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 121.159 1.8 . . . . 0.0 113.948 169.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 p -52.0 -59.42 4.37 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 116.544 2.053 . . . . 0.0 116.544 -169.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 2.9 t -64.95 -39.39 93.42 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 118.557 0.617 . . . . 0.0 110.901 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.2 tp -51.76 -32.44 30.83 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.499 1.92 . . . . 0.0 112.266 -178.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.2 mtm105 -72.63 -45.67 57.85 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 118.824 0.738 . . . . 0.0 112.915 174.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -75.34 -28.08 62.51 Favored Glycine 0 N--CA 1.474 1.203 0 C-N-CA 125.348 1.452 . . . . 0.0 112.433 -176.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 89.1 m -66.93 -5.57 13.14 Favored 'General case' 0 CA--C 1.566 1.568 0 C-N-CA 127.414 2.285 . . . . 0.0 111.115 165.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.02 -24.92 1.91 Allowed Glycine 0 C--N 1.343 0.924 0 C-N-CA 128.711 3.053 . . . . 0.0 113.809 -172.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 69.9 mt -43.27 -39.55 3.08 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 128.519 2.728 . . . . 0.0 115.549 -170.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -115.4 133.68 60.92 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 124.922 1.289 . . . . 0.0 113.231 173.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 71.7 t -124.59 136.99 58.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 126.369 1.868 . . . . 0.0 109.549 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.33 141.4 30.94 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.797 1.239 . . . . 0.0 111.095 169.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.0 m -164.0 163.56 23.36 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.947 1.699 . . . . 0.0 107.244 -169.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -84.34 148.43 26.65 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.222 1.374 . . . . 0.0 114.177 174.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -91.76 -18.54 23.75 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.453 0.701 . . . . 0.0 110.24 163.609 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 128.8 -37.81 2.16 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 127.188 2.328 . . . . 0.0 113.252 173.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 23.1 ttm180 -93.97 -34.49 13.04 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 128.646 2.778 . . . . 0.0 111.841 170.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -144.43 164.07 31.93 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.745 2.018 . . . . 0.0 110.166 -170.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 32.9 m -84.56 150.3 4.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 CA-C-O 121.585 0.707 . . . . 0.0 111.298 168.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -135.63 162.27 33.18 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 126.872 2.069 . . . . 0.0 109.304 -171.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -97.57 153.74 17.98 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 164.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -158.83 161.52 36.91 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.164 1.386 . . . . 0.0 109.366 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 57.3 mt -72.35 152.76 41.87 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.363 0.665 . . . . 0.0 111.479 175.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.09 -40.21 95.07 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 115.13 1.53 . . . . 0.0 115.13 -173.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -162.57 161.19 26.7 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 125.411 1.484 . . . . 0.0 110.553 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.58 -37.69 0.14 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 129.515 3.126 . . . . 0.0 112.766 165.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -56.23 -52.11 65.63 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 125.563 1.545 . . . . 0.0 113.398 178.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.9 mt -70.5 -45.7 65.12 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.182 0.901 . . . . 0.0 109.23 -178.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -51.79 -42.11 62.18 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.453 1.101 . . . . 0.0 111.059 177.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 -65.59 -59.74 3.64 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.689 1.196 . . . . 0.0 113.321 171.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.28 -24.46 55.04 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 119.551 1.069 . . . . 0.0 113.329 -178.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.22 -41.5 16.88 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.077 -1.014 . . . . 0.0 112.937 169.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.01 -55.46 4.83 Favored Glycine 0 N--CA 1.471 1.014 0 C-N-CA 126.485 1.993 . . . . 0.0 114.259 -173.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -72.1 -10.34 59.65 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 119.196 1.498 . . . . 0.0 110.895 167.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.5 tp 74.88 138.9 0.06 Allowed 'General case' 0 C--N 1.345 0.409 0 C-N-CA 129.568 3.147 . . . . 0.0 110.554 169.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 32.6 m -66.74 21.05 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 124.923 1.289 . . . . 0.0 113.584 176.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 48.0 mm-40 78.14 -12.3 1.09 Allowed 'General case' 0 N--CA 1.443 -0.782 0 O-C-N 120.238 -1.539 . . . . 0.0 112.058 161.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.6 p -65.84 34.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 128.881 2.872 . . . . 0.0 115.24 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . 0.271 34.8 m 51.27 15.49 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 130.028 3.331 . . . . 0.0 115.832 175.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 38.7 tp 107.25 101.88 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.659 1 C-N-CA 131.759 4.024 . . . . 0.0 110.501 178.116 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.36 76.49 0.26 Allowed 'General case' 0 CA--C 1.553 1.074 0 O-C-N 121.262 -0.899 . . . . 0.0 111.89 168.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -68.92 162.02 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 C-N-CA 126.818 2.047 . . . . 0.0 113.178 175.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -63.6 -1.37 1.23 Allowed 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 126.914 2.086 . . . . 0.0 115.008 173.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.2 p -62.61 111.44 2.07 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 126.178 1.791 . . . . 0.0 111.323 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -66.21 140.75 58.19 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 171.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -157.47 127.06 3.2 Favored Pre-proline 0 N--CA 1.443 -0.811 0 N-CA-C 106.125 -1.805 . . . . 0.0 106.125 174.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . 0.27 59.5 Cg_endo -73.42 117.13 4.95 Favored 'Trans proline' 0 C--N 1.352 0.713 0 CA-C-N 121.399 1.535 . . . . 0.0 114.149 -166.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 50.5 t 63.62 -65.59 0.11 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 130.221 3.408 . . . . 0.0 106.946 -160.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 1.9 p 160.13 -45.45 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.646 1 C-N-CA 132.439 4.296 . . . . 0.0 109.18 -173.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.02 -19.3 60.68 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 -170.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.11 -178.14 3.44 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.428 1.891 . . . . 0.0 112.579 -166.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 115.738 1.755 . . . . 0.0 115.738 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.898 0 CA-C-O 119.391 -0.338 . . . . 0.0 111.338 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 72.2 mt -29.09 -43.03 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 130.393 3.477 . . . . 0.0 116.33 -172.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -39.22 -33.86 0.16 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.302 2.241 . . . . 0.0 114.485 172.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 1.8 mmm-85 -63.09 -31.21 72.29 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.795 2.038 . . . . 0.0 114.482 178.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -60.93 -51.88 67.38 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 120.41 1.459 . . . . 0.0 111.033 173.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.61 -35.52 74.61 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.106 -0.798 . . . . 0.0 111.106 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 52.7 ttt180 -64.55 -31.84 73.23 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 123.76 0.824 . . . . 0.0 111.057 171.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.28 -27.51 65.48 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 120.714 1.597 . . . . 0.0 111.99 174.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 mp -87.95 -7.57 56.93 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 172.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -125.2 -14.55 6.49 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 117.235 2.309 . . . . 0.0 117.235 -175.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -54.93 143.8 50.48 Favored Pre-proline 0 CA--C 1.546 0.821 0 CA-C-N 120.671 1.578 . . . . 0.0 108.582 170.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -43.64 -80.69 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 1 C-N-CA 127.453 5.436 . . . . 0.0 113.992 -166.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.5 ' HB ' ' CD2' ' B' ' 54' ' ' HIS . 7.3 m -67.74 -14.23 62.78 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.664 -0.647 . . . . 0.0 111.553 176.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.68 -47.06 42.56 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.768 1.167 . . . . 0.0 112.712 -171.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 54.1 t -51.83 -47.33 64.41 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 167.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 13.9 ttt85 -61.22 -42.56 98.83 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 118.059 -0.972 . . . . 0.0 112.862 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -56.62 -47.78 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 CA-C-N 121.176 1.807 . . . . 0.0 111.176 171.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 40.7 mt -66.94 -50.68 61.59 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 118.919 -0.562 . . . . 0.0 111.397 -178.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 p -70.14 -25.38 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 CA-C-N 119.163 0.892 . . . . 0.0 111.265 -177.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.33 -43.87 63.47 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-O 117.566 -1.207 . . . . 0.0 110.414 167.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.432 ' HA ' HD23 ' B' ' 30' ' ' LEU . 9.7 mt -60.08 -27.09 66.71 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.539 1.518 . . . . 0.0 115.042 -178.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -44.71 -28.84 0.67 Allowed 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 126.717 2.007 . . . . 0.0 111.925 168.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -120.08 -31.27 4.47 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 129.556 3.142 . . . . 0.0 113.784 169.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.79 16.43 4.23 Favored Glycine 0 N--CA 1.468 0.793 0 C-N-CA 130.019 3.676 . . . . 0.0 115.999 -163.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 20.0 m -58.49 30.39 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 127.609 2.364 . . . . 0.0 117.361 170.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 71.1 m -87.64 -69.06 0.71 Allowed 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.793 -1.192 . . . . 0.0 113.442 178.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -159.54 158.3 27.51 Favored Pre-proline 0 N--CA 1.475 0.781 0 CA-C-N 120.266 1.394 . . . . 0.0 114.341 -172.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -57.07 115.31 2.41 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 122.451 2.101 . . . . 0.0 109.28 170.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 93.66 1.45 65.92 Favored Glycine 0 CA--C 1.532 1.143 0 CA-C-O 117.348 -1.807 . . . . 0.0 115.313 -174.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . 0.471 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -63.56 -39.5 94.57 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 120.566 2.183 . . . . 0.0 110.007 168.91 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 9.9 mt -56.52 -24.29 45.51 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 124.69 1.196 . . . . 0.0 110.986 -177.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.8 -31.62 62.8 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.289 -0.882 . . . . 0.0 112.219 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.45 -55.97 5.05 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.96 0.904 . . . . 0.0 111.198 171.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . 0.471 ' CD2' HE22 ' B' ' 39' ' ' GLN . 3.2 m-70 -54.51 -29.27 49.95 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.436 HD12 HG22 ' B' ' 51' ' ' VAL . 19.5 mt -105.34 -14.58 15.29 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.197 1.399 . . . . 0.0 112.887 -175.083 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 65.51 14.17 59.68 Favored Glycine 0 CA--C 1.53 0.978 0 C-N-CA 124.323 0.963 . . . . 0.0 113.2 -173.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 39.9 mt -120.3 158.66 26.59 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.184 0.992 . . . . 0.0 112.214 -168.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 20.4 p -66.03 154.65 38.93 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.468 0.651 . . . . 0.0 111.151 -169.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -60.99 -19.76 61.62 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.701 -0.624 . . . . 0.0 111.806 173.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 13.6 m -72.27 -53.55 12.15 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.841 1.256 . . . . 0.0 110.931 168.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -59.22 -37.23 77.0 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.616 1.166 . . . . 0.0 112.024 176.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . 0.436 HG22 HD12 ' B' ' 44' ' ' LEU . 10.5 t -63.79 -43.3 97.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 124.293 1.037 . . . . 0.0 112.348 169.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 18.1 m -61.02 -45.12 96.1 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 120.462 1.483 . . . . 0.0 112.069 173.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 -57.41 -28.11 62.97 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 127.31 2.244 . . . . 0.0 113.089 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . 0.5 ' CD2' ' HB ' ' B' ' 22' ' ' THR . 35.3 m-70 -99.29 -20.12 16.72 Favored 'General case' 0 CA--C 1.55 0.949 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 173.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 50.0 mt -77.71 -22.52 50.3 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 117.039 -1.458 . . . . 0.0 114.875 170.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -44.97 -69.89 0.12 Allowed 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 121.987 2.176 . . . . 0.0 113.888 175.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.5 t -63.9 -42.97 97.3 Favored 'General case' 0 C--O 1.215 -0.76 0 C-N-CA 124.384 1.074 . . . . 0.0 109.916 -178.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.04 -39.63 28.08 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.994 1.318 . . . . 0.0 113.531 176.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 49.1 mtm180 -87.36 -19.91 27.47 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.57 -31.46 10.32 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 125.323 1.439 . . . . 0.0 114.902 175.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 85.1 m -67.27 -10.77 54.04 Favored 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 128.365 2.666 . . . . 0.0 112.501 169.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.31 19.16 78.6 Favored Glycine 0 CA--C 1.529 0.952 0 C-N-CA 124.685 1.136 . . . . 0.0 113.54 -174.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 83.0 mt -78.3 -30.71 48.49 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 118.401 1.1 . . . . 0.0 112.704 175.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 19.6 t -133.5 137.0 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 125.485 1.514 . . . . 0.0 111.259 -170.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 42.4 t -133.97 144.84 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.034 1.334 . . . . 0.0 110.825 -169.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -86.81 137.85 32.07 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.124 1.37 . . . . 0.0 111.38 173.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 18.2 m -161.45 170.04 20.75 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.891 1.676 . . . . 0.0 107.652 -171.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -91.3 145.49 24.61 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 120.419 1.463 . . . . 0.0 113.434 171.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.262 0.0 OUTLIER -88.16 -16.81 32.38 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.492 0.717 . . . . 0.0 110.928 164.667 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 128.28 -35.55 2.68 Favored Glycine 0 CA--C 1.535 1.308 0 C-N-CA 127.407 2.432 . . . . 0.0 113.201 172.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 13.1 ttm180 -96.36 -35.75 11.09 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 129.07 2.948 . . . . 0.0 111.62 170.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -143.62 163.23 33.81 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 127.171 2.188 . . . . 0.0 109.827 -169.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 33.7 m -82.81 153.2 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-O 121.309 0.576 . . . . 0.0 111.652 169.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -136.35 159.02 43.03 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 127.071 2.148 . . . . 0.0 109.845 -171.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -99.54 147.37 25.4 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 162.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -147.42 156.12 42.58 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 123.679 0.792 . . . . 0.0 109.133 178.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 40.5 mt -60.58 154.13 21.87 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 168.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.59 -26.81 68.01 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -171.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -174.79 164.43 3.53 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.108 2.163 . . . . 0.0 110.673 169.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.2 m -35.59 -34.78 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 129.749 3.22 . . . . 0.0 113.213 165.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -61.88 -43.32 99.08 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.03 1.332 . . . . 0.0 111.767 -179.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 11.6 mt -74.31 -44.3 53.16 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.985 1.266 . . . . 0.0 110.045 172.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.08 -28.11 16.35 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.661 1.184 . . . . 0.0 112.313 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 39.5 mtt180 -72.23 -63.32 1.17 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.013 1.725 . . . . 0.0 114.682 170.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.33 -13.93 9.89 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 120.129 -1.607 . . . . 0.0 113.303 175.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 5.3 tp -86.09 -44.34 12.34 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 127.5 2.32 . . . . 0.0 112.824 168.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -83.83 -58.26 2.28 Favored Glycine 0 N--CA 1.476 1.305 0 C-N-CA 127.428 2.442 . . . . 0.0 114.428 -174.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 9.4 pm0 -67.89 -14.73 63.19 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 119.882 1.841 . . . . 0.0 110.232 165.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . 0.405 ' C ' ' H ' ' B' ' 91' ' ' GLN . 43.3 tp 76.55 160.0 0.22 Allowed 'General case' 0 C--N 1.346 0.437 0 C-N-CA 129.63 3.172 . . . . 0.0 110.558 169.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 28.9 m -66.79 18.8 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 O-C-N 120.856 -1.152 . . . . 0.0 112.401 168.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . 0.405 ' H ' ' C ' ' B' ' 89' ' ' LEU . 33.3 mm-40 72.48 -0.91 3.13 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.815 1.246 . . . . 0.0 113.268 166.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.9 p -60.57 34.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 130.107 3.363 . . . . 0.0 115.455 173.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.263 30.0 m 52.03 14.6 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 130.266 3.426 . . . . 0.0 116.201 175.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 41.9 tp 109.93 101.92 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 130.45 3.5 . . . . 0.0 109.697 -174.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.45 69.46 0.15 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.675 1.19 . . . . 0.0 111.592 168.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -63.56 161.9 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 125.715 1.606 . . . . 0.0 112.353 174.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -70.16 -0.65 8.22 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 127.026 2.13 . . . . 0.0 114.331 173.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 18.4 p -60.97 112.51 2.1 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.541 1.936 . . . . 0.0 110.872 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -72.26 137.21 46.62 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 172.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -156.79 130.3 4.63 Favored Pre-proline 0 N--CA 1.446 -0.638 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 175.057 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . 0.282 51.7 Cg_endo -70.21 114.29 3.73 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 CA-C-N 121.489 1.568 . . . . 0.0 114.776 -165.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 37.9 t 66.38 -63.45 0.25 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 130.562 3.545 . . . . 0.0 108.164 -163.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.1 p 153.17 -40.25 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.845 1 C-N-CA 134.995 5.318 . . . . 0.0 108.294 -168.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -75.12 4.91 5.99 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 116.947 2.202 . . . . 0.0 116.947 -168.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.07 -173.62 3.51 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 120.02 1.282 . . . . 0.0 110.656 -169.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.3 ttm-85 . . . . . 0 N--CA 1.467 0.415 0 N-CA-C 116.118 1.896 . . . . 0.0 116.118 -173.204 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.45 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.0 mp -62.03 -27.09 68.64 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.596 1.558 . . . . 0.0 113.117 -167.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.74 -50.07 33.47 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.421 -0.799 . . . . 0.0 111.139 169.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.4 mmt85 -60.13 -35.55 75.52 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.236 -1.54 . . . . 0.0 112.566 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -56.27 -56.92 15.03 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 126.55 1.94 . . . . 0.0 110.72 178.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -75.02 -30.76 58.7 Favored Glycine 0 CA--C 1.531 1.084 0 CA-C-N 119.28 0.946 . . . . 0.0 112.54 -178.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -61.62 -28.84 69.65 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 118.501 1.151 . . . . 0.0 112.027 169.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.514 ' CB ' HH21 ' A' ' 23' ' ' ARG . . . -85.77 -21.48 28.17 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.285 2.234 . . . . 0.0 114.356 173.182 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.9 tp -78.45 -28.84 46.68 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.101 1.76 . . . . 0.0 110.005 177.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -108.04 62.81 0.61 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.599 1.16 . . . . 0.0 112.197 168.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -125.46 141.58 39.34 Favored Pre-proline 0 CA--C 1.557 1.232 0 C-N-CA 127.686 2.394 . . . . 0.0 107.047 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -45.84 -90.46 0.0 OUTLIER 'Trans proline' 0 C--N 1.356 0.944 1 C-N-CA 127.634 5.556 . . . . 0.0 117.073 -163.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.2 m -46.96 -27.43 1.27 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.437 1.895 . . . . 0.0 111.987 169.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.514 HH21 ' CB ' ' A' ' 17' ' ' ALA . 1.8 ttp180 -73.3 -45.89 52.82 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 126.012 1.725 . . . . 0.0 113.644 -168.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.9 t -54.35 -48.82 71.01 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 120.229 1.377 . . . . 0.0 110.324 168.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 -52.45 -52.38 54.42 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-O 117.945 -1.026 . . . . 0.0 112.127 173.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.462 ' HA ' HD11 ' A' ' 44' ' ' LEU . 1.3 mt -50.52 -50.17 22.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 CA-C-N 121.03 1.741 . . . . 0.0 111.767 172.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 93.6 mt -69.55 -37.58 77.12 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 118.28 -0.866 . . . . 0.0 112.608 -170.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.3 p -74.74 -21.34 17.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 CA-C-N 119.19 0.904 . . . . 0.0 111.985 174.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.9 -44.29 27.53 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 118.077 -0.963 . . . . 0.0 110.764 168.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 30' ' ' LEU . 12.4 mt -62.18 -18.96 62.52 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -176.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.6 mt -53.29 -22.11 6.57 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 124.528 1.131 . . . . 0.0 111.665 166.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -129.17 -29.11 2.29 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 128.815 2.846 . . . . 0.0 113.564 169.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.25 11.21 2.98 Favored Glycine 0 N--CA 1.473 1.156 0 C-N-CA 128.941 3.162 . . . . 0.0 116.057 -165.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.626 HG12 ' HA ' ' A' ' 76' ' ' ALA . 27.7 m -66.46 39.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 C-N-CA 128.21 2.604 . . . . 0.0 115.721 172.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 5.1 t -100.81 -60.42 1.53 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.416 1.086 . . . . 0.0 113.033 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 53.6 p90 -158.21 154.97 25.09 Favored Pre-proline 0 N--CA 1.478 0.927 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -178.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -61.01 116.88 3.65 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 122.525 2.15 . . . . 0.0 109.538 175.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.41 -12.19 59.94 Favored Glycine 0 C--O 1.22 -0.772 0 CA-C-O 115.986 -2.563 . . . . 0.0 114.75 -175.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -29.26 68.96 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-N 120.629 2.214 . . . . 0.0 111.838 175.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.413 HD13 HG23 ' A' ' 26' ' ' ILE . 17.9 mt -63.13 -18.97 64.02 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.311 0.644 . . . . 0.0 110.775 177.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.52 -42.37 96.31 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 119.444 1.02 . . . . 0.0 110.472 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.45 -51.16 66.86 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.517 1.053 . . . . 0.0 112.348 173.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -57.27 -36.69 71.32 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.462 HD11 ' HA ' ' A' ' 26' ' ' ILE . 19.6 mt -101.82 -14.49 17.26 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -170.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.08 10.97 36.24 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 114.676 0.63 . . . . 0.0 114.676 -172.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.0 mp -101.16 141.52 33.92 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 173.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.3 t -59.1 147.8 33.63 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 121.909 -0.495 . . . . 0.0 111.277 -176.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -57.09 -27.99 62.23 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.253 1.021 . . . . 0.0 113.439 -171.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.8 p -69.41 -55.44 10.32 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.261 -0.9 . . . . 0.0 112.767 170.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -54.57 -49.06 71.26 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.08 0.952 . . . . 0.0 112.12 177.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 84.9 t -59.56 -40.69 82.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 O-C-N 121.803 -0.561 . . . . 0.0 111.065 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 46.5 m -69.99 -27.24 64.54 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 178.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 32.0 t-20 -58.93 -45.36 90.57 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.019 0.827 . . . . 0.0 110.94 170.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 40.0 m-70 -71.65 -22.65 61.66 Favored 'General case' 0 CA--C 1.551 1.019 0 O-C-N 120.146 -1.596 . . . . 0.0 114.268 170.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 73.6 mt -70.55 -25.35 63.05 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 120.62 1.555 . . . . 0.0 111.697 168.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.14 -42.1 63.07 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.121 0.873 . . . . 0.0 111.736 170.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 2.4 t -83.68 -39.45 20.18 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 119.483 1.038 . . . . 0.0 111.886 -178.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.441 ' CD1' ' HG2' ' A' ' 23' ' ' ARG . 1.1 tp -52.31 -42.33 63.71 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.609 1.564 . . . . 0.0 113.408 175.058 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.8 mtm180 -85.19 -1.07 56.49 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.493 1.117 . . . . 0.0 112.025 -179.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -109.17 -41.84 1.35 Allowed Glycine 0 N--CA 1.477 1.413 0 C-N-CA 126.159 1.838 . . . . 0.0 113.201 175.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 50.7 m -59.49 -16.62 25.45 Favored 'General case' 0 CA--C 1.561 1.394 0 C-N-CA 127.515 2.326 . . . . 0.0 112.785 169.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.98 20.0 74.02 Favored Glycine 0 C--N 1.343 0.953 0 C-N-CA 125.714 1.626 . . . . 0.0 113.987 -176.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.6 mt -71.12 -23.98 62.19 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.303 1.441 . . . . 0.0 113.13 171.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 13.7 t -142.6 144.97 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -166.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 9.6 t -133.42 141.63 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 C-N-CA 125.276 1.43 . . . . 0.0 109.479 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -96.67 148.52 22.78 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.377 1.071 . . . . 0.0 112.526 175.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.9 p -133.91 144.85 49.11 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.634 0.774 . . . . 0.0 109.674 172.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -94.96 107.97 20.02 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 125.376 1.47 . . . . 0.0 108.978 169.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.78 14.24 0.22 Allowed 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -176.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.2 -17.48 26.61 Favored Glycine 0 CA--C 1.529 0.933 0 C-N-CA 126.008 1.766 . . . . 0.0 113.189 -177.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 20.3 ttp-105 -158.17 -48.15 0.06 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.658 1.183 . . . . 0.0 112.103 -169.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -93.75 173.76 7.52 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.096 1.758 . . . . 0.0 110.317 171.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 20.6 m -122.77 149.28 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 125.014 1.325 . . . . 0.0 108.664 167.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.5 ptt85 -138.14 177.12 8.12 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.877 1.671 . . . . 0.0 109.372 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -117.03 174.69 5.96 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.035 0.934 . . . . 0.0 110.893 168.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.626 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -168.87 145.97 3.7 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 126.385 1.874 . . . . 0.0 109.859 177.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 91.0 mt -56.23 148.76 17.61 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 123.505 0.503 . . . . 0.0 110.589 169.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.15 -28.5 60.16 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.875 1.806 . . . . 0.0 115.875 -168.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -156.16 160.12 39.6 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 124.195 1.95 . . . . 0.0 112.988 170.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -40.32 -28.85 0.07 Allowed 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 130.49 3.516 . . . . 0.0 113.831 165.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -60.15 -62.16 2.07 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 126.484 1.914 . . . . 0.0 110.653 171.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.8 mt -62.31 -47.65 83.34 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -176.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.69 -48.06 66.82 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 12.7 ptp180 -75.55 -37.2 60.17 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -175.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -76.7 -39.41 52.07 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.455 1.025 . . . . 0.0 110.69 176.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.99 -32.32 70.74 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.216 -0.928 . . . . 0.0 110.163 169.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.86 -18.56 76.21 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 125.712 1.625 . . . . 0.0 115.401 171.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.38 -20.36 63.83 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 120.04 1.92 . . . . 0.0 110.259 166.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 13.5 tp 66.91 61.86 0.5 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 128.101 2.56 . . . . 0.0 109.877 -169.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 61.9 t -25.88 128.17 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 128.035 2.534 . . . . 0.0 114.557 -172.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.417 ' C ' ' H ' ' A' ' 93' ' ' VAL . 0.8 OUTLIER -94.3 6.86 47.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 112.758 -2.019 . . . . 0.0 111.269 -109.688 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.8 p -63.71 34.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 130.239 3.416 . . . . 0.0 113.382 169.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.417 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.5 t 69.63 18.18 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.983 0 C-N-CA 125.534 1.534 . . . . 0.0 112.004 168.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 5.4 tt 103.0 102.93 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 131.342 3.857 . . . . 0.0 108.749 -173.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.46 76.22 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 115.34 1.608 . . . . 0.0 115.34 176.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 99.2 t -58.73 153.51 3.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 127.419 2.288 . . . . 0.0 111.241 169.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -59.48 -0.24 0.15 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 127.752 2.421 . . . . 0.0 116.813 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 31.3 p -49.01 101.53 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.214 1.406 . . . . 0.0 113.394 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -99.21 141.08 32.44 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 106.197 -1.779 . . . . 0.0 106.197 164.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -138.34 141.8 32.86 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 -169.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -54.85 -29.44 63.22 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 123.325 2.684 . . . . 0.0 114.779 -171.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 10.4 t 74.74 -161.33 0.07 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 126.829 2.052 . . . . 0.0 112.189 169.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 2.6 t 54.21 28.03 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 C-N-CA 125.545 1.538 . . . . 0.0 111.02 -173.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . 0.271 . . 90.97 9.14 0.06 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 128.89 2.876 . . . . 0.0 114.951 -177.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -96.19 151.0 19.9 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.271 1.429 . . . . 0.0 111.67 168.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.547 0.836 0 C-N-CA 127.484 2.314 . . . . 0.0 110.715 -177.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.459 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 5.0 mp -72.88 -19.17 61.34 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -167.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -81.67 -43.96 17.8 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.945 0.793 . . . . 0.0 110.736 166.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 12.0 mmt85 -62.32 -32.06 72.77 Favored 'General case' 0 N--CA 1.473 0.7 0 O-C-N 120.394 -1.441 . . . . 0.0 112.394 178.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -46.04 -63.9 0.87 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 127.896 2.478 . . . . 0.0 110.725 170.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.76 -31.33 62.6 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 119.758 -1.211 . . . . 0.0 112.491 -174.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -66.79 -27.72 67.81 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.448 1.099 . . . . 0.0 112.285 174.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -86.43 -21.58 27.02 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 127.556 2.342 . . . . 0.0 113.727 175.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.0 mp -84.37 -45.19 13.0 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.045 0.838 . . . . 0.0 109.901 173.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.91 49.16 1.32 Allowed 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.204 -0.935 . . . . 0.0 112.162 169.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -117.75 134.57 23.22 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 128.587 2.755 . . . . 0.0 106.567 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -46.3 -90.13 0.0 OUTLIER 'Trans proline' 0 CA--C 1.537 0.672 1 C-N-CA 126.545 4.83 . . . . 0.0 115.682 -164.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 91.3 m -54.63 -26.79 35.1 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.764 1.226 . . . . 0.0 111.251 174.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.636 ' HG2' HD13 ' B' ' 58' ' ' LEU . 6.6 mtp180 -74.13 -36.7 64.2 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 117.062 -1.447 . . . . 0.0 114.355 -171.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 41.4 t -58.04 -51.15 70.85 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.521 1.509 . . . . 0.0 109.364 168.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 38.8 mtp180 -51.89 -45.37 64.15 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 124.854 1.261 . . . . 0.0 111.825 173.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 7.0 mt -52.8 -67.05 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 CA-C-N 120.167 1.349 . . . . 0.0 110.099 169.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 87.4 mt -53.68 -37.99 63.75 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -168.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 7.2 p -72.29 -24.28 22.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-N 119.484 1.038 . . . . 0.0 113.75 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -95.35 -18.58 20.64 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.017 1.327 . . . . 0.0 113.461 173.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.04 -50.3 71.19 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.901 1.681 . . . . 0.0 109.102 175.046 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -39.11 -53.12 1.86 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 130.514 3.526 . . . . 0.0 113.639 -174.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -101.55 -15.48 17.09 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.556 1.942 . . . . 0.0 112.619 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.62 -65.31 2.17 Favored Glycine 0 C--N 1.341 0.808 0 C-N-CA 125.501 1.524 . . . . 0.0 112.005 178.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . 0.441 HG12 ' HA ' ' B' ' 76' ' ' ALA . 29.6 m 27.21 40.14 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 N-CA-C 116.664 2.098 . . . . 0.0 116.664 -173.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -92.11 -73.71 0.54 Allowed 'General case' 0 N--CA 1.465 0.302 0 O-C-N 121.394 -0.816 . . . . 0.0 112.365 -167.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . 0.495 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 34.7 p90 -151.18 163.53 23.33 Favored Pre-proline 0 CA--C 1.546 0.818 0 C-N-CA 124.168 0.987 . . . . 0.0 113.441 -178.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -51.76 117.2 3.3 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 122.507 2.138 . . . . 0.0 110.953 170.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.06 -4.57 84.72 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-O 118.383 -1.232 . . . . 0.0 115.16 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . 0.495 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 0.0 OUTLIER -56.29 -18.53 10.91 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 120.371 2.085 . . . . 0.0 114.848 175.966 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.401 ' HB2' HG11 ' B' ' 51' ' ' VAL . 1.8 mt -75.46 -15.97 60.37 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 124.325 1.05 . . . . 0.0 110.894 178.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.76 -39.16 87.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 119.398 0.999 . . . . 0.0 112.698 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.77 -42.06 77.96 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.803 170.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -62.19 -36.79 82.98 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 176.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 27.0 mt -101.69 -17.37 16.32 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 -169.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.1 13.15 47.4 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-O 121.961 0.756 . . . . 0.0 113.844 -169.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mp -99.44 131.14 45.65 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 169.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 11.8 t -56.38 148.83 18.01 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -176.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 11.0 ptp180 -55.19 -23.87 24.08 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.482 1.513 . . . . 0.0 114.382 -175.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 60.7 p -72.98 -53.17 11.87 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.292 1.405 . . . . 0.0 112.339 169.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 63.7 t-20 -57.52 -47.19 82.64 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.357 1.063 . . . . 0.0 111.916 -178.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . 0.401 HG11 ' HB2' ' B' ' 40' ' ' LEU . 27.4 t -63.11 -36.59 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 O-C-N 121.203 -0.935 . . . . 0.0 111.54 177.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 55.3 m -71.87 -29.72 64.67 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -55.48 -45.85 76.92 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 122.089 0.947 . . . . 0.0 110.54 170.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 -71.73 -23.16 61.57 Favored 'General case' 0 CA--C 1.556 1.199 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 171.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 65.9 mt -74.85 -18.71 60.4 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-N 121.192 1.814 . . . . 0.0 112.175 168.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.36 -50.17 70.38 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.21 0.914 . . . . 0.0 110.581 172.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 6.1 t -76.01 -39.45 55.73 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 118.554 0.615 . . . . 0.0 112.236 -177.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.636 HD13 ' HG2' ' B' ' 23' ' ' ARG . 4.8 tp -56.05 -40.87 74.15 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.845 1.658 . . . . 0.0 112.361 -175.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 -81.32 -9.75 59.69 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.717 1.207 . . . . 0.0 112.33 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -93.17 -39.42 5.13 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 125.076 1.322 . . . . 0.0 111.827 169.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 43.5 m -58.07 -18.18 22.96 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 127.528 2.331 . . . . 0.0 113.216 169.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 81.51 -9.52 54.8 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 125.709 1.624 . . . . 0.0 113.838 -176.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 92.5 mt -51.41 -31.63 23.4 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 128.079 2.551 . . . . 0.0 114.315 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -129.91 138.87 52.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 C-N-CA 126.376 1.87 . . . . 0.0 109.44 177.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 51.2 t -122.02 135.9 60.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 C-N-CA 127.153 2.181 . . . . 0.0 108.713 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -87.54 136.05 33.1 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.589 0.756 . . . . 0.0 112.42 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 14.1 p -136.74 148.08 47.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.492 0.717 . . . . 0.0 110.566 179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -100.09 107.25 19.1 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.964 1.306 . . . . 0.0 110.198 175.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.83 9.46 0.38 Allowed 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 116.2 1.926 . . . . 0.0 116.2 -177.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 116.24 -17.93 14.24 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.921 1.724 . . . . 0.0 113.083 -177.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 20.0 ttp-105 -157.88 -42.99 0.06 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.447 1.499 . . . . 0.0 111.957 -169.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -102.27 171.64 7.35 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.259 1.824 . . . . 0.0 111.136 175.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 23.8 m -120.01 143.06 32.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.017 1.327 . . . . 0.0 110.377 168.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.2 ptt180 -131.98 175.1 9.51 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.041 1.336 . . . . 0.0 110.808 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -122.65 125.65 46.03 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.556 1.142 . . . . 0.0 108.588 167.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.441 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -123.61 150.42 44.15 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.451 1.1 . . . . 0.0 110.365 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.8 tp -53.02 145.26 13.34 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.585 1.154 . . . . 0.0 110.326 172.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.27 -37.9 84.83 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 -173.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -169.11 161.41 10.37 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 123.698 1.713 . . . . 0.0 112.592 -174.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -34.96 -39.45 0.1 Allowed 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 130.662 3.585 . . . . 0.0 113.162 165.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -50.79 -67.39 0.26 Allowed 'General case' 0 C--N 1.345 0.386 0 C-N-CA 127.033 2.133 . . . . 0.0 111.877 173.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 16.8 mt -62.35 -37.46 85.75 Favored 'General case' 0 C--O 1.223 -0.336 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.6 -41.89 98.3 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 118.471 -0.776 . . . . 0.0 112.276 -174.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -71.45 -52.06 20.49 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-O 117.878 -1.058 . . . . 0.0 111.772 174.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.79 -38.01 89.5 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 120.109 1.322 . . . . 0.0 112.311 -173.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' B' ' 86' ' ' LEU . 0.3 OUTLIER -71.85 -29.16 64.09 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.39 -0.819 . . . . 0.0 112.109 173.445 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -87.09 -29.75 21.97 Favored Glycine 0 CA--C 1.543 1.796 0 C-N-CA 124.847 1.213 . . . . 0.0 116.022 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -89.04 -8.68 53.5 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.971 1.709 . . . . 0.0 112.82 171.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 13.7 tp 85.69 84.94 0.02 OUTLIER 'General case' 0 C--O 1.239 0.521 0 C-N-CA 128.801 2.84 . . . . 0.0 114.18 166.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 55.4 t -46.89 131.3 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-O 124.624 2.155 . . . . 0.0 110.172 169.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . 0.404 ' C ' ' H ' ' B' ' 93' ' ' VAL 0.288 2.0 tp-100 -100.19 10.76 40.76 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 111.902 -2.408 . . . . 0.0 112.501 -120.021 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 6.7 p -67.32 42.39 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.71 1 C-N-CA 132.674 4.389 . . . . 0.0 110.853 166.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . 0.404 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.2 OUTLIER 56.73 9.24 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 C-N-CA 129.326 3.05 . . . . 0.0 116.247 177.767 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 7.3 tt 97.41 106.06 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 129.902 3.281 . . . . 0.0 104.415 -165.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.28 86.15 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 -177.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 57.1 t -64.47 147.3 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 125.608 1.563 . . . . 0.0 108.073 167.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -59.47 -3.28 0.42 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.852 2.061 . . . . 0.0 116.346 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 12.2 p -44.17 95.11 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.012 1.725 . . . . 0.0 113.201 176.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -99.88 145.1 28.17 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 168.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -148.12 144.3 18.69 Favored Pre-proline 0 C--N 1.322 -0.616 0 C-N-CA 125.878 1.671 . . . . 0.0 107.105 -168.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -52.7 -28.94 39.7 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 123.652 2.901 . . . . 0.0 115.793 -171.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 47.9 t 72.86 -161.24 0.1 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 127.296 2.239 . . . . 0.0 111.886 174.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 2.2 t 56.51 22.43 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 126.304 1.841 . . . . 0.0 111.661 -170.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . 0.278 . . 89.45 8.09 0.1 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 128.548 2.739 . . . . 0.0 115.251 -174.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -86.87 146.89 26.02 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.43 1.092 . . . . 0.0 111.252 169.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.558 0 C-N-CA 126.152 1.781 . . . . 0.0 110.23 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.651 0 CA-C-O 120.672 0.273 . . . . 0.0 111.72 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.561 ' HG ' HG11 ' B' ' 92' ' ' VAL . 0.7 OUTLIER -65.98 -46.54 77.67 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -169.06 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.97 -60.3 3.5 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 118.249 -0.881 . . . . 0.0 112.43 -177.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.5 ptp85 -61.33 -35.41 77.31 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.658 1.117 . . . . 0.0 112.69 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -59.55 -63.11 1.42 Allowed 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.805 0.842 . . . . 0.0 110.793 174.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.83 -31.34 62.42 Favored Glycine 0 C--N 1.337 0.588 0 CA-C-O 118.222 -1.321 . . . . 0.0 112.388 -169.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.77 -8.1 32.86 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.032 1.916 . . . . 0.0 114.269 173.102 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.47 -6.23 14.47 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.153 1.381 . . . . 0.0 112.753 169.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.492 HD12 ' HA ' ' A' ' 18' ' ' LEU . 3.7 tp -96.07 -37.71 10.5 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.227 1.411 . . . . 0.0 110.381 176.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.61 34.69 0.33 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 128.149 2.58 . . . . 0.0 115.469 -172.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -103.0 165.76 13.06 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 129.785 3.234 . . . . 0.0 113.209 -168.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -69.57 -104.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.549 1.258 1 C-N-CA 126.206 4.604 . . . . 0.0 110.832 168.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -46.9 -37.99 9.77 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 127.346 2.259 . . . . 0.0 112.877 176.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.515 ' CD ' HD13 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -67.18 -32.7 73.95 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 117.964 -1.017 . . . . 0.0 113.505 -176.523 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 40.6 t -60.74 -52.14 66.36 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 119.041 0.837 . . . . 0.0 109.826 169.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 78.7 mtt-85 -52.61 -45.43 66.57 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.175 1.39 . . . . 0.0 113.239 175.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.8 mt -45.27 -63.94 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 C-N-CA 124.028 0.931 . . . . 0.0 110.887 169.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 59.9 mt -60.9 -42.23 97.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 114.774 -1.103 . . . . 0.0 112.462 -170.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -63.02 -25.61 38.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 CA-C-N 119.016 0.826 . . . . 0.0 112.354 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.448 ' HB1' ' CD2' ' A' ' 43' ' ' HIS . . . -89.2 -26.4 21.26 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 123.505 0.722 . . . . 0.0 112.867 175.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.31 -39.46 94.62 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.278 1.431 . . . . 0.0 112.639 -175.632 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 mt -41.13 -44.36 2.49 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 128.119 2.568 . . . . 0.0 111.809 173.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -112.59 11.63 19.68 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 126.966 2.106 . . . . 0.0 112.251 173.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.29 -4.91 19.94 Favored Glycine 0 N--CA 1.47 0.949 0 C-N-CA 127.61 2.528 . . . . 0.0 114.357 -170.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.6 m -40.95 67.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 C-N-CA 127.85 2.46 . . . . 0.0 117.344 166.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 52.0 m -133.25 -61.16 0.83 Allowed 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.844 1.257 . . . . 0.0 114.168 -178.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -161.69 163.02 20.2 Favored Pre-proline 0 N--CA 1.479 0.993 0 CA-C-N 120.647 1.567 . . . . 0.0 115.143 -177.159 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -57.65 131.33 43.59 Favored 'Trans proline' 0 C--N 1.355 0.885 0 C-N-CA 122.633 2.222 . . . . 0.0 108.159 168.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.87 1.72 59.69 Favored Glycine 0 CA--C 1.528 0.896 0 CA-C-O 116.993 -2.004 . . . . 0.0 114.928 -176.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -35.96 73.33 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 121.143 2.471 . . . . 0.0 110.766 170.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 mt -59.32 -20.9 58.3 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 125.838 1.655 . . . . 0.0 112.071 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.5 -35.09 76.7 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.931 -0.481 . . . . 0.0 111.833 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.71 -45.62 61.26 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.586 0.754 . . . . 0.0 111.18 171.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.448 ' CD2' ' HB1' ' A' ' 29' ' ' ALA . 5.4 m-70 -59.21 -37.39 77.34 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 177.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 21.0 mt -99.33 -16.47 18.44 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.441 1.096 . . . . 0.0 113.676 -173.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.68 8.02 71.05 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-N 119.105 0.866 . . . . 0.0 113.803 -170.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.7 mt -110.91 147.75 33.95 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.695 1.198 . . . . 0.0 111.276 -173.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.8 t -58.37 136.77 57.49 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.568 0.699 . . . . 0.0 112.089 -173.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 38.6 ptt180 -57.73 -33.66 68.68 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.428 1.091 . . . . 0.0 112.912 -176.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.8 m -61.88 -43.08 99.58 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.606 0.762 . . . . 0.0 111.509 174.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -80.08 -39.42 29.7 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 59.9 t -60.33 -38.63 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-N 119.521 1.055 . . . . 0.0 110.773 173.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 14.9 m -70.02 -21.11 63.23 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 177.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -57.01 -45.22 83.2 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-O 123.301 1.524 . . . . 0.0 110.806 174.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 22.2 m-70 -69.94 -14.16 62.58 Favored 'General case' 0 CA--C 1.561 1.388 0 C-N-CA 125.857 1.663 . . . . 0.0 114.63 170.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 95.5 mt -81.11 -26.98 35.77 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 120.662 -1.274 . . . . 0.0 112.353 172.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.8 t -47.23 -50.89 20.19 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.204 0.911 . . . . 0.0 111.94 -178.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 41.5 t -86.8 -23.29 25.43 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 178.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.515 HD13 ' CD ' ' A' ' 23' ' ' ARG . 5.6 tp -58.49 -39.33 79.7 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 121.031 1.741 . . . . 0.0 111.199 171.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -77.88 -24.93 48.33 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.526 1.53 . . . . 0.0 112.021 176.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.55 -52.22 4.27 Favored Glycine 0 CA--C 1.534 1.264 0 C-N-CA 124.951 1.263 . . . . 0.0 113.462 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 17.5 m -64.75 -2.05 2.28 Favored 'General case' 0 CA--C 1.562 1.415 0 C-N-CA 125.903 1.681 . . . . 0.0 113.278 171.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.26 6.67 87.81 Favored Glycine 0 C--N 1.344 1.011 0 C-N-CA 124.987 1.279 . . . . 0.0 114.375 170.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 18.6 mt -66.68 -36.89 83.6 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-N 118.175 0.988 . . . . 0.0 111.818 -177.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.5 m -113.22 135.8 51.59 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.101 0 C-N-CA 125.881 1.672 . . . . 0.0 110.818 170.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 46.9 t -116.71 141.84 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 125.614 1.566 . . . . 0.0 108.784 176.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.11 142.32 49.16 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.753 0.821 . . . . 0.0 113.063 174.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.0 m -134.21 144.81 48.66 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 169.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -83.54 103.84 13.2 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 118.697 0.68 . . . . 0.0 109.536 168.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.269 1.3 pp20? -70.79 -161.11 0.05 OUTLIER 'General case' 0 CA--C 1.558 1.267 0 N-CA-C 112.432 0.531 . . . . 0.0 112.432 168.724 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -60.59 -28.32 67.54 Favored Glycine 0 CA--C 1.535 1.31 0 O-C-N 119.695 -1.878 . . . . 0.0 115.801 -169.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.0 tpt85 -158.03 14.5 0.21 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 174.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.29 174.0 11.28 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.618 1.567 . . . . 0.0 110.075 -177.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 9.1 p -87.49 139.16 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 167.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -122.25 165.41 16.24 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 125.334 1.453 . . . . 0.0 109.002 173.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -114.35 152.91 30.71 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 123.116 0.566 . . . . 0.0 109.735 170.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -144.38 143.32 30.88 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 125.777 1.631 . . . . 0.0 109.552 -177.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.01 143.28 22.36 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 168.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.12 -60.94 2.69 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.589 0.631 . . . . 0.0 112.479 -175.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -146.87 165.66 29.06 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.971 1.367 . . . . 0.0 112.02 -175.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -31.91 -36.29 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 130.736 3.614 . . . . 0.0 113.139 166.33 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -48.59 -66.26 0.43 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 127.208 2.203 . . . . 0.0 113.608 172.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 10.7 mt -70.24 -31.9 69.52 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 119.434 1.015 . . . . 0.0 110.179 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.49 -40.64 97.62 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 118.894 0.77 . . . . 0.0 111.123 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -68.99 -55.46 10.81 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 117.664 -1.16 . . . . 0.0 111.585 169.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.93 -31.6 72.72 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 120.64 1.564 . . . . 0.0 113.36 -172.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.5 tt -71.8 -54.76 9.17 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.765 0.826 . . . . 0.0 109.307 168.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.39 -24.48 75.01 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 124.708 1.147 . . . . 0.0 115.475 -167.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 -74.33 -25.17 59.38 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 126.713 2.005 . . . . 0.0 111.908 168.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.3 tp 76.73 108.71 0.08 Allowed 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 129.336 3.054 . . . . 0.0 110.553 -178.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.721 HG23 HG12 ' A' ' 92' ' ' VAL . 14.8 m -54.17 2.79 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 129.016 2.926 . . . . 0.0 117.099 -176.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 74.73 -5.3 2.16 Favored 'General case' 0 C--O 1.218 -0.577 0 O-C-N 120.21 -1.556 . . . . 0.0 113.217 162.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.721 HG12 HG23 ' A' ' 90' ' ' VAL . 7.4 p -64.88 43.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 127.951 2.501 . . . . 0.0 113.424 168.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER 59.55 10.34 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.887 0 C-N-CA 128.332 2.653 . . . . 0.0 113.882 174.318 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 18.9 tp 77.47 107.0 0.08 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 127.254 2.222 . . . . 0.0 107.639 -165.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.401 ' CB ' HD12 ' B' ' 11' ' ' LEU . . . -51.4 141.87 14.65 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.834 0.854 . . . . 0.0 112.872 172.534 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.4 m -149.92 165.01 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 127.693 2.397 . . . . 0.0 108.79 -176.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -75.2 26.97 0.09 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.707 2.403 . . . . 0.0 114.593 -172.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 18.2 p -114.46 44.54 1.7 Allowed 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.581 1.953 . . . . 0.0 109.967 168.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 16.4 p30 -68.59 38.93 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 129.232 3.013 . . . . 0.0 113.668 176.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.22 135.81 68.57 Favored Pre-proline 0 CA--C 1.556 1.198 0 C-N-CA 125.778 1.631 . . . . 0.0 110.788 172.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -75.58 -156.11 0.05 OUTLIER 'Trans proline' 0 CA--C 1.544 0.984 1 C-N-CA 126.155 4.57 . . . . 0.0 115.587 -164.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 16.5 t -69.86 -161.18 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 127.825 2.45 . . . . 0.0 114.341 -177.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 45.4 t -153.94 -78.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 128.2 2.6 . . . . 0.0 109.439 -169.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -85.77 40.17 0.84 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.501 1.52 . . . . 0.0 113.967 -176.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -172.98 -176.54 1.43 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.523 2.329 . . . . 0.0 110.708 179.028 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.6 ptt180 . . . . . 0 N--CA 1.476 0.861 0 C-N-CA 125.462 1.505 . . . . 0.0 113.788 172.274 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.544 0 CA-C-O 120.877 0.37 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.593 ' HG ' HG11 ' A' ' 92' ' ' VAL . 0.6 OUTLIER -65.78 -46.23 79.5 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-O 118.148 -0.93 . . . . 0.0 113.496 -169.644 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.77 -61.08 2.53 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.923 -178.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 7.4 ptp85 -61.31 -33.3 73.35 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.613 1.097 . . . . 0.0 112.889 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.54 -65.87 0.62 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.605 0.762 . . . . 0.0 110.233 174.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.57 -28.37 69.53 Favored Glycine 0 C--O 1.22 -0.736 0 CA-C-O 117.288 -1.84 . . . . 0.0 112.395 -169.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.56 -13.03 61.7 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 120.926 2.363 . . . . 0.0 114.343 173.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -108.58 -8.29 15.52 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.438 1.495 . . . . 0.0 112.746 170.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . 0.453 HD12 ' HA ' ' B' ' 18' ' ' LEU . 4.7 tp -93.39 -37.13 12.15 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.848 1.259 . . . . 0.0 110.456 176.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.16 37.42 0.44 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 128.335 2.654 . . . . 0.0 115.324 -176.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.409 ' CG ' ' HE ' ' B' ' 23' ' ' ARG . 0.2 OUTLIER -104.72 165.48 13.2 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 129.141 2.976 . . . . 0.0 112.045 -169.865 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.58 -105.8 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.355 1 C-N-CA 125.975 4.45 . . . . 0.0 111.011 169.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -45.89 -36.64 5.52 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 127.194 2.197 . . . . 0.0 113.516 175.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.419 ' CD ' HD13 ' B' ' 58' ' ' LEU . 0.0 OUTLIER -66.94 -33.56 75.85 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 -178.377 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 43.8 t -62.2 -49.34 76.17 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.1 0.864 . . . . 0.0 110.109 169.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 80.2 mtt-85 -53.26 -46.91 69.41 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.495 1.118 . . . . 0.0 113.119 174.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 3.5 mt -44.57 -63.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 123.975 0.91 . . . . 0.0 110.504 169.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.44 -39.46 93.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 117.917 -1.039 . . . . 0.0 113.128 -169.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -64.56 -25.23 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 CA-C-N 119.294 0.952 . . . . 0.0 112.418 176.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . 0.431 ' HB1' ' CD2' ' B' ' 43' ' ' HIS . . . -89.59 -27.17 20.4 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 174.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.3 -39.6 91.08 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.892 1.277 . . . . 0.0 112.872 -175.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -43.79 -45.51 7.32 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 128.709 2.804 . . . . 0.0 112.116 176.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -108.76 9.56 26.9 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 127.614 2.365 . . . . 0.0 111.569 175.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.19 -33.53 3.67 Favored Glycine 0 C--O 1.222 -0.626 0 CA-C-O 117.015 -1.992 . . . . 0.0 114.395 -169.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . 0.515 HG12 ' HA ' ' B' ' 76' ' ' ALA . 34.3 m -10.88 51.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 N-CA-C 121.787 3.995 . . . . 0.0 121.787 170.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 35.8 m -119.94 -60.51 1.7 Allowed 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.189 -1.569 . . . . 0.0 112.532 -176.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -162.58 165.4 15.37 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 -174.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -58.06 128.82 30.26 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 122.564 2.176 . . . . 0.0 107.879 167.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.13 2.65 73.21 Favored Glycine 0 CA--C 1.528 0.875 0 CA-C-O 116.912 -2.049 . . . . 0.0 114.895 -176.062 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -39.08 80.58 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 121.44 2.62 . . . . 0.0 110.255 169.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 9.7 mt -58.85 -20.86 54.66 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 126.193 1.797 . . . . 0.0 112.561 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.9 -35.56 80.46 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.703 0.401 . . . . 0.0 111.593 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.95 -46.72 64.67 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.243 0.617 . . . . 0.0 111.15 170.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . 0.431 ' CD2' ' HB1' ' B' ' 29' ' ' ALA . 4.7 m-70 -58.27 -38.59 77.26 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 114.128 1.158 . . . . 0.0 114.128 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 27.8 mt -97.13 -16.55 20.41 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.4 1.08 . . . . 0.0 113.545 -173.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.07 5.14 64.81 Favored Glycine 0 CA--C 1.537 1.445 0 CA-C-N 119.249 0.931 . . . . 0.0 113.931 -169.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 96.5 mt -108.33 146.11 33.45 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.926 1.29 . . . . 0.0 111.251 -173.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 10.3 t -57.83 139.16 54.75 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.485 0.66 . . . . 0.0 112.448 -173.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -58.6 -32.19 68.76 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.208 1.003 . . . . 0.0 112.911 -176.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 4.1 m -62.26 -44.8 95.72 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.636 0.653 . . . . 0.0 111.862 173.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -77.79 -39.99 42.11 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -178.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 61.2 t -60.46 -38.44 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 118.992 0.815 . . . . 0.0 110.695 173.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 18.4 m -69.21 -24.2 63.99 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 177.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -56.09 -43.95 78.53 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 122.916 1.341 . . . . 0.0 111.232 173.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 24.7 m-70 -74.11 -17.26 60.96 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 125.11 1.364 . . . . 0.0 114.525 170.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 96.0 mt -76.65 -28.99 56.23 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 120.394 1.452 . . . . 0.0 112.297 169.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 7.6 t -46.67 -56.19 6.53 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.95 0.796 . . . . 0.0 111.901 -179.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 52.7 t -78.4 -28.98 47.02 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 118.321 -0.847 . . . . 0.0 113.262 177.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.419 HD13 ' CD ' ' B' ' 23' ' ' ARG . 6.4 tp -52.2 -41.03 62.34 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 120.84 1.654 . . . . 0.0 111.461 175.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 30.4 mtm180 -81.94 -21.64 37.16 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.283 1.433 . . . . 0.0 112.521 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.71 -39.96 11.4 Favored Glycine 0 N--CA 1.477 1.402 0 C-N-CA 124.969 1.271 . . . . 0.0 113.024 174.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 20.9 m -72.12 -11.79 60.91 Favored 'General case' 0 CA--C 1.561 1.371 0 C-N-CA 126.185 1.794 . . . . 0.0 111.883 169.086 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.96 11.8 85.04 Favored Glycine 0 N--CA 1.472 1.085 0 C-N-CA 124.818 1.199 . . . . 0.0 114.593 169.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 20.7 mt -67.71 -33.87 75.75 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.991 1.316 . . . . 0.0 111.492 -178.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -112.02 145.43 18.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 C-N-CA 127.865 2.466 . . . . 0.0 110.314 170.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.07 143.94 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.902 1.281 . . . . 0.0 110.796 177.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.09 136.67 52.62 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.015 0.926 . . . . 0.0 112.293 171.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 2.8 m -134.28 144.63 48.45 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 106.02 -1.845 . . . . 0.0 106.02 168.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -82.14 103.82 12.03 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 118.948 0.795 . . . . 0.0 110.13 169.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.27 1.1 pp20? -71.65 -160.49 0.06 Allowed 'General case' 0 CA--C 1.559 1.298 0 CA-C-N 118.249 0.477 . . . . 0.0 111.83 168.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -60.48 -27.54 66.03 Favored Glycine 0 CA--C 1.536 1.373 0 O-C-N 119.53 -1.982 . . . . 0.0 115.607 -169.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 3.4 tpt85 -157.93 11.44 0.19 Allowed 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 174.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.24 176.83 8.68 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.734 1.613 . . . . 0.0 110.724 -177.021 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 7.1 p -90.15 134.45 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 168.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.18 161.99 17.67 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.098 1.759 . . . . 0.0 110.184 174.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -117.29 118.71 33.02 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 121.853 -0.529 . . . . 0.0 110.306 175.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.515 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -106.3 149.04 27.31 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.674 1.59 . . . . 0.0 110.724 177.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 tp -58.23 151.86 18.43 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 166.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.14 -66.76 0.47 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 121.926 0.87 . . . . 0.0 112.923 -174.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -142.07 163.4 32.97 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.953 1.359 . . . . 0.0 111.049 -178.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -32.51 -35.2 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 130.681 3.592 . . . . 0.0 113.159 166.587 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -48.54 -69.77 0.11 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.312 2.245 . . . . 0.0 113.56 170.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 17.0 mt -64.92 -32.35 74.02 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 120.097 1.317 . . . . 0.0 110.266 179.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.08 -41.97 98.73 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 118.782 0.719 . . . . 0.0 110.896 -177.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 19.0 tpp85 -68.27 -54.17 19.45 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.628 1.171 . . . . 0.0 111.863 171.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.02 -33.78 75.0 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 120.325 1.421 . . . . 0.0 113.347 -173.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 4.7 tt -70.12 -54.49 12.76 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.613 0.765 . . . . 0.0 109.522 168.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.68 -25.12 75.88 Favored Glycine 0 CA--C 1.54 1.609 0 C-N-CA 124.982 1.277 . . . . 0.0 115.282 -167.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -70.78 -29.25 65.4 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 126.461 1.904 . . . . 0.0 111.07 167.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 20.6 tp 81.46 121.21 0.05 OUTLIER 'General case' 0 C--N 1.341 0.222 0 C-N-CA 130.147 3.379 . . . . 0.0 109.581 -172.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . 0.747 HG23 HG12 ' B' ' 92' ' ' VAL . 12.0 m -62.01 3.72 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.242 0 C-N-CA 125.208 1.403 . . . . 0.0 114.739 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 71.75 -9.79 0.92 Allowed 'General case' 0 C--O 1.217 -0.612 0 C-N-CA 125.404 1.482 . . . . 0.0 114.605 165.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.747 HG12 HG23 ' B' ' 90' ' ' VAL . 7.9 p -59.39 45.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 C-N-CA 129.35 3.06 . . . . 0.0 115.242 171.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.3 t 63.29 5.97 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 C-N-CA 128.865 2.866 . . . . 0.0 113.742 173.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 18.6 tp 80.66 109.38 0.07 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 127.608 2.363 . . . . 0.0 106.308 -164.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.4 ' CB ' HD12 ' A' ' 11' ' ' LEU . . . -50.92 142.96 10.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.506 0.722 . . . . 0.0 112.863 171.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 3.7 m -152.22 163.25 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 127.317 2.247 . . . . 0.0 108.766 -175.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -73.98 24.43 0.08 Allowed 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 127.744 2.417 . . . . 0.0 114.697 -173.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 19.5 p -113.68 40.76 2.34 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 126.621 1.968 . . . . 0.0 109.874 168.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 19.2 p-10 -71.23 46.69 0.11 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 129.436 3.094 . . . . 0.0 112.49 177.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.15 138.73 84.09 Favored Pre-proline 0 CA--C 1.556 1.203 0 C-N-CA 126.884 2.074 . . . . 0.0 110.565 175.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -72.1 -162.08 0.11 Allowed 'Trans proline' 0 C--N 1.356 0.95 1 C-N-CA 126.802 5.001 . . . . 0.0 117.401 -163.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 13.0 t -64.49 -158.07 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 125.826 1.65 . . . . 0.0 113.786 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -169.1 -29.29 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 117.042 2.238 . . . . 0.0 117.042 -165.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -139.13 42.06 2.08 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.817 1.19 . . . . 0.0 111.137 -175.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 178.65 -167.77 0.07 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 130.52 3.528 . . . . 0.0 108.138 -169.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.478 0.929 0 C-N-CA 127.225 2.21 . . . . 0.0 112.91 169.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.86 -36.01 77.62 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 117.672 -1.156 . . . . 0.0 113.158 -169.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.6 -58.19 7.03 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 120.72 1.6 . . . . 0.0 111.711 176.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -54.73 -40.09 68.9 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.076 1.35 . . . . 0.0 112.856 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -75.34 -53.89 7.99 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.823 1.249 . . . . 0.0 111.55 177.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.18 -17.98 70.64 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-O 118.103 -1.387 . . . . 0.0 112.895 -175.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.42 HH21 ' CG ' ' B' ' 99' ' ' ASP . 66.2 mtt-85 -56.92 -19.59 18.68 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 119.844 1.822 . . . . 0.0 113.45 168.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -109.18 -6.53 15.54 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.576 1.151 . . . . 0.0 114.051 169.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.6 tp -101.34 -32.11 10.63 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 119.728 1.149 . . . . 0.0 111.638 -175.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -87.0 65.8 9.13 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 127.503 2.321 . . . . 0.0 111.133 -178.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -138.07 167.73 18.93 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 125.769 1.628 . . . . 0.0 110.541 -174.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -66.31 -103.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.553 1.432 1 C-N-CA 125.622 4.215 . . . . 0.0 111.059 169.037 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.0 p -37.56 -45.89 0.79 Allowed 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 128.347 2.659 . . . . 0.0 113.175 169.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.55 ' HG2' HD13 ' A' ' 58' ' ' LEU . 5.1 ttm180 -62.83 -42.45 99.74 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.108 0.867 . . . . 0.0 111.621 -171.579 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 19.5 t -58.27 -53.5 57.6 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 118.324 0.511 . . . . 0.0 110.385 168.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 -53.84 -36.38 62.5 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 178.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.457 HG13 ' HA ' ' A' ' 23' ' ' ARG . 1.5 mt -48.75 -58.43 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 CA-C-N 119.593 1.088 . . . . 0.0 109.039 170.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 79.0 mt -66.21 -37.45 85.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.435 -171.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.442 HG12 HD21 ' A' ' 86' ' ' LEU . 0.9 OUTLIER -69.33 -31.9 51.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 122.719 0.407 . . . . 0.0 111.934 177.513 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.02 -30.47 31.47 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.356 1.062 . . . . 0.0 112.709 177.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.42 ' O ' HG13 ' A' ' 34' ' ' VAL . 1.0 OUTLIER -65.47 -35.51 81.13 Favored 'General case' 0 C--O 1.224 -0.243 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 177.911 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.3 mt -46.18 -21.59 0.17 Allowed 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 117.3 -1.333 . . . . 0.0 114.55 169.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -122.38 -35.04 3.18 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 126.392 1.877 . . . . 0.0 113.815 178.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.9 -76.54 0.94 Allowed Glycine 0 N--CA 1.475 1.253 0 C-N-CA 127.043 2.259 . . . . 0.0 113.172 -170.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.42 HG13 ' O ' ' A' ' 30' ' ' LEU . 1.4 m 45.44 31.29 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 C-N-CA 125.283 1.433 . . . . 0.0 114.82 178.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 32.8 m -88.16 -79.3 0.3 Allowed 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.141 0.976 . . . . 0.0 112.888 -178.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.476 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 2.5 m-85 -140.54 154.86 69.74 Favored Pre-proline 0 N--CA 1.478 0.961 0 N-CA-C 114.371 1.249 . . . . 0.0 114.371 -168.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -66.41 16.05 0.11 Allowed 'Trans proline' 0 CA--C 1.55 1.322 0 C-N-CA 124.668 3.579 . . . . 0.0 115.068 171.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -124.21 -10.37 5.16 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 125.885 1.707 . . . . 0.0 113.688 168.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.476 ' HG2' ' H ' ' A' ' 36' ' ' TYR . 0.0 OUTLIER -71.59 -39.75 70.33 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 119.695 1.747 . . . . 0.0 111.115 -174.301 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.7 mt -57.18 -19.2 19.21 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 123.925 0.89 . . . . 0.0 112.915 173.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.19 -30.99 71.94 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 120.019 1.281 . . . . 0.0 112.036 -179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -79.81 -49.96 11.22 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.565 0.746 . . . . 0.0 111.304 173.114 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -53.89 -31.11 48.79 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.409 HD11 HG12 ' A' ' 26' ' ' ILE . 60.0 mt -102.52 -7.6 21.74 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.848 1.659 . . . . 0.0 112.995 -177.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.27 0.72 8.17 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.272 1.415 . . . . 0.0 114.069 -173.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.5 mp -110.76 144.21 40.08 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 124.334 1.054 . . . . 0.0 111.864 -169.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.9 t -59.42 149.22 29.99 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-O 121.932 0.873 . . . . 0.0 111.205 177.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -63.42 -16.24 59.96 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.966 1.098 . . . . 0.0 113.966 -170.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.8 p -71.34 -48.3 51.18 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.065 1.302 . . . . 0.0 112.043 168.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -60.67 -43.1 98.06 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.219 0.918 . . . . 0.0 111.48 172.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 69.6 t -62.84 -40.95 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 O-C-N 121.827 -0.546 . . . . 0.0 111.34 176.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 73.8 m -62.14 -36.93 83.3 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 178.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -56.39 -41.54 76.45 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.138 0.575 . . . . 0.0 111.778 172.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -73.66 -35.23 65.22 Favored 'General case' 0 CA--C 1.558 1.288 0 O-C-N 121.264 -0.897 . . . . 0.0 112.805 174.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.1 mt -69.88 -37.02 75.91 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 120.607 1.549 . . . . 0.0 114.127 176.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 38.9 m -54.61 -39.72 68.17 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.926 1.239 . . . . 0.0 113.094 -177.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 9.0 t -67.63 -43.53 80.16 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 118.578 0.626 . . . . 0.0 112.021 175.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.55 HD13 ' HG2' ' A' ' 23' ' ' ARG . 3.3 tp -61.96 -37.33 84.35 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 127.94 2.496 . . . . 0.0 112.823 -175.706 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.0 mtm105 -82.35 2.45 32.25 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.34 1.856 . . . . 0.0 112.721 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -112.63 -45.16 0.79 Allowed Glycine 0 N--CA 1.475 1.241 0 C-N-CA 126.582 2.039 . . . . 0.0 112.352 173.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 98.6 m -66.01 3.31 0.86 Allowed 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 127.2 2.2 . . . . 0.0 113.751 171.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 58.21 35.89 79.99 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 125.625 1.583 . . . . 0.0 113.687 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.6 mt -86.56 -29.07 22.92 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.563 1.145 . . . . 0.0 112.698 173.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.1 m -140.17 143.84 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 125.39 1.476 . . . . 0.0 112.115 -175.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.4 t -131.12 142.81 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 125.98 1.712 . . . . 0.0 110.236 -174.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.08 158.35 35.88 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.475 1.91 . . . . 0.0 113.961 176.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.3 m -156.67 174.71 15.05 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 168.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -111.07 119.34 38.7 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.481 0.712 . . . . 0.0 110.519 169.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -77.42 -157.32 0.09 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.248 0.619 . . . . 0.0 110.767 167.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -63.86 -24.9 68.74 Favored Glycine 0 CA--C 1.537 1.465 0 O-C-N 119.479 -2.013 . . . . 0.0 115.819 -171.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -157.18 2.0 0.12 Allowed 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 119.298 1.549 . . . . 0.0 114.861 172.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -125.39 164.23 20.87 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 126.017 1.727 . . . . 0.0 109.584 -179.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 30.7 m -79.21 150.75 5.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 166.238 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -125.57 179.86 4.95 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.411 1.485 . . . . 0.0 110.205 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.412 ' O ' HG12 ' A' ' 34' ' ' VAL . 35.4 m-85 -142.87 132.06 23.24 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 124.443 1.097 . . . . 0.0 110.849 174.392 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.78 162.01 29.42 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.793 2.037 . . . . 0.0 110.079 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.0 mp -57.47 149.52 20.77 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 119.026 0.83 . . . . 0.0 110.293 169.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.5 -21.03 66.18 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 114.684 1.364 . . . . 0.0 114.684 -172.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -170.92 173.44 5.16 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 122.416 1.103 . . . . 0.0 113.223 168.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 52.9 p -40.5 -31.3 0.14 Allowed 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 128.958 2.903 . . . . 0.0 112.284 165.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -44.16 -76.27 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 127.379 2.272 . . . . 0.0 112.762 168.047 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.665 ' H ' HD22 ' A' ' 82' ' ' LEU . 0.0 OUTLIER -71.17 -28.69 64.43 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -171.635 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.5 -45.51 93.9 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.125 0.97 . . . . 0.0 111.586 177.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . 0.281 3.1 ppt_? -72.66 -46.12 55.51 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.618 177.112 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.09 -42.51 90.64 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 179.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.442 HD21 HG12 ' A' ' 28' ' ' VAL . 3.1 tt -73.54 -43.46 59.87 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 121.534 -0.729 . . . . 0.0 110.408 175.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.88 -35.92 57.94 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.261 0.934 . . . . 0.0 113.753 -172.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -78.21 -3.56 43.29 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.858 1.263 . . . . 0.0 112.353 169.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 54.8 tp 67.48 107.73 0.04 OUTLIER 'General case' 0 C--N 1.342 0.275 0 C-N-CA 129.028 2.931 . . . . 0.0 111.579 169.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.7 m -66.59 23.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 125.999 1.72 . . . . 0.0 114.424 178.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.406 ' C ' ' H ' ' A' ' 93' ' ' VAL . 28.1 mm-40 83.07 -13.93 0.77 Allowed 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.399 -1.438 . . . . 0.0 112.116 152.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 14.4 p -54.77 32.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.525 1 C-N-CA 133.166 4.587 . . . . 0.0 116.475 169.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.406 ' H ' ' C ' ' A' ' 91' ' ' GLN . 2.1 t 58.48 31.32 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 128.193 2.597 . . . . 0.0 111.533 168.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 79.37 113.87 0.07 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 127.589 2.356 . . . . 0.0 105.715 -165.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.51 64.68 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 127.201 2.2 . . . . 0.0 114.803 -179.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -51.57 161.16 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 127.631 2.372 . . . . 0.0 113.008 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -90.03 16.67 7.93 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 128.542 2.737 . . . . 0.0 114.422 -172.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 10.2 p -86.98 150.19 24.24 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.229 1.411 . . . . 0.0 112.402 176.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -140.7 139.99 34.83 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.904 1.682 . . . . 0.0 110.623 176.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -163.05 158.61 18.4 Favored Pre-proline 0 CA--C 1.541 0.609 0 O-C-N 120.32 -1.488 . . . . 0.0 111.727 -166.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -73.6 174.66 11.86 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 122.478 2.118 . . . . 0.0 108.275 165.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 48.9 t -50.97 143.46 10.24 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 123.182 1.468 . . . . 0.0 114.033 -171.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 85.9 t -54.62 -31.98 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 C-N-CA 126.016 1.726 . . . . 0.0 111.669 178.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.5 -23.47 63.62 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 177.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -112.93 11.67 19.19 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.186 1.794 . . . . 0.0 113.557 177.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.536 0.422 0 C-N-CA 124.804 1.242 . . . . 0.0 113.3 -172.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.137 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.64 -34.4 72.01 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 117.479 -1.248 . . . . 0.0 113.437 -168.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.24 -57.73 9.5 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.858 1.663 . . . . 0.0 111.425 174.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 13.9 mtp85 -54.46 -38.96 66.97 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.173 1.389 . . . . 0.0 112.398 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -76.22 -54.01 7.42 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.319 1.448 . . . . 0.0 112.497 177.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -73.42 -14.75 79.24 Favored Glycine 0 CA--C 1.53 1.009 0 CA-C-O 117.907 -1.496 . . . . 0.0 112.704 -174.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 62.1 mtt-85 -57.9 -12.79 3.5 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 119.947 1.873 . . . . 0.0 113.658 168.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -122.41 -1.44 9.12 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 126.026 1.73 . . . . 0.0 113.978 170.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 3.9 tp -106.91 -30.3 8.95 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.615 1.098 . . . . 0.0 111.566 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.22 66.61 9.81 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 127.405 2.282 . . . . 0.0 110.331 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.484 ' CB ' ' HB3' ' B' ' 23' ' ' ARG . 0.3 OUTLIER -138.61 162.93 50.34 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 125.724 1.61 . . . . 0.0 111.343 -171.851 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -69.65 -100.54 0.01 OUTLIER 'Trans proline' 0 CA--C 1.551 1.337 0 C-N-CA 125.184 3.922 . . . . 0.0 109.584 169.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 22.7 p -36.74 -46.4 0.6 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 129.028 2.931 . . . . 0.0 113.458 168.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.484 ' HB3' ' CB ' ' B' ' 20' ' ' ASP . 7.4 ttm180 -70.9 -37.06 72.95 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.582 1.083 . . . . 0.0 112.947 -171.109 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 12.1 t -60.03 -52.47 65.24 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.853 0.835 . . . . 0.0 109.254 167.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 3.9 mmt85 -55.65 -36.75 67.39 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 177.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . 0.608 HG12 HD11 ' B' ' 44' ' ' LEU . 1.7 mt -49.9 -60.1 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 CA-C-N 119.756 1.162 . . . . 0.0 108.945 171.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 87.9 mt -63.78 -38.8 92.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 118.144 -0.932 . . . . 0.0 111.748 -173.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . 0.475 HG12 HD21 ' B' ' 86' ' ' LEU . 1.0 OUTLIER -68.93 -33.72 60.54 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 CA-C-N 119.149 0.886 . . . . 0.0 111.881 177.659 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.44 -23.99 27.64 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.664 0.786 . . . . 0.0 113.028 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.406 ' O ' HG13 ' B' ' 34' ' ' VAL . 0.9 OUTLIER -63.06 -45.05 94.02 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 117.749 -1.12 . . . . 0.0 112.27 171.819 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -42.61 -43.16 3.68 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.719 2.408 . . . . 0.0 113.573 -174.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -100.47 -31.85 11.09 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.104 1.762 . . . . 0.0 112.67 177.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.04 -61.03 2.17 Favored Glycine 0 C--N 1.343 0.937 0 C-N-CA 124.542 1.068 . . . . 0.0 113.933 -171.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . 0.46 HG12 ' O ' ' B' ' 75' ' ' TYR . 0.2 OUTLIER 30.91 46.59 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 C-N-CA 127.598 2.359 . . . . 0.0 115.192 178.974 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 3.3 m -107.73 -67.91 0.93 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.665 1.586 . . . . 0.0 112.777 -176.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -143.17 152.77 58.77 Favored Pre-proline 0 N--CA 1.476 0.839 0 N-CA-C 118.786 2.884 . . . . 0.0 118.786 -167.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -68.27 8.93 0.44 Allowed 'Trans proline' 0 CA--C 1.55 1.289 0 C-N-CA 124.689 3.593 . . . . 0.0 113.764 168.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -122.43 -10.18 6.17 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 125.811 1.672 . . . . 0.0 113.754 168.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.51 -40.11 80.98 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 119.717 1.758 . . . . 0.0 110.331 -177.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 47.7 mt -63.14 -11.34 19.64 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 124.05 0.94 . . . . 0.0 112.355 -179.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -73.2 -33.69 65.53 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 119.743 -0.783 . . . . 0.0 111.003 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.56 -53.46 10.48 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.173 0.989 . . . . 0.0 110.34 169.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -52.62 -30.86 33.69 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 115.26 1.578 . . . . 0.0 115.26 -178.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.678 HD12 HG22 ' B' ' 51' ' ' VAL . 65.5 mt -102.4 -18.78 15.22 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.319 1.447 . . . . 0.0 113.349 -178.024 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.51 -1.54 56.92 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.555 1.074 . . . . 0.0 113.854 -170.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 8.5 mp -110.95 146.94 35.71 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 119.222 1.511 . . . . 0.0 112.313 -174.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 8.9 t -56.37 150.52 14.68 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 122.291 1.043 . . . . 0.0 112.383 176.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -63.98 -14.18 52.05 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -171.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 13.5 p -72.66 -44.01 62.39 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 120.144 1.338 . . . . 0.0 112.235 169.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -61.27 -44.7 96.8 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 118.673 0.669 . . . . 0.0 111.506 170.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . 0.678 HG22 HD12 ' B' ' 44' ' ' LEU . 52.6 t -57.73 -47.54 85.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.831 174.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 75.5 m -59.53 -40.3 86.72 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.86 0.864 . . . . 0.0 113.155 -177.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -54.32 -46.26 72.81 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.921 0.888 . . . . 0.0 112.086 171.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -73.67 -28.22 61.64 Favored 'General case' 0 CA--C 1.558 1.27 0 O-C-N 121.141 -0.974 . . . . 0.0 112.682 176.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 45.3 mt -73.66 -33.98 64.72 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 120.864 1.665 . . . . 0.0 113.613 174.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 33.6 m -52.78 -40.67 63.39 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.447 1.022 . . . . 0.0 113.461 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.2 t -70.16 -39.64 75.22 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.208 0.913 . . . . 0.0 112.329 177.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 2.3 tp -60.95 -47.47 86.27 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 128.071 2.548 . . . . 0.0 111.688 -174.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 33.1 mtm105 -80.17 4.75 16.42 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.827 1.651 . . . . 0.0 112.214 177.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -106.22 -47.62 1.06 Allowed Glycine 0 CA--C 1.532 1.112 0 C-N-CA 125.958 1.742 . . . . 0.0 112.02 169.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 92.8 m -76.56 13.74 0.92 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 126.514 1.925 . . . . 0.0 114.431 177.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 61.03 29.06 69.92 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 125.731 1.634 . . . . 0.0 114.418 174.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 24.9 mt -80.78 -26.49 37.17 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.377 -1.072 . . . . 0.0 112.943 176.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.5 m -147.17 152.3 13.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 126.152 1.781 . . . . 0.0 112.572 -171.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -130.13 158.12 42.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.783 1.633 . . . . 0.0 111.187 173.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.53 161.08 30.1 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.04 1.336 . . . . 0.0 112.267 167.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.401 HG22 ' H ' ' B' ' 68' ' ' TYR . 1.1 m -156.56 176.71 12.35 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 125.583 1.553 . . . . 0.0 107.046 168.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.401 ' H ' HG22 ' B' ' 67' ' ' THR . 38.6 t80 -117.52 118.88 33.36 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.928 0.891 . . . . 0.0 111.344 172.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.25 1.2 pp20? -77.32 -151.96 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.457 0.703 . . . . 0.0 111.233 167.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -66.98 -24.79 73.2 Favored Glycine 0 CA--C 1.54 1.594 0 O-C-N 119.572 -1.955 . . . . 0.0 116.035 -173.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 5.4 ttp85 -158.71 0.32 0.09 Allowed 'General case' 0 N--CA 1.482 1.126 0 CA-C-N 119.263 1.532 . . . . 0.0 114.528 174.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -124.98 162.93 23.43 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 126.11 1.764 . . . . 0.0 109.327 -178.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 20.8 m -80.29 152.44 4.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 O-C-N 121.709 -0.619 . . . . 0.0 109.415 165.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 8.0 ptt180 -124.62 172.47 9.22 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.263 1.425 . . . . 0.0 110.331 174.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.46 ' O ' HG12 ' B' ' 34' ' ' VAL . 28.3 m-85 -120.7 143.79 48.56 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.321 1.048 . . . . 0.0 110.027 167.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -142.02 149.45 40.0 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.566 1.546 . . . . 0.0 110.566 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 6.1 mp -52.93 146.78 10.25 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 119.216 0.916 . . . . 0.0 109.138 169.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.17 -16.22 63.27 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -172.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -169.91 172.4 6.63 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 123.055 1.407 . . . . 0.0 112.51 171.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 86.4 p -49.73 -26.13 3.55 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.408 2.283 . . . . 0.0 111.282 163.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 8.5 t60 -60.26 -58.06 10.11 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 128.298 2.639 . . . . 0.0 112.032 179.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.11 -33.15 71.49 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 120.579 1.536 . . . . 0.0 110.25 174.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.13 -37.41 82.74 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.949 0.9 . . . . 0.0 112.318 -176.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.26 -44.02 63.45 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-O 117.506 -1.235 . . . . 0.0 111.683 174.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.09 -43.72 95.32 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 120.017 1.281 . . . . 0.0 113.518 177.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.475 HD21 HG12 ' B' ' 28' ' ' VAL . 5.0 tt -67.02 -49.78 64.18 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.084 0.954 . . . . 0.0 110.312 174.059 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.81 -33.04 47.78 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.84 1.21 . . . . 0.0 114.623 -167.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -74.11 -10.96 60.14 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 118.958 1.379 . . . . 0.0 112.201 169.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 57.9 tp 69.66 110.3 0.05 Allowed 'General case' 0 C--O 1.235 0.303 0 C-N-CA 129.59 3.156 . . . . 0.0 110.939 171.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 21.0 m -66.32 23.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 C-N-CA 126.295 1.838 . . . . 0.0 114.286 177.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . 0.426 ' C ' ' H ' ' B' ' 93' ' ' VAL . 24.6 mm-40 78.22 -9.63 1.48 Allowed 'General case' 0 C--N 1.327 -0.402 0 O-C-N 120.43 -1.419 . . . . 0.0 113.166 156.323 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 11.2 p -54.22 26.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.25 1 C-N-CA 132.226 4.21 . . . . 0.0 115.993 167.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . 0.426 ' H ' ' C ' ' B' ' 91' ' ' GLN . 1.8 t 60.29 31.71 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 127.044 2.138 . . . . 0.0 111.589 167.52 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 80.86 112.33 0.07 Allowed 'General case' 0 C--N 1.347 0.485 0 C-N-CA 127.697 2.399 . . . . 0.0 106.338 -167.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.0 64.05 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 128.38 2.672 . . . . 0.0 114.861 176.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -54.54 150.48 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 126.723 2.009 . . . . 0.0 112.481 -177.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.61 13.5 0.35 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 130.042 3.337 . . . . 0.0 116.092 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 12.5 p -86.01 147.34 26.25 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.998 0.919 . . . . 0.0 112.122 173.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . 0.42 ' CG ' HH21 ' A' ' 16' ' ' ARG . 48.9 t0 -139.67 136.59 34.43 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.219 1.807 . . . . 0.0 111.587 175.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -164.47 155.05 12.94 Favored Pre-proline 0 CA--C 1.536 0.42 0 O-C-N 120.449 -1.407 . . . . 0.0 111.675 -167.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -73.29 172.38 15.73 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 122.244 1.963 . . . . 0.0 108.885 166.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 43.5 t -51.83 143.0 14.03 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 126.358 2.98 . . . . 0.0 114.187 -169.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.456 ' HA ' ' HB2' ' B' ' 106' ' ' ARG . 19.1 m -70.64 -18.78 21.31 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-N 109.752 -3.385 . . . . 0.0 112.47 -172.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.81 -24.11 61.67 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.127 0.971 . . . . 0.0 113.003 169.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -118.88 12.8 12.99 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 126.506 1.922 . . . . 0.0 114.205 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . 0.456 ' HB2' ' HA ' ' B' ' 103' ' ' VAL . 0.6 OUTLIER . . . . . 0 CA--C 1.536 0.429 0 C-N-CA 124.824 1.25 . . . . 0.0 113.399 -174.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.826 0 CA-C-O 122.635 1.207 . . . . 0.0 110.169 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -102.09 -37.81 8.0 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-O 117.287 -1.34 . . . . 0.0 113.568 -169.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.72 -37.99 63.87 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 121.611 2.005 . . . . 0.0 113.663 -172.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.551 HH21 ' HB3' ' A' ' 61' ' ' CYS . 0.0 OUTLIER -53.68 -23.26 10.87 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.645 0.979 . . . . 0.0 113.645 177.599 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.416 ' HG ' HG23 ' B' ' 92' ' ' VAL . 3.1 tm? -56.14 -41.82 75.96 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.29 1.836 . . . . 0.0 111.92 174.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.38 -35.8 92.54 Favored Glycine 0 CA--C 1.53 0.993 0 CA-C-N 120.388 1.449 . . . . 0.0 112.114 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.66 -45.71 61.17 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.803 0.841 . . . . 0.0 110.986 170.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.92 -24.17 67.63 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.728 1.149 . . . . 0.0 112.862 -178.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.7 mp -82.26 -28.39 31.85 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.014 0.825 . . . . 0.0 112.712 169.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -87.91 67.23 8.98 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.559 1.944 . . . . 0.0 112.831 173.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.536 ' HB3' HH11 ' A' ' 23' ' ' ARG . 31.3 t70 -143.55 135.86 13.33 Favored Pre-proline 0 CA--C 1.552 1.045 0 C-N-CA 128.241 2.616 . . . . 0.0 107.353 -176.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -52.68 -102.74 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.902 1 C-N-CA 127.26 5.307 . . . . 0.0 116.722 -163.677 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.4 m -56.0 -30.72 62.25 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.573 1.149 . . . . 0.0 110.511 -177.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.607 HH21 HD12 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -50.33 -42.08 52.26 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 172.717 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 36.8 t -58.7 -43.48 90.07 Favored 'General case' 0 N--CA 1.467 0.404 0 O-C-N 121.314 -0.866 . . . . 0.0 111.346 175.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.5 tpt180 -63.67 -29.47 70.7 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 118.051 -0.976 . . . . 0.0 112.118 174.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.491 HG13 ' HA ' ' A' ' 23' ' ' ARG . 1.6 mt -62.56 -53.57 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 120.756 1.616 . . . . 0.0 110.999 167.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.607 HD12 HH21 ' A' ' 23' ' ' ARG . 8.5 mt -60.17 -39.47 86.54 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 117.704 -1.141 . . . . 0.0 112.608 -177.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -68.73 -27.35 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 CA-C-N 120.292 1.406 . . . . 0.0 112.825 175.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.432 ' HB1' ' CD2' ' A' ' 43' ' ' HIS . . . -82.25 1.5 36.36 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 126.167 1.787 . . . . 0.0 114.222 169.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.64 -20.0 14.59 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 120.651 -1.281 . . . . 0.0 111.853 168.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.2 mt -66.79 -44.64 80.75 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.375 1.47 . . . . 0.0 109.218 165.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -132.49 95.94 3.73 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.666 1.986 . . . . 0.0 110.99 168.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -179.22 -83.48 0.06 OUTLIER Glycine 0 N--CA 1.468 0.769 0 C-N-CA 125.999 1.761 . . . . 0.0 110.592 171.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 19.5 m 43.06 25.37 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 116.881 2.178 . . . . 0.0 116.881 171.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 99.1 m -83.61 -76.48 0.29 Allowed 'General case' 0 C--O 1.223 -0.307 0 O-C-N 121.047 -1.033 . . . . 0.0 109.919 178.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.417 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 0.2 OUTLIER -139.38 159.71 64.84 Favored Pre-proline 0 CA--C 1.54 0.578 0 CA-C-O 118.549 -0.739 . . . . 0.0 112.902 -170.532 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -57.27 -18.8 31.81 Favored 'Trans proline' 0 CA--C 1.538 0.679 0 C-N-CA 123.183 2.588 . . . . 0.0 114.819 175.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -97.18 -6.48 57.74 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 118.175 -1.347 . . . . 0.0 115.766 172.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.417 ' HG2' ' H ' ' A' ' 36' ' ' TYR . 0.0 OUTLIER -70.37 -28.7 65.31 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.43 2.115 . . . . 0.0 113.143 -170.429 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 23.4 mt -63.75 -18.67 64.29 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 123.839 0.856 . . . . 0.0 111.717 178.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.24 -45.03 68.58 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.273 0.629 . . . . 0.0 111.496 177.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.46 -41.02 69.92 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.786 0.834 . . . . 0.0 112.151 176.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.432 ' CD2' ' HB1' ' A' ' 29' ' ' ALA . 14.0 m-70 -64.04 -21.37 66.48 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 114.903 1.446 . . . . 0.0 114.903 176.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 86.8 mt -115.32 -15.59 11.56 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.803 1.641 . . . . 0.0 114.029 -172.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.7 4.14 57.0 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 124.021 0.82 . . . . 0.0 113.405 -170.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 71.9 mt -102.31 172.86 6.64 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.814 1.246 . . . . 0.0 111.286 -176.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.1 p -86.27 158.34 19.72 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.503 -0.748 . . . . 0.0 110.065 175.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -61.92 -21.33 64.66 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 174.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.0 p -73.52 -52.58 13.05 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.078 -1.013 . . . . 0.0 109.712 168.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -69.77 -30.05 67.53 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.009 0.924 . . . . 0.0 112.505 -173.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 80.0 t -67.25 -30.26 48.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 O-C-N 120.681 -1.262 . . . . 0.0 111.769 167.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 74.3 m -70.52 -16.11 62.85 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.607 -1.308 . . . . 0.0 114.091 -175.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -54.2 -58.95 5.44 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.761 0.824 . . . . 0.0 110.635 169.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -77.02 -14.81 59.79 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-O 117.837 -1.078 . . . . 0.0 113.78 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 92.9 mt -70.81 -26.99 63.56 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 121.241 1.837 . . . . 0.0 111.668 169.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 65.1 p -59.26 -47.32 85.79 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 -175.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.9 t -72.97 -38.12 66.83 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.766 0.712 . . . . 0.0 111.829 172.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.5 tp -51.1 -48.86 61.58 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.202 1.001 . . . . 0.0 112.397 176.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.478 ' HG2' HG23 ' A' ' 64' ' ' VAL . 43.8 mtm180 -88.96 -5.54 57.89 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.627 1.571 . . . . 0.0 113.56 -176.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -100.9 -41.48 2.65 Favored Glycine 0 N--CA 1.474 1.2 0 C-N-CA 125.538 1.542 . . . . 0.0 112.811 175.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.551 ' HB3' HH21 ' A' ' 13' ' ' ARG . 3.8 m -77.44 8.73 3.87 Favored 'General case' 0 CA--C 1.552 1.051 0 O-C-N 120.832 -1.393 . . . . 0.0 113.297 169.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 58.41 34.65 75.92 Favored Glycine 0 CA--C 1.533 1.191 0 O-C-N 120.904 -1.123 . . . . 0.0 114.045 176.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 26.2 mt -82.38 -25.88 33.38 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.275 1.538 . . . . 0.0 111.989 171.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.478 HG23 ' HG2' ' A' ' 59' ' ' ARG . 2.5 m -133.98 149.3 30.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 127.34 2.256 . . . . 0.0 109.366 176.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.6 t -129.08 135.82 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 C-N-CA 124.995 1.318 . . . . 0.0 109.883 -176.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.72 148.23 44.87 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.671 1.189 . . . . 0.0 112.863 171.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 34.2 m -160.0 162.77 34.37 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.498 1.919 . . . . 0.0 106.584 -178.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -87.65 138.74 31.2 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.136 1.334 . . . . 0.0 110.917 169.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.98 -20.2 39.01 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 118.318 0.508 . . . . 0.0 112.239 169.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 139.76 -47.31 0.9 Allowed Glycine 0 CA--C 1.528 0.906 0 C-N-CA 126.009 1.766 . . . . 0.0 112.237 175.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 19.8 ttp180 -101.0 -29.67 12.05 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.562 1.945 . . . . 0.0 112.027 171.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.13 171.21 13.93 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.662 1.985 . . . . 0.0 110.913 -170.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 13.0 p -87.35 144.46 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 124.011 0.924 . . . . 0.0 109.438 169.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -128.8 174.22 9.66 Favored 'General case' 0 CA--C 1.522 -0.126 0 C-N-CA 126.244 1.818 . . . . 0.0 109.718 178.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -117.23 170.85 8.36 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.373 1.069 . . . . 0.0 109.08 166.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -164.97 154.97 13.5 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 126.46 1.904 . . . . 0.0 109.246 177.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 tp -56.71 142.44 40.22 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 119.315 0.961 . . . . 0.0 111.683 171.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -83.39 11.34 6.97 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 116.224 1.935 . . . . 0.0 116.224 -169.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 32.2 t0 165.65 144.87 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 128.69 2.796 . . . . 0.0 110.874 -179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 83.8 p -45.67 -29.87 1.39 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.924 2.089 . . . . 0.0 114.074 167.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -61.93 -49.74 74.93 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 124.062 0.945 . . . . 0.0 112.744 174.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 54.0 mt -60.85 -42.71 98.36 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 176.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.97 -34.08 65.38 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.617 1.167 . . . . 0.0 112.014 -174.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.7 mtt-85 -71.79 -60.68 2.11 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.417 1.087 . . . . 0.0 113.212 177.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.45 -34.6 75.69 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 120.309 1.413 . . . . 0.0 112.543 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 70.0 tp -62.46 -49.73 74.28 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.659 1.584 . . . . 0.0 110.795 169.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -67.93 -39.82 89.23 Favored Glycine 0 N--CA 1.475 1.239 0 C-N-CA 126.616 2.055 . . . . 0.0 113.926 -176.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 51.9 tp10 -64.79 -8.23 14.21 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 127.763 2.425 . . . . 0.0 112.713 168.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.3 tp 67.69 36.38 3.64 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 128.721 2.808 . . . . 0.0 110.6 169.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 3.8 m 48.63 -18.05 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 131.483 3.913 . . . . 0.0 117.366 -168.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 56.2 mm-40 69.94 -7.39 0.94 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 128.271 2.628 . . . . 0.0 114.076 -174.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.439 HG13 ' H ' ' A' ' 92' ' ' VAL . 0.7 OUTLIER -66.61 -10.38 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.346 0 C-N-CA 126.39 1.876 . . . . 0.0 114.467 170.813 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 79.5 42.57 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.043 0 C-N-CA 129.937 3.295 . . . . 0.0 113.158 168.071 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 tt 78.09 95.85 0.06 Allowed 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 123.614 1.673 . . . . 0.0 109.09 -168.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -49.55 70.72 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 128.355 2.662 . . . . 0.0 116.336 169.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 94.1 t -58.73 130.97 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 N-CA-C 106.09 -1.818 . . . . 0.0 106.09 165.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.598 ' HA ' ' HB3' ' B' ' 12' ' ' ALA . 29.0 t70 -60.93 -80.3 0.03 OUTLIER 'General case' 0 C--O 1.235 0.33 0 O-C-N 123.905 0.753 . . . . 0.0 112.294 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 5.7 p 66.24 132.59 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 128.785 2.834 . . . . 0.0 108.777 -169.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -84.92 83.67 7.97 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 120.974 1.715 . . . . 0.0 110.011 178.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.52 151.23 76.94 Favored Pre-proline 0 CA--C 1.551 1.007 0 CA-C-N 114.042 -1.435 . . . . 0.0 109.717 177.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -86.17 -102.39 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 124.083 3.189 . . . . 0.0 108.196 174.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 34.9 t -65.51 141.05 58.6 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 123.438 1.589 . . . . 0.0 109.784 165.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 19.2 m -104.85 6.04 10.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 112.657 -2.065 . . . . 0.0 111.541 -171.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.59 -37.15 85.81 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.897 1.279 . . . . 0.0 111.445 168.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -104.18 11.64 34.78 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.344 1.858 . . . . 0.0 111.437 -175.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.349 0.55 0 O-C-N 120.738 -1.226 . . . . 0.0 111.448 -177.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.294 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -73.31 4.0 5.16 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 -169.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.598 ' HB3' ' HA ' ' A' ' 97' ' ' ASP . . . -82.22 -39.82 22.54 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 121.016 1.734 . . . . 0.0 111.154 166.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -59.07 -21.37 59.06 Favored 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 124.583 1.153 . . . . 0.0 111.518 176.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -47.78 -47.07 30.87 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.976 2.511 . . . . 0.0 111.668 165.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.07 -15.0 69.1 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-O 119.139 -0.812 . . . . 0.0 112.557 -175.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.39 -56.25 4.59 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 166.303 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.24 -27.81 68.72 Favored 'General case' 0 CA--C 1.549 0.914 0 N-CA-C 115.583 1.698 . . . . 0.0 115.583 -173.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 5.8 mp -84.19 -20.05 33.01 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 119.284 0.947 . . . . 0.0 113.458 171.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.6 51.88 1.95 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.092 1.357 . . . . 0.0 110.995 169.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -117.21 146.85 39.14 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 127.511 2.325 . . . . 0.0 107.808 176.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -59.78 -94.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.929 1 C-N-CA 126.248 4.632 . . . . 0.0 113.663 -168.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.3 m -58.54 -24.23 60.17 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 120.773 -1.204 . . . . 0.0 111.213 175.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.465 ' HD3' ' CD1' ' B' ' 58' ' ' LEU . 13.1 ttm-85 -70.72 -41.22 72.18 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 113.977 1.102 . . . . 0.0 113.977 -178.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 38.1 t -56.02 -42.62 76.76 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.84 1.2 . . . . 0.0 109.449 169.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -64.66 -33.87 76.95 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 116.936 -1.507 . . . . 0.0 113.179 174.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.5 mt -56.8 -62.75 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 CA-C-N 121.317 1.871 . . . . 0.0 108.419 168.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 41.2 mt -54.88 -43.13 72.9 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.155 -0.926 . . . . 0.0 112.204 -170.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.9 p -74.59 -19.49 16.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-N 119.535 1.061 . . . . 0.0 113.197 -178.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.57 -27.46 21.36 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.486 1.515 . . . . 0.0 112.629 172.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.82 -47.02 83.83 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 125.5 1.52 . . . . 0.0 109.523 170.43 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.36 -61.11 1.8 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 129.946 3.298 . . . . 0.0 112.252 179.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -95.53 34.73 1.43 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.929 2.492 . . . . 0.0 110.395 174.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -128.92 -80.75 0.27 Allowed Glycine 0 C--N 1.337 0.613 0 C-N-CA 125.281 1.42 . . . . 0.0 113.532 -173.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 27.5 m 27.79 24.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 N-CA-C 119.651 3.204 . . . . 0.0 119.651 -174.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 76.1 m -83.7 -67.28 0.8 Allowed 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 121.331 1.878 . . . . 0.0 112.138 -178.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -147.15 162.57 32.24 Favored Pre-proline 0 CA--C 1.54 0.566 0 CA-C-O 117.919 -1.039 . . . . 0.0 111.231 -173.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -55.65 -27.5 61.12 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 122.7 2.267 . . . . 0.0 112.983 169.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -83.83 -3.9 89.08 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-O 117.432 -1.76 . . . . 0.0 115.521 175.011 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . 0.443 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -76.62 -36.92 57.14 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.953 2.376 . . . . 0.0 112.856 -172.419 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 14.7 mt -62.45 -22.31 66.11 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 123.431 0.693 . . . . 0.0 111.458 -179.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.87 -38.34 64.63 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.553 0.741 . . . . 0.0 111.904 176.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -52.61 13.38 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.618 0.767 . . . . 0.0 111.198 176.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . 0.443 ' CD2' HE22 ' B' ' 39' ' ' GLN . 8.9 m-70 -57.41 -24.16 53.77 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 65.9 mt -108.44 -11.23 15.19 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.603 1.561 . . . . 0.0 113.245 -176.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.36 8.04 42.66 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.292 0.948 . . . . 0.0 113.803 -170.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 53.4 mt -103.81 164.56 11.6 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.773 1.229 . . . . 0.0 112.066 -171.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 68.0 p -70.58 146.42 50.1 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 121.286 -0.884 . . . . 0.0 109.992 174.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 39.8 ptt180 -60.75 -17.07 46.45 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 172.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 47.6 p -73.6 -61.03 1.98 Allowed 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 166.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -66.57 -25.26 66.55 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.425 1.011 . . . . 0.0 113.124 -170.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 74.7 t -68.95 -31.11 49.2 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 CA-C-N 118.687 0.676 . . . . 0.0 111.896 169.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 75.8 m -61.28 -30.3 70.39 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.989 -1.069 . . . . 0.0 112.351 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -57.0 -13.68 2.94 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 128.053 2.541 . . . . 0.0 114.717 173.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -119.23 -8.01 10.19 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 120.325 -1.484 . . . . 0.0 114.411 170.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 71.4 mt -81.13 -25.06 37.21 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.067 0.947 . . . . 0.0 111.542 168.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 4.4 p -55.63 -49.63 72.33 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . 0.425 ' HB3' ' NH1' ' B' ' 23' ' ' ARG . 7.3 t -72.76 -35.32 67.45 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.765 1.166 . . . . 0.0 111.889 176.301 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.465 ' CD1' ' HD3' ' B' ' 23' ' ' ARG . 1.4 tp -56.91 -52.61 64.47 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.261 2.224 . . . . 0.0 111.726 -176.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 28.7 mtm105 -84.4 14.48 4.42 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.747 1.619 . . . . 0.0 111.863 178.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -110.17 -50.48 0.67 Allowed Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.712 1.149 . . . . 0.0 111.231 169.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 81.1 m -73.47 3.93 5.46 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 125.99 1.716 . . . . 0.0 113.748 -178.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.56 24.17 70.86 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 118.759 -1.023 . . . . 0.0 113.57 -176.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 63.3 mt -73.46 -21.57 60.4 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.545 1.672 . . . . 0.0 112.522 170.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -145.31 154.5 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 126.982 2.113 . . . . 0.0 110.109 175.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 89.8 t -135.23 141.89 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 127.118 2.167 . . . . 0.0 109.331 -177.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -84.12 155.21 22.73 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 123.102 1.429 . . . . 0.0 114.004 174.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 29.5 m -160.27 172.28 17.66 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.711 2.004 . . . . 0.0 107.082 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -92.51 152.39 19.68 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 119.958 1.254 . . . . 0.0 111.72 168.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -96.34 -4.69 41.55 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.151 0.981 . . . . 0.0 112.034 167.528 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 121.0 -34.81 3.89 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 127.14 2.305 . . . . 0.0 112.802 176.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 23.8 ttp180 -120.42 -29.92 4.68 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 130.419 3.487 . . . . 0.0 111.822 -176.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -135.38 171.96 13.7 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 128.425 2.69 . . . . 0.0 110.896 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 8.3 p -87.52 150.23 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.797 1.239 . . . . 0.0 110.283 169.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 31.3 ptt85 -137.25 172.27 13.24 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 126.552 1.941 . . . . 0.0 109.814 -174.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -114.69 171.98 7.31 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.534 0.734 . . . . 0.0 110.201 167.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -160.95 151.05 17.57 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 127.0 2.12 . . . . 0.0 107.919 179.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.3 tp -60.45 157.8 13.3 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.618 1.167 . . . . 0.0 113.193 172.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.84 -30.92 58.68 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 116.366 1.988 . . . . 0.0 116.366 -177.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 42.0 t0 173.49 153.12 0.09 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.345 2.258 . . . . 0.0 109.091 -166.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 90.8 p -44.23 -30.91 0.86 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.191 1.796 . . . . 0.0 112.917 166.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -53.55 -59.01 5.15 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 126.236 1.814 . . . . 0.0 113.763 171.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 21.6 mt -60.77 -44.96 96.11 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.482 1.037 . . . . 0.0 108.202 176.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.6 -33.7 64.2 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.766 1.226 . . . . 0.0 112.262 -172.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 7.6 mtt-85 -70.78 -56.81 5.52 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.352 1.061 . . . . 0.0 113.342 175.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.84 -37.08 83.79 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 120.005 1.275 . . . . 0.0 112.697 -178.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 36.1 tp -63.57 -34.76 78.52 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.424 1.89 . . . . 0.0 111.781 169.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.68 -29.4 29.57 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 126.845 2.164 . . . . 0.0 114.646 -174.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -11.24 60.26 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.126 1.463 . . . . 0.0 111.568 167.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 52.5 tp 73.77 133.79 0.05 OUTLIER 'General case' 0 C--N 1.347 0.482 0 C-N-CA 130.903 3.681 . . . . 0.0 106.54 -169.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 79.0 t -67.75 5.5 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 -167.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 86.91 -25.18 0.1 Allowed 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.032 -1.042 . . . . 0.0 111.615 138.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.416 HG23 ' HG ' ' A' ' 14' ' ' LEU . 7.2 p -52.85 25.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.83 1 C-N-CA 134.702 5.201 . . . . 0.0 115.264 166.804 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 62.37 14.22 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 126.305 1.842 . . . . 0.0 113.689 171.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 4.7 tt 91.65 104.27 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 128.349 2.659 . . . . 0.0 108.735 -168.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.03 65.44 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 115.862 1.801 . . . . 0.0 115.862 176.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 15.5 t -55.24 130.56 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 CA-C-N 119.43 1.014 . . . . 0.0 108.588 166.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -59.04 -89.45 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 125.545 1.538 . . . . 0.0 111.825 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 12.1 p 82.1 157.56 0.13 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 129.645 3.178 . . . . 0.0 112.498 169.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -82.88 36.75 0.51 Allowed 'General case' 0 CA--C 1.544 0.721 0 O-C-N 120.973 -1.079 . . . . 0.0 111.686 172.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -133.04 87.08 40.8 Favored Pre-proline 0 CA--C 1.547 0.835 0 O-C-N 120.373 -1.455 . . . . 0.0 111.395 174.149 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -75.31 4.6 4.76 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 124.508 3.472 . . . . 0.0 114.162 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -158.19 153.51 25.82 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 129.396 3.079 . . . . 0.0 108.276 170.133 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 10.1 m -131.04 11.12 1.93 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 117.534 2.42 . . . . 0.0 117.534 -164.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.98 -21.46 58.77 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 118.88 0.763 . . . . 0.0 112.547 168.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -133.82 16.34 3.91 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 127.698 2.399 . . . . 0.0 112.421 -170.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.132 0 O-C-N 119.888 -1.757 . . . . 0.0 113.154 -172.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.349 0 CA-C-O 121.609 0.719 . . . . 0.0 112.601 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -12.47 2.81 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 167.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.64 -31.27 24.77 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.951 1.3 . . . . 0.0 112.332 166.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 30.7 mtm105 -84.18 -32.37 24.63 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.991 1.316 . . . . 0.0 113.458 173.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -54.72 -49.75 69.99 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.834 1.254 . . . . 0.0 109.992 172.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.82 -24.92 70.25 Favored Glycine 0 N--CA 1.473 1.158 0 O-C-N 121.202 -0.937 . . . . 0.0 113.476 176.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.86 1.27 15.49 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.896 1.278 . . . . 0.0 112.336 173.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -118.41 -38.59 3.14 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.234 1.414 . . . . 0.0 111.848 167.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mp -86.18 -8.76 57.58 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -175.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -128.09 35.53 4.43 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.337 1.455 . . . . 0.0 110.698 167.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -114.59 144.42 31.81 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 127.379 2.271 . . . . 0.0 106.38 176.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -54.29 -94.41 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.791 1 C-N-CA 126.15 4.567 . . . . 0.0 114.314 -166.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.3 t -60.25 -23.86 64.42 Favored 'General case' 0 C--O 1.223 -0.342 0 O-C-N 121.375 -0.828 . . . . 0.0 111.51 175.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -69.73 -34.87 74.44 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 120.253 1.388 . . . . 0.0 113.783 -178.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.6 t -70.05 -36.82 75.28 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 121.44 1.927 . . . . 0.0 110.53 169.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.1 mtm180 -59.35 -46.98 87.14 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-O 117.65 -1.166 . . . . 0.0 112.532 172.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.466 HG12 HD11 ' A' ' 44' ' ' LEU . 1.1 mt -44.89 -56.88 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 CA-C-N 121.137 1.789 . . . . 0.0 110.307 172.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 94.8 mt -61.8 -41.39 97.69 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 117.702 -1.142 . . . . 0.0 111.545 -175.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.8 p -75.21 -27.76 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-N 120.793 1.633 . . . . 0.0 112.833 176.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.37 -30.26 63.18 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.423 1.489 . . . . 0.0 112.441 173.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.447 ' O ' HG13 ' A' ' 34' ' ' VAL . 1.4 mp -63.44 -47.04 83.52 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.425 167.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.51 -45.89 56.81 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.112 1.765 . . . . 0.0 112.469 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 29.6 t0 -107.29 40.53 1.66 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.103 1.761 . . . . 0.0 111.102 174.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -150.56 -78.3 0.02 OUTLIER Glycine 0 C--N 1.339 0.731 0 O-C-N 120.555 -1.34 . . . . 0.0 115.267 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.447 HG13 ' O ' ' A' ' 30' ' ' LEU . 27.6 m 31.37 31.01 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 C-N-CA 128.055 2.542 . . . . 0.0 117.6 -168.075 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 36.1 m -84.65 -67.66 0.78 Allowed 'General case' 0 N--CA 1.469 0.481 0 O-C-N 120.551 -1.343 . . . . 0.0 113.933 -173.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -143.64 164.03 32.83 Favored Pre-proline 0 CA--C 1.54 0.565 0 CA-C-O 118.054 -0.974 . . . . 0.0 112.541 -171.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -66.19 -25.49 50.31 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 121.99 1.794 . . . . 0.0 113.061 -169.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.16 11.34 48.14 Favored Glycine 0 CA--C 1.53 0.979 0 CA-C-O 117.913 -1.493 . . . . 0.0 114.439 173.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.531 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -64.23 -34.27 77.72 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.501 2.151 . . . . 0.0 111.126 179.826 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 46.0 mt -56.36 -21.54 25.36 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 124.901 1.28 . . . . 0.0 112.647 175.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.43 -28.4 69.78 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.189 -0.944 . . . . 0.0 112.194 -178.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.2 -57.05 3.99 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.769 0.828 . . . . 0.0 111.099 169.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.531 ' CD2' HE22 ' A' ' 39' ' ' GLN . 5.7 m-70 -53.41 -31.48 45.25 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -179.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.466 HD11 HG12 ' A' ' 26' ' ' ILE . 70.4 mt -98.09 -22.93 15.97 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.147 0.979 . . . . 0.0 113.44 -175.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.56 -0.73 48.07 Favored Glycine 0 CA--C 1.534 1.277 0 C-N-CA 124.787 1.184 . . . . 0.0 113.484 -169.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 94.9 mt -97.32 149.21 22.34 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.276 1.43 . . . . 0.0 110.326 -176.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.7 p -66.2 152.05 45.68 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 121.233 -0.917 . . . . 0.0 110.975 -174.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -56.14 -44.05 78.86 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.495 0.718 . . . . 0.0 111.988 -178.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.6 m -64.24 -35.56 81.22 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.588 1.155 . . . . 0.0 112.782 173.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -73.89 -44.54 54.94 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 178.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 67.9 t -60.6 -30.65 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 119.409 1.004 . . . . 0.0 112.447 176.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 58.8 m -53.16 -38.54 62.85 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 119.825 1.193 . . . . 0.0 113.683 174.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 64.3 m-80 -58.63 -48.02 82.43 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.236 1.014 . . . . 0.0 111.718 175.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 34.6 m80 -65.79 -31.73 72.86 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.569 1.148 . . . . 0.0 112.343 179.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 60.1 mt -74.46 -32.48 62.61 Favored 'General case' 0 C--O 1.222 -0.395 0 C-N-CA 124.088 0.955 . . . . 0.0 112.767 169.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.3 m -61.97 -33.97 75.28 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 120.798 1.636 . . . . 0.0 115.375 -170.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 38.5 t -77.04 -34.12 57.27 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.717 1.144 . . . . 0.0 111.512 170.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.3 tp -64.14 -38.28 90.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 127.37 2.268 . . . . 0.0 112.271 -177.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 66.4 mtm-85 -75.23 -13.51 60.45 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.905 1.682 . . . . 0.0 113.059 174.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.89 -34.99 4.71 Favored Glycine 0 N--CA 1.473 1.153 0 C-N-CA 126.317 1.913 . . . . 0.0 113.548 175.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 56.1 m -76.51 7.69 4.24 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.422 1.489 . . . . 0.0 111.425 168.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.48 -20.03 1.78 Allowed Glycine 0 CA--C 1.533 1.171 0 C-N-CA 126.71 2.1 . . . . 0.0 116.095 175.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.3 mt -55.63 -24.99 36.54 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 127.367 2.267 . . . . 0.0 115.675 -170.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.44 HG12 ' CD2' ' A' ' 30' ' ' LEU . 2.7 m -121.64 127.53 75.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.425 0 C-N-CA 124.27 1.028 . . . . 0.0 112.937 171.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 90.4 t -115.7 132.91 63.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 125.792 1.637 . . . . 0.0 109.513 -176.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -91.13 155.17 18.83 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 122.242 1.02 . . . . 0.0 112.684 178.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 26.3 m -147.79 152.09 37.11 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.301 1.44 . . . . 0.0 109.001 177.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -98.98 110.48 23.08 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.051 1.34 . . . . 0.0 111.14 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -87.52 68.37 9.6 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.036 2.135 . . . . 0.0 111.177 -179.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 63.01 -1.43 1.84 Allowed Glycine 0 CA--C 1.538 1.504 0 N-CA-C 117.72 1.848 . . . . 0.0 117.72 168.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.6 mtm-85 154.7 -25.83 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 131.533 3.933 . . . . 0.0 111.363 -172.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -94.43 179.16 5.38 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 166.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 24.5 m -128.43 168.89 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 O-C-N 121.042 -1.036 . . . . 0.0 108.838 168.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -137.63 -176.11 4.3 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.777 1.631 . . . . 0.0 111.14 172.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -135.43 151.33 50.31 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.769 2.027 . . . . 0.0 109.01 169.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.438 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -152.39 151.62 31.05 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.017 1.327 . . . . 0.0 110.58 -173.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -57.3 143.77 38.36 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.568 1.147 . . . . 0.0 109.711 173.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.49 -10.75 60.0 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 116.806 2.15 . . . . 0.0 116.806 -169.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -176.17 161.59 2.36 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.235 2.214 . . . . 0.0 109.563 173.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 90.2 p -41.59 -32.76 0.38 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 128.247 2.619 . . . . 0.0 112.711 166.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -42.07 -60.71 1.34 Allowed 'General case' 0 C--N 1.343 0.291 0 C-N-CA 126.666 1.986 . . . . 0.0 112.801 168.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.434 ' H ' HD22 ' A' ' 82' ' ' LEU . 0.3 OUTLIER -80.37 -34.96 36.05 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -170.344 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.69 -38.4 69.61 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 118.62 0.645 . . . . 0.0 112.664 169.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -71.78 -63.74 1.07 Allowed 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.946 0.898 . . . . 0.0 113.245 173.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.47 -25.99 67.6 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.88 -1.137 . . . . 0.0 113.548 -171.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.77 -40.47 22.58 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 123.268 0.627 . . . . 0.0 111.779 169.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.12 -60.12 5.41 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 127.059 2.266 . . . . 0.0 115.045 -176.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.6 pm0 -66.44 -21.67 66.21 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.676 1.738 . . . . 0.0 111.406 168.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.8 tt 80.38 132.68 0.06 Allowed 'General case' 0 C--N 1.343 0.294 0 C-N-CA 128.565 2.746 . . . . 0.0 112.225 166.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 29.4 m -63.29 16.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 126.797 2.039 . . . . 0.0 114.732 178.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 73.22 -11.0 0.94 Allowed 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 126.365 1.866 . . . . 0.0 113.212 169.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 2.9 p -55.73 22.78 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 C-N-CA 129.864 3.266 . . . . 0.0 117.698 175.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.9 t 68.7 9.75 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 126.771 2.028 . . . . 0.0 112.779 166.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 95.31 110.51 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 131.09 3.756 . . . . 0.0 107.665 -168.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.3 74.75 0.05 Allowed 'General case' 0 CA--C 1.553 1.089 0 O-C-N 121.446 -0.783 . . . . 0.0 113.05 169.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.8 t -70.77 146.59 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 126.082 1.753 . . . . 0.0 111.8 174.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.69 78.8 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 128.69 2.796 . . . . 0.0 112.401 170.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 19.7 p -141.02 121.67 14.26 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.036 1.335 . . . . 0.0 112.61 -172.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -111.84 134.41 53.42 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.858 1.263 . . . . 0.0 110.041 173.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -165.11 158.62 14.23 Favored Pre-proline 0 CA--C 1.548 0.866 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 -170.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -83.16 170.32 12.22 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.972 2.448 . . . . 0.0 113.203 -172.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.6 t -85.65 -179.87 6.96 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 125.395 1.478 . . . . 0.0 110.205 167.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 2.2 t -113.76 4.28 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.956 2.102 . . . . 0.0 111.412 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -128.31 -37.43 1.84 Allowed 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 125.795 1.638 . . . . 0.0 112.508 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -151.19 125.09 9.16 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.128 0.876 . . . . 0.0 112.268 173.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 106' ' ' ARG 0.255 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.257 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 166.487 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.59 0 CA-C-O 122.345 1.069 . . . . 0.0 113.548 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.455 HD13 ' H ' ' B' ' 11' ' ' LEU . 0.0 OUTLIER -59.05 -8.99 1.66 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.567 1.947 . . . . 0.0 114.882 172.463 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.81 -21.4 11.07 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 120.671 -1.268 . . . . 0.0 112.691 168.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 38.0 mtm105 -83.6 -46.72 12.05 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.151 1.781 . . . . 0.0 111.798 169.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -51.17 -57.89 7.58 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.913 1.685 . . . . 0.0 110.262 173.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -68.5 -23.71 75.2 Favored Glycine 0 C--N 1.339 0.725 0 CA-C-O 117.908 -1.495 . . . . 0.0 112.757 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 25.8 ttm105 -63.99 -49.19 73.44 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 119.792 1.796 . . . . 0.0 110.386 169.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.19 -33.85 75.33 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 120.065 1.302 . . . . 0.0 114.093 175.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 7.6 mp -84.57 -2.04 56.8 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 178.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -119.87 -12.82 9.13 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 172.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.55 157.32 27.08 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 126.347 1.859 . . . . 0.0 111.384 169.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -65.23 -99.49 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 0.992 1 C-N-CA 126.009 4.473 . . . . 0.0 111.725 -176.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 12.1 t -58.48 -25.27 62.13 Favored 'General case' 0 N--CA 1.464 0.262 0 O-C-N 120.637 -1.29 . . . . 0.0 112.469 175.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.54 -39.91 85.0 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 119.707 1.14 . . . . 0.0 112.844 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 44.0 t -66.54 -37.19 84.47 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.72 1.6 . . . . 0.0 111.008 169.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 7.2 mtm180 -61.53 -35.88 78.99 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 172.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . 0.452 HG12 HD11 ' B' ' 44' ' ' LEU . 1.8 mt -52.59 -59.9 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 CA-C-N 120.334 1.425 . . . . 0.0 108.851 169.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 96.9 mt -57.24 -45.95 83.45 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.75 -171.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 5.7 p -75.06 -31.3 24.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.58 -30.81 57.17 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.131 0.878 . . . . 0.0 112.387 174.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 12.1 tp -64.42 -37.09 86.3 Favored 'General case' 0 C--N 1.339 0.152 0 O-C-N 120.926 -1.109 . . . . 0.0 112.768 175.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -49.05 -31.75 8.28 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 128.907 2.883 . . . . 0.0 114.237 175.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.84 -33.17 18.67 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.663 1.985 . . . . 0.0 113.152 174.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -99.22 -65.02 0.84 Allowed Glycine 0 C--N 1.338 0.687 0 N-CA-C 115.465 0.946 . . . . 0.0 115.465 -165.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 16.1 m 34.5 38.8 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 125.969 1.708 . . . . 0.0 114.075 -167.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 30.0 m -86.47 -86.65 0.14 Allowed 'General case' 0 C--O 1.225 -0.23 0 C-N-CA 124.028 0.931 . . . . 0.0 110.944 -176.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -133.69 162.89 54.92 Favored Pre-proline 0 CA--C 1.544 0.72 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -169.127 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -63.91 -25.53 67.21 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 122.64 2.226 . . . . 0.0 113.843 -167.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.66 7.81 50.42 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-O 117.114 -1.937 . . . . 0.0 114.918 172.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.99 -31.97 71.55 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 121.083 2.442 . . . . 0.0 111.409 -175.084 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 31.4 mt -63.13 -18.75 63.77 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 125.32 1.448 . . . . 0.0 112.215 -179.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.0 -32.18 70.61 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 119.731 1.15 . . . . 0.0 112.245 177.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.62 -54.88 6.08 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.491 0.716 . . . . 0.0 111.306 170.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -53.55 -31.37 46.21 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.452 HD11 HG12 ' B' ' 26' ' ' ILE . 70.3 mt -100.55 -27.13 13.58 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.558 1.143 . . . . 0.0 112.984 -174.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.56 4.97 88.0 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 124.998 1.285 . . . . 0.0 113.27 -169.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 96.6 mt -105.78 150.3 25.67 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.019 1.328 . . . . 0.0 111.207 -172.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 9.5 p -64.34 149.63 47.82 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.262 -0.899 . . . . 0.0 110.402 -175.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -58.57 -35.56 72.57 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.654 0.612 . . . . 0.0 112.654 -177.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.7 m -66.82 -44.01 82.3 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.356 -0.84 . . . . 0.0 112.018 170.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -65.81 -45.31 82.81 Favored 'General case' 0 CA--C 1.548 0.884 0 O-C-N 121.162 -0.961 . . . . 0.0 112.215 177.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 94.8 t -59.59 -31.72 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 120.335 -1.478 . . . . 0.0 111.692 169.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 69.7 m -65.13 -26.99 68.43 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 120.02 1.282 . . . . 0.0 113.728 175.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -62.97 -55.58 24.6 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.104 0.866 . . . . 0.0 109.557 169.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 33.9 m80 -59.04 -39.86 83.29 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.594 1.158 . . . . 0.0 113.18 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 56.0 mt -66.59 -33.75 76.36 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 124.59 1.156 . . . . 0.0 112.709 172.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 59.9 m -63.7 -35.55 80.94 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 120.484 1.493 . . . . 0.0 114.293 -169.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 34.1 t -72.05 -34.69 68.95 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.597 0.635 . . . . 0.0 112.07 169.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 5.4 tp -68.41 -32.05 71.83 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.556 2.342 . . . . 0.0 112.581 -175.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 51.3 mtm-85 -82.09 -19.64 39.76 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.39 1.476 . . . . 0.0 112.239 171.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -88.88 -37.85 7.14 Favored Glycine 0 N--CA 1.476 1.325 0 C-N-CA 124.811 1.196 . . . . 0.0 113.398 177.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 97.0 m -81.39 15.34 2.05 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 126.332 1.853 . . . . 0.0 111.364 169.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.93 -26.3 1.16 Allowed Glycine 0 CA--C 1.534 1.259 0 C-N-CA 126.265 1.888 . . . . 0.0 116.525 172.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 21.3 mt -50.86 -29.41 11.78 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 127.664 2.386 . . . . 0.0 116.592 -168.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -118.03 122.44 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 124.915 1.286 . . . . 0.0 111.301 169.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 80.4 t -107.45 130.65 59.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 125.507 1.523 . . . . 0.0 108.656 -176.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -96.86 146.46 24.91 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 124.624 1.17 . . . . 0.0 111.395 -177.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 96.4 m -154.09 147.35 24.81 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 124.432 1.093 . . . . 0.0 109.001 -172.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -97.62 93.23 6.3 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.36 1.064 . . . . 0.0 111.719 -176.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -69.3 74.88 0.36 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.815 1.646 . . . . 0.0 114.078 173.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 63.15 -5.69 0.56 Allowed Glycine 0 N--CA 1.475 1.257 0 C-N-CA 126.808 2.147 . . . . 0.0 118.313 167.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 4.1 mtm-85 161.04 -24.98 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 130.36 3.464 . . . . 0.0 111.759 -175.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -100.6 170.4 8.39 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 166.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 11.1 m -115.1 163.32 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 119.036 0.834 . . . . 0.0 109.134 168.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 10.3 ptt-85 -129.63 172.93 11.09 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 122.2 1.0 . . . . 0.0 110.784 170.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -127.93 140.34 52.06 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 167.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -146.52 154.75 41.9 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 123.753 0.821 . . . . 0.0 110.675 -178.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 1.2 mp -57.25 142.96 41.24 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.593 0.757 . . . . 0.0 110.614 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.13 0.44 1.97 Allowed 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 118.751 2.871 . . . . 0.0 118.751 -167.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 11.8 t70 169.02 158.33 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 129.835 3.254 . . . . 0.0 109.832 173.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 88.7 p -40.58 -35.39 0.46 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.806 2.442 . . . . 0.0 112.756 167.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -38.66 -63.16 0.53 Allowed 'General case' 0 C--N 1.342 0.278 0 C-N-CA 127.242 2.217 . . . . 0.0 113.013 167.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . 0.511 ' H ' HD22 ' B' ' 82' ' ' LEU . 0.4 OUTLIER -75.2 -34.16 61.49 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -170.981 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.17 -30.22 71.41 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.857 0.863 . . . . 0.0 112.3 177.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.8 mmt85 -71.17 -65.74 0.71 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.645 1.178 . . . . 0.0 110.905 168.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.97 -25.83 63.93 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.599 1.333 . . . . 0.0 114.599 -173.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -87.26 -34.3 18.97 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 121.374 -0.829 . . . . 0.0 112.647 169.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.35 -58.33 5.11 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 127.27 2.367 . . . . 0.0 113.645 -175.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 14.0 pm0 -70.21 -17.72 63.15 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 119.22 1.51 . . . . 0.0 111.165 166.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . 0.406 ' C ' ' H ' ' B' ' 91' ' ' GLN . 26.5 tp 82.07 146.44 0.08 Allowed 'General case' 0 C--N 1.343 0.321 0 C-N-CA 129.989 3.315 . . . . 0.0 112.904 167.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . 0.497 HG23 HG12 ' B' ' 92' ' ' VAL . 5.8 m -57.34 5.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 127.513 2.325 . . . . 0.0 114.122 168.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . 0.406 ' H ' ' C ' ' B' ' 89' ' ' LEU . 7.3 mm-40 69.0 -9.27 0.6 Allowed 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 127.111 2.164 . . . . 0.0 114.228 176.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.497 HG12 HG23 ' B' ' 90' ' ' VAL . 1.2 p -56.26 26.0 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 130.174 3.39 . . . . 0.0 117.765 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 73.05 10.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 126.672 1.989 . . . . 0.0 112.496 168.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 78.99 101.27 0.06 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 127.716 2.407 . . . . 0.0 108.986 -171.224 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.12 139.77 22.49 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.14 1.376 . . . . 0.0 114.681 177.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 5.3 t -123.71 156.4 30.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 126.867 2.067 . . . . 0.0 108.426 175.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.68 25.42 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.364 0 C-N-CA 128.118 2.567 . . . . 0.0 115.567 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 18.2 p -96.86 127.05 42.46 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.647 1.579 . . . . 0.0 114.621 -170.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -93.5 141.13 28.81 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.13 1.772 . . . . 0.0 108.873 167.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -162.25 144.83 8.65 Favored Pre-proline 0 CA--C 1.544 0.738 0 O-C-N 120.086 -1.634 . . . . 0.0 108.445 -176.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -70.72 165.73 31.08 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 122.559 2.173 . . . . 0.0 112.549 -175.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 53.7 t -85.01 177.16 8.03 Favored 'General case' 0 CA--C 1.557 1.231 0 C-N-CA 125.449 1.5 . . . . 0.0 111.311 169.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 11.4 t -101.59 -10.29 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 127.129 2.172 . . . . 0.0 111.142 173.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -114.3 -57.16 2.31 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.38 1.872 . . . . 0.0 110.941 -178.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -147.06 124.78 11.83 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 119.374 0.988 . . . . 0.0 113.552 177.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . 0.488 ' CZ ' ' HA ' ' B' ' 106' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.397 0 C-N-CA 124.058 0.943 . . . . 0.0 113.15 166.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.821 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 pp -56.88 -40.83 76.95 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.198 0.599 . . . . 0.0 112.483 -173.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.44 1.26 8.29 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.372 1.469 . . . . 0.0 113.878 176.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.436 ' HE ' ' HB2' ' B' ' 102' ' ' CYS . 1.6 mpt_? -112.21 -21.18 11.58 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.967 1.307 . . . . 0.0 112.478 169.042 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.08 -59.71 4.98 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.705 1.138 . . . . 0.0 109.534 168.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.08 -27.56 72.45 Favored Glycine 0 CA--C 1.538 1.473 0 O-C-N 121.292 -0.88 . . . . 0.0 113.234 -178.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -51.93 28.7 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.287 1.035 . . . . 0.0 111.478 172.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.44 -25.11 59.22 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.125 -0.984 . . . . 0.0 112.524 -175.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.1 mp -82.83 -6.96 59.67 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 118.138 -0.934 . . . . 0.0 111.362 168.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -92.34 -35.62 13.63 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 119.995 1.271 . . . . 0.0 112.28 166.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -47.56 127.81 10.51 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 125.309 1.443 . . . . 0.0 108.697 173.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -50.06 -85.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.498 1 C-N-CA 127.621 5.547 . . . . 0.0 113.516 -165.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.36 -22.24 29.78 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 126.614 1.965 . . . . 0.0 113.747 174.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 37.8 mtt180 -74.19 -40.69 62.34 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 120.249 1.386 . . . . 0.0 112.215 178.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 6.9 t -60.18 -48.32 82.21 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.353 0.979 . . . . 0.0 110.09 169.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 21.7 tpt180 -62.18 -35.84 80.06 Favored 'General case' 0 CA--C 1.556 1.178 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 176.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -55.27 -53.47 34.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 CA-C-N 120.674 1.579 . . . . 0.0 108.719 167.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.693 HD22 HD21 ' A' ' 77' ' ' LEU . 25.0 mt -63.88 -45.61 88.63 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 117.483 -1.246 . . . . 0.0 112.664 -174.11 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.2 m -58.27 -27.22 32.01 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 CA-C-N 120.667 1.576 . . . . 0.0 112.378 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.482 ' HB1' ' CD2' ' A' ' 43' ' ' HIS . . . -95.63 -18.43 20.55 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.972 0.909 . . . . 0.0 113.312 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.503 HD23 ' HA ' ' A' ' 30' ' ' LEU . 8.9 mt -68.72 -41.28 79.25 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 118.247 -0.883 . . . . 0.0 112.482 168.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.8 tt -29.81 -62.32 0.14 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 130.4 3.48 . . . . 0.0 113.251 -178.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -98.55 -17.5 18.65 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.746 2.018 . . . . 0.0 112.684 174.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -75.39 -43.16 25.76 Favored Glycine 0 C--N 1.341 0.853 0 CA-C-O 116.153 -2.471 . . . . 0.0 115.833 -168.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.6 m 4.03 48.65 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 C-N-CA 131.125 3.77 . . . . 0.0 119.798 177.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 68.7 m -104.61 -63.17 1.24 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.975 1.71 . . . . 0.0 110.424 176.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -151.26 149.14 23.91 Favored Pre-proline 0 N--CA 1.474 0.762 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -173.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -55.99 -44.44 47.06 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 121.756 1.638 . . . . 0.0 111.082 175.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -69.04 -5.06 45.56 Favored Glycine 0 CA--C 1.535 1.288 0 CA-C-O 118.276 -1.291 . . . . 0.0 114.678 177.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -69.91 -34.97 74.19 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 118.965 1.382 . . . . 0.0 111.383 173.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.8 mt -64.56 -3.2 2.88 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 118.43 0.559 . . . . 0.0 111.9 -177.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.96 -44.3 85.41 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.724 -0.61 . . . . 0.0 110.264 172.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.58 -38.55 70.92 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.821 0.849 . . . . 0.0 111.813 173.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.482 ' CD2' ' HB1' ' A' ' 29' ' ' ALA . 6.5 m-70 -62.9 -20.03 64.77 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.606 HD12 HG22 ' A' ' 51' ' ' VAL . 75.5 mt -121.24 -19.37 7.1 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.996 1.718 . . . . 0.0 114.285 -172.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.49 17.29 78.95 Favored Glycine 0 CA--C 1.535 1.289 0 CA-C-N 118.673 0.669 . . . . 0.0 112.438 -168.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 87.1 mt -111.09 157.3 20.15 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.693 1.246 . . . . 0.0 112.749 -173.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.3 t -62.97 147.47 50.45 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.466 -0.771 . . . . 0.0 109.904 168.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 19.3 ptt-85 -61.58 -13.63 23.38 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 174.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.6 m -66.7 -51.18 58.99 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.033 -1.042 . . . . 0.0 111.71 169.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -65.14 -44.92 87.05 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 124.036 0.935 . . . . 0.0 110.142 177.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.606 HG22 HD12 ' A' ' 44' ' ' LEU . 13.0 t -52.72 -48.38 49.17 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.266 171.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 66.5 m -60.84 -39.58 89.62 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 118.954 0.797 . . . . 0.0 112.487 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -57.89 -44.54 86.8 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.074 0.949 . . . . 0.0 111.858 173.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 23.0 m170 -61.73 -41.59 97.84 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 120.895 -1.128 . . . . 0.0 112.149 172.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 54.8 mt -75.09 -20.5 59.46 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.2 t -49.81 -51.64 38.23 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.889 1.276 . . . . 0.0 113.508 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 40.0 t -77.87 -39.8 42.13 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.574 0.75 . . . . 0.0 111.904 175.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.7 tp -55.58 -36.61 67.07 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.456 1.503 . . . . 0.0 112.302 -176.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.431 ' HD3' ' CE2' ' A' ' 75' ' ' TYR . 69.0 mtm180 -74.13 -40.23 62.78 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 173.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.43 -39.03 31.7 Favored Glycine 0 N--CA 1.467 0.733 0 C-N-CA 123.798 0.713 . . . . 0.0 112.122 -170.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 67.6 m -81.18 12.33 3.55 Favored 'General case' 0 CA--C 1.562 1.417 0 C-N-CA 126.206 1.802 . . . . 0.0 112.315 171.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.88 -12.08 54.55 Favored Glycine 0 N--CA 1.473 1.133 0 C-N-CA 128.574 2.988 . . . . 0.0 118.946 167.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.7 mt -58.59 -29.82 66.73 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.45 1.5 . . . . 0.0 114.815 -175.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.6 m -132.0 132.33 61.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.7 t -118.85 135.23 59.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 127.871 2.468 . . . . 0.0 110.883 -168.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.68 126.55 31.42 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.29 0.636 . . . . 0.0 111.845 175.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -141.67 156.45 45.64 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.413 1.085 . . . . 0.0 109.395 174.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.35 124.43 28.41 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 119.55 1.068 . . . . 0.0 110.112 168.16 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.0 -32.57 57.3 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 121.28 -0.888 . . . . 0.0 112.758 173.488 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 166.33 -17.92 0.09 OUTLIER Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.569 1.557 . . . . 0.0 115.246 174.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.96 -16.65 0.26 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.16 2.184 . . . . 0.0 113.584 177.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.04 173.98 10.98 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.659 1.984 . . . . 0.0 109.729 175.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 8.4 p -81.26 136.95 22.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 C-N-CA 124.315 1.046 . . . . 0.0 111.072 169.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -110.24 160.4 16.55 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 126.553 1.941 . . . . 0.0 109.648 169.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.431 ' CE2' ' HD3' ' A' ' 59' ' ' ARG . 3.4 m-30 -107.99 100.76 10.08 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 107.027 -1.471 . . . . 0.0 107.027 170.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -93.61 142.15 27.67 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.32 1.048 . . . . 0.0 110.055 179.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.693 HD21 HD22 ' A' ' 27' ' ' LEU . 8.6 mt -55.33 153.19 7.46 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.667 0.787 . . . . 0.0 112.049 171.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.85 -32.89 66.25 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 115.054 1.502 . . . . 0.0 115.054 -169.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -167.35 161.69 14.31 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 125.071 1.348 . . . . 0.0 109.718 -175.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 68.6 m -48.35 -32.59 7.7 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.363 1.065 . . . . 0.0 112.332 168.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -47.84 -52.78 17.79 Favored 'General case' 0 C--N 1.345 0.397 0 C-N-CA 125.614 1.565 . . . . 0.0 112.829 171.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.3 mt -76.03 -46.08 31.13 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-O 117.926 -1.035 . . . . 0.0 108.808 -173.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.52 -33.69 46.38 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 172.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 -68.01 -67.36 0.47 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.982 1.713 . . . . 0.0 112.327 173.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.94 -30.14 71.25 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.74 1.155 . . . . 0.0 113.276 -174.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 47.1 tp -65.56 -38.82 90.65 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.249 1.42 . . . . 0.0 110.905 169.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -76.02 -51.52 6.89 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 128.548 2.975 . . . . 0.0 115.091 -175.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -71.53 -2.49 17.07 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.43 1.615 . . . . 0.0 113.23 172.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 32.9 tp 69.84 110.62 0.05 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 128.605 2.762 . . . . 0.0 113.288 167.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.489 HG23 HG12 ' A' ' 92' ' ' VAL . 29.5 m -64.9 17.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 127.097 2.159 . . . . 0.0 116.376 -169.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.512 ' C ' ' H ' ' A' ' 93' ' ' VAL . 43.1 mm-40 75.55 -11.01 1.16 Allowed 'General case' 0 C--O 1.216 -0.676 0 O-C-N 120.525 -1.359 . . . . 0.0 113.277 158.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.489 HG12 HG23 ' A' ' 90' ' ' VAL . 4.3 p -70.74 40.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 126.769 2.028 . . . . 0.0 111.271 166.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.512 ' H ' ' C ' ' A' ' 91' ' ' GLN . 2.2 t 72.0 -33.49 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 130.82 3.648 . . . . 0.0 114.657 176.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 51.4 tp 128.91 94.08 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.66 1 C-N-CA 132.044 4.138 . . . . 0.0 105.792 -166.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -54.14 138.61 37.65 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -174.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 25.5 t -114.0 154.26 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 126.556 1.943 . . . . 0.0 108.917 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -58.8 -4.76 0.49 Allowed 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 127.205 2.202 . . . . 0.0 114.885 173.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.1 p -84.73 109.85 18.35 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.857 1.663 . . . . 0.0 113.254 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -89.61 157.95 17.82 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.194 0.998 . . . . 0.0 108.89 166.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -160.21 147.34 12.42 Favored Pre-proline 0 CA--C 1.556 1.19 0 CA-C-O 117.365 -1.303 . . . . 0.0 109.362 -169.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -38.77 146.84 0.14 Allowed 'Trans proline' 0 C--N 1.357 1.017 1 C-N-CA 127.111 5.208 . . . . 0.0 121.349 -166.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -75.16 72.22 2.24 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-O 123.021 1.391 . . . . 0.0 108.645 168.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 1.2 p -54.74 -25.98 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 127.055 2.142 . . . . 0.0 112.875 -170.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.453 ' CB ' ' HA ' ' B' ' 57' ' ' CYS . . . -61.52 97.11 0.07 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.329 0.651 . . . . 0.0 112.202 168.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 119.33 -58.35 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 131.509 3.924 . . . . 0.0 112.019 169.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 13.6 ptt-85 . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 115.759 1.763 . . . . 0.0 115.759 -166.977 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.688 0 N-CA-C 105.651 -1.981 . . . . 0.0 105.651 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . 0.272 1.8 pp -42.69 -55.03 3.77 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 117.248 2.314 . . . . 0.0 117.248 -164.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.38 -23.63 63.76 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 120.398 1.454 . . . . 0.0 112.731 178.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -20.44 61.4 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 116.626 -1.654 . . . . 0.0 112.055 172.204 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.58 -67.77 0.3 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 120.778 1.626 . . . . 0.0 108.589 170.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -57.63 -38.7 88.96 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-O 119.512 -0.604 . . . . 0.0 112.721 -175.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -62.47 -50.99 69.25 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 118.105 0.952 . . . . 0.0 112.669 173.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.27 -11.71 60.83 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.364 0.983 . . . . 0.0 113.37 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.3 mp -96.42 -14.2 22.61 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.34 1.056 . . . . 0.0 112.145 168.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.95 -13.86 56.9 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.397 1.079 . . . . 0.0 112.282 166.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -79.98 133.05 58.65 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 128.414 2.686 . . . . 0.0 108.927 -177.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -52.88 -84.7 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.614 1 C-N-CA 126.819 5.013 . . . . 0.0 113.297 -167.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.03 -23.29 67.38 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 126.251 1.821 . . . . 0.0 112.508 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 47.0 mtt85 -73.84 -43.44 58.7 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 120.248 1.385 . . . . 0.0 112.663 176.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 4.5 t -58.32 -44.87 88.83 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.918 1.235 . . . . 0.0 110.023 170.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 19.5 tpt180 -61.31 -33.86 74.28 Favored 'General case' 0 CA--C 1.559 1.301 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 172.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -63.83 -52.15 60.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 O-C-N 119.601 -1.937 . . . . 0.0 108.957 168.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 88.5 mt -59.47 -44.7 92.96 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 117.674 -1.155 . . . . 0.0 112.437 -177.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 3.8 m -59.32 -23.89 26.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 CA-C-N 120.427 1.467 . . . . 0.0 112.734 177.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . 0.55 ' HB1' ' CD2' ' B' ' 43' ' ' HIS . . . -98.92 -8.18 25.97 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.4 1.08 . . . . 0.0 112.784 -179.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.8 mt -87.14 -25.17 24.23 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.005 1.322 . . . . 0.0 112.932 168.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.2 -30.17 10.93 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 127.991 2.516 . . . . 0.0 111.676 166.144 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -131.0 -37.72 1.27 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.436 1.894 . . . . 0.0 115.447 -170.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.26 -63.23 3.01 Favored Glycine 0 C--N 1.343 0.963 0 C-N-CA 125.022 1.296 . . . . 0.0 114.688 -165.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 4.3 m 41.01 36.2 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 116.146 1.906 . . . . 0.0 116.146 173.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 60.0 m -98.76 -76.37 0.54 Allowed 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 125.587 1.555 . . . . 0.0 112.198 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -143.08 153.29 60.02 Favored Pre-proline 0 N--CA 1.478 0.933 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 -169.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -54.41 -35.52 84.89 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 123.253 2.635 . . . . 0.0 112.64 178.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -80.41 -8.84 87.17 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-O 117.849 -1.528 . . . . 0.0 115.102 175.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.17 -32.35 73.74 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 120.627 2.213 . . . . 0.0 112.879 -171.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 5.2 mt -67.71 -7.87 30.63 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 118.543 0.611 . . . . 0.0 111.634 -178.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.51 -39.15 89.97 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.299 -0.875 . . . . 0.0 111.162 169.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.81 -44.22 33.44 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.295 1.038 . . . . 0.0 112.187 175.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . 0.55 ' CD2' ' HB1' ' B' ' 29' ' ' ALA . 25.6 m-70 -57.45 -25.04 59.08 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 178.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.655 HD12 HG22 ' B' ' 51' ' ' VAL . 66.5 mt -115.21 -19.71 10.69 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.374 1.87 . . . . 0.0 114.251 -173.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.89 17.9 77.22 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-N 119.137 0.881 . . . . 0.0 113.065 -169.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 85.9 mt -110.27 162.05 15.0 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 118.563 1.182 . . . . 0.0 112.889 -174.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.9 t -68.67 148.91 49.74 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.123 -0.986 . . . . 0.0 110.092 168.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 22.8 ptt-85 -60.29 -15.34 24.26 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 174.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 1.8 m -67.35 -50.79 58.44 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.986 -1.071 . . . . 0.0 111.68 169.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -65.92 -43.22 88.79 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.68 0.792 . . . . 0.0 110.398 176.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . 0.655 HG22 HD12 ' B' ' 44' ' ' LEU . 16.6 t -54.6 -44.39 69.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 O-C-N 121.588 -0.695 . . . . 0.0 112.074 171.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.1 m -62.3 -39.91 94.57 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.51 1.05 . . . . 0.0 112.802 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -55.78 -44.8 78.09 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.45 1.1 . . . . 0.0 111.487 172.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 22.2 m80 -63.27 -40.6 97.86 Favored 'General case' 0 CA--C 1.549 0.906 0 O-C-N 121.179 -0.95 . . . . 0.0 112.305 172.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 82.7 mt -73.83 -28.36 61.57 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -176.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 68.1 m -50.68 -53.39 31.54 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 120.798 1.636 . . . . 0.0 113.785 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . 0.453 ' HA ' ' CB ' ' A' ' 104' ' ' ALA . 36.2 t -68.87 -42.85 76.47 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 118.551 0.614 . . . . 0.0 112.525 179.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 mp -49.0 -41.88 35.96 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.552 1.941 . . . . 0.0 114.287 174.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 85.7 mtm180 -91.4 -20.85 21.36 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -177.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -86.52 -45.72 5.44 Favored Glycine 0 N--CA 1.472 1.054 0 CA-C-N 119.921 1.237 . . . . 0.0 112.122 176.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 84.8 m -74.29 9.08 1.81 Allowed 'General case' 0 CA--C 1.561 1.399 0 C-N-CA 126.083 1.753 . . . . 0.0 113.612 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 84.81 -5.67 81.3 Favored Glycine 0 C--N 1.341 0.853 0 C-N-CA 128.797 3.094 . . . . 0.0 116.713 168.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 12.0 mt -64.26 -22.56 66.99 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 119.007 1.404 . . . . 0.0 114.6 -173.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 31.9 t -137.91 134.8 45.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 125.533 1.533 . . . . 0.0 112.284 -171.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 15.7 t -118.6 132.62 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 126.843 2.057 . . . . 0.0 111.281 -169.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -82.36 129.93 34.99 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.878 0.871 . . . . 0.0 110.8 169.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.01 159.76 42.03 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.111 0.964 . . . . 0.0 110.42 174.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.38 128.74 34.17 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.457 0.571 . . . . 0.0 109.912 166.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.65 -28.65 30.54 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.443 -0.786 . . . . 0.0 112.731 170.005 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 159.77 -39.79 0.47 Allowed Glycine 0 CA--C 1.531 1.038 0 C-N-CA 124.556 1.074 . . . . 0.0 115.005 172.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.31 -19.23 11.34 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.689 1.596 . . . . 0.0 113.103 172.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.85 171.74 13.8 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.485 1.914 . . . . 0.0 110.588 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 7.1 p -80.68 152.4 4.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 C-N-CA 124.328 1.051 . . . . 0.0 109.682 168.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 22.0 ptt180 -132.04 173.96 10.68 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.52 2.328 . . . . 0.0 110.749 177.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -120.09 120.93 37.67 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.643 166.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -109.87 164.04 12.96 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.159 1.384 . . . . 0.0 109.165 172.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 64.8 mt -70.02 166.35 19.91 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.725 -0.609 . . . . 0.0 111.018 172.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.8 -48.88 66.59 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 114.566 1.321 . . . . 0.0 114.566 -177.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -161.99 164.66 28.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.988 2.115 . . . . 0.0 109.377 -171.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 73.2 m -51.53 -26.83 9.21 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.918 0.887 . . . . 0.0 112.58 168.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -52.26 -58.38 6.82 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 125.024 1.329 . . . . 0.0 112.292 170.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 8.9 mt -70.22 -42.62 72.03 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.563 1.074 . . . . 0.0 109.774 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -52.25 -35.77 50.69 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.242 1.017 . . . . 0.0 113.237 173.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 20.0 mmt180 -67.01 -64.66 0.81 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.704 1.201 . . . . 0.0 112.337 175.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.63 -17.97 64.98 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 -176.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 43.0 tp -82.58 -30.94 29.26 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 127.104 2.162 . . . . 0.0 112.352 169.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -87.23 -59.71 1.73 Allowed Glycine 0 N--CA 1.473 1.102 0 C-N-CA 128.776 3.084 . . . . 0.0 114.252 -172.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -71.81 -16.57 62.18 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 119.045 1.422 . . . . 0.0 110.708 167.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 23.5 tp 78.24 147.79 0.09 Allowed 'General case' 0 C--N 1.343 0.312 0 C-N-CA 129.16 2.984 . . . . 0.0 114.488 165.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . 0.545 HG23 HG12 ' B' ' 92' ' ' VAL . 15.6 m -59.05 10.39 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 127.366 2.266 . . . . 0.0 114.46 168.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 8.6 mm-40 70.57 -17.2 0.29 Allowed 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 127.083 2.153 . . . . 0.0 115.571 172.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.545 HG12 HG23 ' B' ' 90' ' ' VAL . 2.5 p -59.06 31.13 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 C-N-CA 130.622 3.569 . . . . 0.0 116.803 -178.033 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.4 t 69.77 12.96 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 127.702 2.401 . . . . 0.0 113.086 168.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 46.6 tp 84.06 104.41 0.05 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 129.285 3.034 . . . . 0.0 108.743 -169.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.07 119.42 5.44 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.165 168.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 2.9 t -95.05 165.2 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 126.207 1.803 . . . . 0.0 109.798 171.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -62.02 18.39 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 128.576 2.75 . . . . 0.0 115.935 175.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 44.2 p -102.06 117.96 35.89 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.399 1.48 . . . . 0.0 113.392 -173.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -80.28 152.97 28.76 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 165.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -159.97 139.23 8.09 Favored Pre-proline 0 CA--C 1.545 0.757 0 CA-C-O 116.977 -1.487 . . . . 0.0 107.007 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -47.78 146.98 7.66 Favored 'Trans proline' 0 C--N 1.353 0.795 1 C-N-CA 125.753 4.302 . . . . 0.0 118.212 -167.031 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . 0.436 ' HB2' ' HE ' ' A' ' 13' ' ' ARG . 7.5 t -77.9 57.05 1.65 Allowed 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 125.316 1.446 . . . . 0.0 110.669 169.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 1.5 p -28.13 -42.32 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.575 1 C-N-CA 132.278 4.231 . . . . 0.0 116.628 -168.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -50.88 154.93 1.3 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 122.25 1.024 . . . . 0.0 112.926 177.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 72.83 -40.09 0.47 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.263 1.825 . . . . 0.0 113.742 -177.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 6.8 ptt-85 . . . . . 0 N--CA 1.486 1.349 0 C-N-CA 128.782 2.833 . . . . 0.0 113.606 171.689 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.606 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 pp -60.56 -43.11 97.63 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.747 1.018 . . . . 0.0 113.747 -174.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.34 -20.76 66.54 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.973 0.909 . . . . 0.0 113.111 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.8 mmt180 -87.77 -43.03 12.18 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.141 0.977 . . . . 0.0 110.564 173.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -59.17 -43.34 92.11 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.55 1.14 . . . . 0.0 112.095 -178.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -56.13 -30.98 58.6 Favored Glycine 0 CA--C 1.533 1.205 0 CA-C-N 118.963 0.801 . . . . 0.0 112.586 176.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.6 ttp85 -90.69 -13.77 33.53 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 174.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.1 -30.05 62.15 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 121.033 1.742 . . . . 0.0 111.108 169.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.8 mp -81.96 -45.89 14.76 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.137 0.975 . . . . 0.0 110.298 169.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.19 64.98 5.19 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-O 122.459 1.123 . . . . 0.0 112.874 170.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -136.55 138.52 26.84 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 128.876 2.87 . . . . 0.0 109.523 -177.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -52.18 -89.26 0.0 OUTLIER 'Trans proline' 0 CA--C 1.54 0.807 1 C-N-CA 126.22 4.614 . . . . 0.0 114.159 -168.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 m -67.72 -24.22 65.35 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.833 0.853 . . . . 0.0 110.734 -177.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.502 ' HG2' HD13 ' A' ' 58' ' ' LEU . 16.9 ttm105 -74.74 -37.82 62.42 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.849 1.204 . . . . 0.0 112.601 -177.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 14.0 t -55.75 -46.48 77.82 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 120.126 1.33 . . . . 0.0 109.982 166.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 58.0 mmt-85 -58.95 -44.7 91.51 Favored 'General case' 0 C--O 1.217 -0.652 0 CA-C-O 117.801 -1.095 . . . . 0.0 112.809 174.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mm -53.26 -48.93 54.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 CA-C-N 120.867 1.667 . . . . 0.0 110.763 173.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 89.3 mt -61.88 -42.39 99.01 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 118.538 -0.744 . . . . 0.0 111.44 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -77.19 -26.26 15.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -179.2 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.82 -31.67 59.49 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.289 1.436 . . . . 0.0 111.056 173.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 tp -65.1 -45.11 86.54 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 116.567 -1.682 . . . . 0.0 111.882 169.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 mt -47.59 -45.3 27.2 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.58 1.952 . . . . 0.0 113.677 -178.007 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -98.3 -1.81 40.95 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 125.97 1.708 . . . . 0.0 113.193 177.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -107.7 -76.52 0.98 Allowed Glycine 0 C--N 1.341 0.85 0 C-N-CA 126.561 2.029 . . . . 0.0 113.636 -174.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.2 m 36.45 34.7 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 C-N-CA 127.576 2.351 . . . . 0.0 115.362 -169.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.56 -62.33 1.61 Allowed 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.247 -0.908 . . . . 0.0 112.814 -172.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 8.9 p90 -164.63 155.89 13.34 Favored Pre-proline 0 N--CA 1.476 0.835 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -169.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -57.79 129.88 35.72 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 122.075 1.85 . . . . 0.0 108.682 169.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.17 -2.67 83.77 Favored Glycine 0 CA--C 1.532 1.113 0 CA-C-O 117.486 -1.73 . . . . 0.0 114.312 -173.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.519 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -60.86 -36.08 78.26 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 120.828 2.314 . . . . 0.0 110.323 169.96 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.96 -19.67 63.02 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.601 1.161 . . . . 0.0 112.221 179.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.59 -25.58 68.3 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 118.393 0.542 . . . . 0.0 111.839 178.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.08 -54.76 5.48 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.98 0.912 . . . . 0.0 111.377 169.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.519 ' CD2' HE22 ' A' ' 39' ' ' GLN . 5.4 m-70 -55.01 -26.38 36.65 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.436 HD12 HG22 ' A' ' 51' ' ' VAL . 57.0 mt -108.39 -12.79 14.98 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.26 1.424 . . . . 0.0 113.432 -176.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 66.45 6.11 32.82 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 124.202 0.906 . . . . 0.0 113.935 -171.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 57.5 mt -108.1 138.8 43.75 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.399 1.08 . . . . 0.0 111.39 -169.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.7 t -60.37 151.63 27.4 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.654 0.74 . . . . 0.0 112.324 -173.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.2 ptp180 -50.53 -35.91 31.76 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.374 1.469 . . . . 0.0 113.484 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.03 -45.74 80.37 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.373 1.069 . . . . 0.0 111.944 175.077 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -66.55 -45.5 79.19 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.36 -0.837 . . . . 0.0 111.569 175.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.436 HG22 HD12 ' A' ' 44' ' ' LEU . 2.6 t -63.39 -28.6 45.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 O-C-N 120.748 -1.22 . . . . 0.0 112.153 175.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.8 m -63.51 -41.53 98.51 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.007 0.821 . . . . 0.0 112.726 171.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -59.48 -34.03 72.06 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.912 0.885 . . . . 0.0 112.463 172.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -70.69 -45.75 64.42 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 121.105 -0.997 . . . . 0.0 112.849 172.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 83.2 mt -69.76 -18.58 63.51 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.312 1.445 . . . . 0.0 113.81 176.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.4 t -57.2 -55.56 33.13 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.97 1.259 . . . . 0.0 111.303 -178.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 16.0 t -69.6 -34.63 74.37 Favored 'General case' 0 C--O 1.219 -0.537 0 O-C-N 121.749 -0.594 . . . . 0.0 111.858 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.502 HD13 ' HG2' ' A' ' 23' ' ' ARG . 4.3 tp -64.76 -37.36 87.35 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.994 0.918 . . . . 0.0 112.514 -176.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.42 ' HG2' HG23 ' A' ' 64' ' ' VAL . 88.5 mtm180 -85.16 -30.4 23.97 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.884 1.273 . . . . 0.0 110.979 175.091 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.61 -44.55 81.78 Favored Glycine 0 N--CA 1.474 1.195 0 C-N-CA 123.915 0.769 . . . . 0.0 112.532 176.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 20.6 m -72.95 -10.2 59.55 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.376 1.47 . . . . 0.0 112.816 169.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.71 2.59 61.12 Favored Glycine 0 CA--C 1.533 1.187 0 O-C-N 120.531 -1.356 . . . . 0.0 115.127 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.5 mt -53.94 -25.94 23.0 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 120.092 1.946 . . . . 0.0 113.391 173.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.42 HG23 ' HG2' ' A' ' 59' ' ' ARG . 2.9 m -124.47 141.92 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.833 1.653 . . . . 0.0 113.881 169.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 65.6 t -133.92 137.8 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 126.186 1.795 . . . . 0.0 110.508 -175.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.468 ' HB2' ' CE1' ' A' ' 75' ' ' TYR . . . -91.28 154.43 19.26 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 174.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.8 m -143.06 135.34 27.26 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.332 1.853 . . . . 0.0 110.065 -173.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -79.63 105.36 10.87 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.827 0.851 . . . . 0.0 112.333 169.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.402 ' CG ' ' HD3' ' A' ' 74' ' ' ARG . 76.2 mm-40 -83.59 174.34 10.64 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.555 1.142 . . . . 0.0 110.76 167.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -69.57 24.16 0.38 Allowed Glycine 0 N--CA 1.481 1.649 0 N-CA-C 117.891 1.916 . . . . 0.0 117.891 -168.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.82 -14.04 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 128.174 2.59 . . . . 0.0 113.913 179.024 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -140.77 171.37 14.19 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 126.777 2.031 . . . . 0.0 108.191 -175.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 34.2 m -118.06 148.14 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 123.581 0.752 . . . . 0.0 109.004 170.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.402 ' HD3' ' CG ' ' A' ' 69' ' ' GLU . 9.2 ptt85 -117.21 -178.73 3.52 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.319 0.648 . . . . 0.0 112.499 174.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.468 ' CE1' ' HB2' ' A' ' 66' ' ' ALA . 12.0 m-85 -131.34 131.23 43.59 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.068 1.747 . . . . 0.0 106.886 166.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.88 163.73 25.7 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.673 1.589 . . . . 0.0 110.284 176.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.8 mp -59.3 146.25 40.23 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.763 0.825 . . . . 0.0 109.564 169.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -47.64 -40.86 20.76 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.808 1.243 . . . . 0.0 114.048 -178.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -167.92 167.24 12.97 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.737 1.615 . . . . 0.0 111.401 176.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -35.61 -35.79 0.06 Allowed 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 130.399 3.479 . . . . 0.0 112.228 165.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -44.05 -61.23 1.54 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 126.587 1.955 . . . . 0.0 113.059 169.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.6 mt -74.75 -29.85 61.28 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.345 0.975 . . . . 0.0 110.24 -176.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.54 -26.83 68.88 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.633 -1.175 . . . . 0.0 111.69 178.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.9 mtt180 -67.67 -71.78 0.19 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 120.117 1.326 . . . . 0.0 111.688 172.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.48 -41.79 90.58 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.451 1.023 . . . . 0.0 112.262 -169.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.94 -35.42 74.52 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.846 1.259 . . . . 0.0 111.745 175.03 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.42 -45.6 94.57 Favored Glycine 0 CA--C 1.527 0.837 0 C-N-CA 126.064 1.792 . . . . 0.0 113.571 173.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . 0.328 16.4 pt-20 -85.25 21.12 1.78 Allowed 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.629 1.172 . . . . 0.0 112.953 169.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 33.9 tp 77.75 -43.71 0.4 Allowed 'General case' 0 N--CA 1.474 0.769 1 C-N-CA 131.856 4.062 . . . . 0.0 113.986 166.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.365 5.2 t 145.3 5.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.286 1 C-N-CA 134.787 5.235 . . . . 0.0 110.412 168.966 . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 87.47 -25.34 0.09 Allowed 'General case' 0 C--O 1.217 -0.658 0 O-C-N 120.119 -1.613 . . . . 0.0 111.115 137.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.32 48.1 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 130.391 3.476 . . . . 0.0 111.217 166.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER 68.54 -32.68 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 131.635 3.974 . . . . 0.0 115.145 175.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 50.1 tp 132.86 86.36 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.108 1 C-N-CA 132.417 4.287 . . . . 0.0 106.851 -167.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.22 16.22 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 118.708 2.855 . . . . 0.0 118.708 -168.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER 68.7 128.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 129.785 3.234 . . . . 0.0 114.508 176.2 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -72.8 2.52 6.54 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 127.333 2.253 . . . . 0.0 114.09 173.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 34.6 p -80.67 170.89 15.72 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.856 1.662 . . . . 0.0 111.446 172.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -134.61 126.69 29.7 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 165.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 48.1 mm-40 -151.05 170.06 8.35 Favored Pre-proline 0 CA--C 1.546 0.811 0 C-N-CA 126.968 2.107 . . . . 0.0 108.696 -167.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -73.6 -171.77 0.92 Allowed 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.657 2.238 . . . . 0.0 109.534 166.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 51.7 t -59.29 155.61 14.16 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 123.352 1.548 . . . . 0.0 113.028 -177.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -75.44 -3.52 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-N 113.754 -1.566 . . . . 0.0 111.947 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -75.38 -25.79 57.95 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.138 0.975 . . . . 0.0 111.735 166.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -96.04 -153.95 0.42 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.699 1.6 . . . . 0.0 111.588 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 31.2 ttm180 . . . . . 0 N--CA 1.469 0.518 0 C-N-CA 124.692 1.197 . . . . 0.0 112.239 -172.846 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.597 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 pp -55.76 -45.21 78.12 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -175.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.62 -25.55 68.01 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.398 1.079 . . . . 0.0 113.082 -178.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 15.9 mmt180 -84.0 -41.75 16.93 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.736 0.814 . . . . 0.0 110.498 176.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -57.95 -48.53 79.68 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.326 0.65 . . . . 0.0 111.523 177.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.75 -28.2 62.68 Favored Glycine 0 CA--C 1.533 1.165 0 CA-C-N 119.005 0.821 . . . . 0.0 113.046 -178.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -87.22 -21.53 25.79 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-O 118.028 -0.987 . . . . 0.0 113.651 171.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.45 -29.28 64.68 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 121.584 1.993 . . . . 0.0 112.205 172.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.2 mp -84.11 -44.74 13.73 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 118.089 -0.958 . . . . 0.0 110.489 169.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.68 66.68 5.23 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-O 122.804 1.288 . . . . 0.0 111.467 169.209 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -136.15 139.74 30.95 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 128.318 2.647 . . . . 0.0 109.242 -175.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -55.23 -79.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 125.179 3.92 . . . . 0.0 111.811 -171.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.88 -30.84 69.43 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 117.355 -1.307 . . . . 0.0 111.486 -178.046 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 64.5 mtt85 -72.95 -37.35 67.15 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 121.299 1.863 . . . . 0.0 112.715 -177.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 36.5 t -54.3 -48.69 71.0 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 121.438 1.926 . . . . 0.0 110.301 168.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 73.8 mmt-85 -58.59 -54.12 50.68 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.022 0.929 . . . . 0.0 112.949 175.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mm -49.78 -50.21 18.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 C-N-CA 125.939 1.696 . . . . 0.0 111.67 172.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 96.3 mt -65.56 -41.61 92.78 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.597 -175.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 p -78.08 -28.4 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 CA-C-N 119.102 0.865 . . . . 0.0 112.562 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.72 -31.73 69.9 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.494 1.118 . . . . 0.0 111.627 170.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.412 ' O ' HG13 ' B' ' 34' ' ' VAL . 3.6 tp -63.58 -45.51 90.12 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 117.087 -1.435 . . . . 0.0 112.466 169.434 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.1 mt -47.63 -45.62 27.93 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 127.311 2.244 . . . . 0.0 113.856 -176.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -106.9 18.1 22.26 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 126.171 1.789 . . . . 0.0 112.317 179.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.67 -75.07 0.23 Allowed Glycine 0 N--CA 1.47 0.937 0 C-N-CA 125.94 1.734 . . . . 0.0 113.554 -175.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . 0.588 ' HB ' ' HE ' ' B' ' 74' ' ' ARG . 26.7 m 36.71 34.61 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 127.047 2.139 . . . . 0.0 116.477 -171.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.6 -59.58 2.39 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 -171.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . 0.417 ' HA ' ' HA ' ' B' ' 74' ' ' ARG . 7.7 p90 -165.89 156.59 11.68 Favored Pre-proline 0 N--CA 1.473 0.684 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -170.17 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -57.51 129.97 36.57 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.209 1.939 . . . . 0.0 108.684 169.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.98 -0.83 81.94 Favored Glycine 0 CA--C 1.532 1.103 0 CA-C-O 117.252 -1.86 . . . . 0.0 114.559 -173.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . 0.569 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -61.1 -37.56 83.17 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 121.045 2.422 . . . . 0.0 109.818 169.546 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 4.3 mt -60.59 -21.07 62.22 Favored 'General case' 0 C--O 1.222 -0.364 0 C-N-CA 124.673 1.189 . . . . 0.0 111.948 179.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.75 -27.59 69.3 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.787 -0.57 . . . . 0.0 112.149 178.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -80.23 -52.53 7.62 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.177 0.991 . . . . 0.0 111.474 170.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . 0.569 ' CD2' HE22 ' B' ' 39' ' ' GLN . 2.6 m-70 -54.88 -27.55 43.64 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 179.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 53.1 mt -108.29 -14.92 14.59 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.967 1.307 . . . . 0.0 113.961 -174.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.57 5.26 49.67 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 124.309 0.957 . . . . 0.0 114.107 -170.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 75.7 mt -105.03 137.51 42.67 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.653 1.181 . . . . 0.0 111.309 -171.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 12.6 t -60.84 152.03 28.3 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.513 -0.742 . . . . 0.0 112.16 -173.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -50.45 -42.68 54.5 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.983 1.313 . . . . 0.0 112.81 -178.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 1.5 m -64.3 -38.95 92.85 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.138 -0.977 . . . . 0.0 112.547 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -70.48 -45.83 64.92 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.256 0.623 . . . . 0.0 111.308 174.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.2 t -63.13 -31.23 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 O-C-N 120.981 -1.075 . . . . 0.0 111.694 176.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 39.2 m -56.67 -44.39 81.36 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.956 1.253 . . . . 0.0 113.056 169.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -60.74 -28.13 68.46 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.228 0.922 . . . . 0.0 112.869 176.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -78.52 -41.76 31.38 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.878 -1.139 . . . . 0.0 112.616 173.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 89.5 mt -72.28 -17.64 61.86 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.747 1.219 . . . . 0.0 114.064 174.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 2.3 t -58.97 -58.54 8.18 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.449 1.022 . . . . 0.0 111.601 -177.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 9.1 t -64.59 -39.27 93.43 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.714 -0.616 . . . . 0.0 111.415 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.1 tp -55.8 -48.43 75.4 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.917 2.487 . . . . 0.0 113.1 -177.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -80.5 -12.53 59.53 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.118 0.967 . . . . 0.0 111.859 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -82.36 -47.05 6.23 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.205 0.907 . . . . 0.0 111.307 169.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 59.8 m -67.95 -3.26 9.37 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 127.358 2.263 . . . . 0.0 114.414 174.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 62.47 22.82 64.04 Favored Glycine 0 N--CA 1.471 0.999 0 CA-C-N 119.852 1.205 . . . . 0.0 114.006 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 85.1 mt -69.5 -24.32 63.74 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.188 1.494 . . . . 0.0 112.761 171.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 1.5 m -146.82 140.57 20.12 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 C-N-CA 126.223 1.809 . . . . 0.0 111.328 -169.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 9.3 t -138.25 140.64 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 O-C-N 124.115 0.884 . . . . 0.0 110.22 -169.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.94 147.74 26.1 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.852 1.261 . . . . 0.0 113.261 174.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 45.4 m -138.15 135.55 35.81 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.892 1.677 . . . . 0.0 109.544 -177.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -79.26 120.83 24.29 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 123.977 0.798 . . . . 0.0 110.525 168.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -106.05 173.73 6.19 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.003 1.721 . . . . 0.0 109.5 175.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -68.36 23.79 0.27 Allowed Glycine 0 N--CA 1.481 1.649 0 N-CA-C 118.366 2.107 . . . . 0.0 118.366 -168.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 170.15 -9.61 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 128.929 2.891 . . . . 0.0 114.076 177.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -142.77 172.89 12.08 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.169 1.788 . . . . 0.0 108.524 -177.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 35.6 m -116.39 148.02 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 169.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . 0.588 ' HE ' ' HB ' ' B' ' 34' ' ' VAL . 0.0 OUTLIER -122.38 -179.32 4.15 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.541 0.686 . . . . 0.0 111.871 178.558 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -128.88 136.27 50.2 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 166.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.437 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -134.6 161.59 34.67 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 124.6 1.16 . . . . 0.0 109.445 177.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.27 148.89 49.19 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 167.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.96 -27.97 69.2 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 115.873 1.805 . . . . 0.0 115.873 -169.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -172.94 162.42 4.69 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.234 1.813 . . . . 0.0 112.286 177.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.3 m -33.84 -38.57 0.06 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 129.524 3.13 . . . . 0.0 112.885 164.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -50.06 -58.15 6.12 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.588 1.955 . . . . 0.0 113.161 173.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 14.3 mt -72.66 -38.15 67.72 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 120.878 -1.139 . . . . 0.0 110.668 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -56.18 -31.37 63.35 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.975 1.31 . . . . 0.0 112.999 176.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -66.89 -66.24 0.58 Allowed 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 120.25 1.386 . . . . 0.0 111.5 171.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.48 -41.33 76.41 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.146 0.979 . . . . 0.0 112.527 -173.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -78.12 -32.47 50.46 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.27 1.828 . . . . 0.0 111.717 176.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.91 -45.59 91.99 Favored Glycine 0 N--CA 1.469 0.849 0 C-N-CA 125.637 1.589 . . . . 0.0 112.205 177.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . 0.313 19.6 pt-20 -92.05 20.0 6.26 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 167.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . 0.551 ' O ' HG13 ' B' ' 90' ' ' VAL . 24.8 tp 70.79 -42.87 0.54 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 131.057 3.743 . . . . 0.0 115.692 167.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . 0.551 HG13 ' O ' ' B' ' 89' ' ' LEU . 2.6 m 168.38 -21.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.956 1 C-N-CA 131.928 4.091 . . . . 0.0 110.581 -171.372 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 71.04 -15.73 0.39 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.454 2.302 . . . . 0.0 114.276 174.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.505 HG13 ' O ' ' B' ' 92' ' ' VAL . 3.6 p -59.21 37.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 129.408 3.083 . . . . 0.0 115.51 170.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 80.38 -24.6 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 C-N-CA 127.909 2.484 . . . . 0.0 112.682 175.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 56.0 tp 117.05 95.04 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 131.347 3.859 . . . . 0.0 105.919 -167.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.8 122.57 18.87 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.422 -0.799 . . . . 0.0 108.891 171.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . 0.413 HG23 ' H ' ' B' ' 96' ' ' VAL . 2.7 t -51.9 139.08 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 124.736 1.215 . . . . 0.0 113.95 -178.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -67.04 12.7 0.07 Allowed 'General case' 0 CA--C 1.561 1.366 0 C-N-CA 127.72 2.408 . . . . 0.0 115.037 171.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 6.8 p -89.35 171.16 9.96 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.574 1.549 . . . . 0.0 110.801 173.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -126.56 122.5 35.27 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 168.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 50.7 mm-40 -147.96 165.24 19.01 Favored Pre-proline 0 CA--C 1.544 0.717 0 C-N-CA 127.014 2.126 . . . . 0.0 108.59 -168.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.34 -173.95 1.64 Allowed 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.466 2.777 . . . . 0.0 110.025 167.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 36.4 t -58.85 149.33 27.06 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-O 122.527 1.156 . . . . 0.0 112.975 179.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -74.77 1.52 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 CA-C-N 114.869 -1.06 . . . . 0.0 112.378 -177.049 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.15 -27.36 42.73 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.392 1.077 . . . . 0.0 111.938 166.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -89.72 -153.41 0.28 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 126.168 1.787 . . . . 0.0 111.864 175.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 34.5 ttm180 . . . . . 0 N--CA 1.469 0.517 0 C-N-CA 124.94 1.296 . . . . 0.0 111.786 -174.428 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.069 0 CA-C-O 117.97 -1.014 . . . . 0.0 108.478 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 25.9 tp -52.36 -44.13 65.05 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.714 1.143 . . . . 0.0 110.964 173.261 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.81 -3.51 12.68 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.458 ' HD2' ' HB2' ' B' ' 102' ' ' CYS . 66.5 mtt-85 -124.46 -38.44 2.41 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.06 1.344 . . . . 0.0 111.265 178.761 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.431 ' C ' HD13 ' A' ' 14' ' ' LEU . 1.8 tm? -50.9 -58.2 6.59 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.784 1.633 . . . . 0.0 107.941 166.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.12 -22.7 77.39 Favored Glycine 0 C--O 1.218 -0.856 0 CA-C-O 118.392 -1.227 . . . . 0.0 111.627 -178.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.438 HH11 ' HG3' ' A' ' 16' ' ' ARG . 2.6 ttm-85 -68.75 -39.31 80.38 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 119.514 1.657 . . . . 0.0 111.688 171.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.88 -35.3 79.71 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 121.072 -1.018 . . . . 0.0 111.658 175.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . 0.27 6.9 mp -87.53 10.42 17.85 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 123.536 0.734 . . . . 0.0 111.639 171.533 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -111.55 2.23 17.27 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 126.105 1.762 . . . . 0.0 113.52 166.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.418 ' CG ' ' HE ' ' A' ' 23' ' ' ARG . 7.4 t70 -105.07 136.3 19.19 Favored Pre-proline 0 CA--C 1.538 0.511 0 C-N-CA 126.08 1.752 . . . . 0.0 109.904 -172.012 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.433 ' HG2' ' H ' ' A' ' 22' ' ' THR . 55.2 Cg_endo -55.86 -62.94 0.21 Allowed 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 125.226 3.951 . . . . 0.0 111.201 -172.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.433 ' H ' ' HG2' ' A' ' 21' ' ' PRO . 85.3 m -62.6 -44.12 97.11 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 117.558 -1.211 . . . . 0.0 109.832 -174.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.418 ' HE ' ' CG ' ' A' ' 20' ' ' ASP . 30.1 mtm180 -68.51 -38.39 80.9 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 117.128 -1.415 . . . . 0.0 112.491 -175.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 88.1 m -57.97 -50.0 74.88 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 120.244 1.384 . . . . 0.0 111.02 170.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.3 ttm180 -62.54 -37.45 86.14 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 118.758 -0.639 . . . . 0.0 112.266 177.049 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.4 mt -54.04 -61.63 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 C-N-CA 125.059 1.344 . . . . 0.0 110.055 169.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 92.3 mt -56.15 -41.15 74.94 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.811 0.844 . . . . 0.0 111.501 -169.224 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.2 p -77.52 -32.43 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 175.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.79 -30.27 68.82 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 119.29 0.95 . . . . 0.0 112.507 174.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.512 ' O ' HG13 ' A' ' 34' ' ' VAL . 7.0 tp -64.47 -43.46 94.16 Favored 'General case' 0 N--CA 1.45 -0.441 0 O-C-N 121.094 -1.004 . . . . 0.0 112.244 177.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -44.28 -36.11 2.61 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.958 2.903 . . . . 0.0 113.916 174.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -90.9 -41.08 11.36 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.3 1.84 . . . . 0.0 112.723 176.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.38 -69.93 1.3 Allowed Glycine 0 C--N 1.337 0.587 0 C-N-CA 124.026 0.822 . . . . 0.0 112.449 -168.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.577 HG12 ' HA ' ' A' ' 76' ' ' ALA . 16.3 m 37.88 33.23 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 125.371 1.469 . . . . 0.0 114.692 -167.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -83.91 -64.46 1.16 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.016 -1.053 . . . . 0.0 112.177 -171.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -156.97 157.11 30.53 Favored Pre-proline 0 N--CA 1.473 0.688 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -169.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -58.98 118.97 5.95 Favored 'Trans proline' 0 C--N 1.352 0.749 0 C-N-CA 122.24 1.96 . . . . 0.0 108.52 171.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 90.68 1.46 73.97 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-O 117.335 -1.814 . . . . 0.0 114.936 -175.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.45 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -61.47 -35.83 78.74 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 121.184 2.492 . . . . 0.0 110.468 169.429 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 33.7 mt -54.45 -22.53 12.95 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 126.135 1.774 . . . . 0.0 112.077 174.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.86 -27.26 69.05 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.348 -1.47 . . . . 0.0 112.2 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.54 -57.09 4.01 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 118.203 0.456 . . . . 0.0 110.267 169.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.45 ' CD2' HE22 ' A' ' 39' ' ' GLN . 3.0 m-70 -54.57 -31.0 55.9 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 -177.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 37.5 mt -103.05 -2.67 27.12 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.968 1.307 . . . . 0.0 113.417 -175.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.24 7.83 20.76 Favored Glycine 0 CA--C 1.535 1.324 0 CA-C-N 118.968 0.804 . . . . 0.0 114.441 -175.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 36.2 mt -107.25 160.19 15.78 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.61 1.164 . . . . 0.0 112.91 -171.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.564 HG23 ' H ' ' A' ' 50' ' ' ASN . 1.2 t -62.49 144.54 55.88 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.124 -0.985 . . . . 0.0 111.768 170.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -55.46 -29.21 58.28 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 127.007 2.123 . . . . 0.0 111.602 175.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 29.8 p -72.03 -57.33 4.37 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.431 -0.793 . . . . 0.0 111.739 169.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.564 ' H ' HG23 ' A' ' 47' ' ' THR . 14.8 t30 -66.09 -26.43 67.47 Favored 'General case' 0 CA--C 1.543 0.699 0 O-C-N 120.075 -1.641 . . . . 0.0 113.94 -175.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 75.9 t -66.54 -35.47 74.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 CA-C-N 120.402 1.456 . . . . 0.0 111.439 167.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.9 p -77.11 -22.29 52.94 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.697 -1.252 . . . . 0.0 114.137 178.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 -39.64 -44.94 1.58 Allowed 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 126.239 1.815 . . . . 0.0 111.198 167.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . 0.264 11.6 m-70 -104.33 -11.02 17.39 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -173.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 80.7 mt -71.64 -21.63 61.8 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.735 -1.228 . . . . 0.0 112.695 168.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.6 t -50.96 -42.59 60.01 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.576 1.08 . . . . 0.0 113.809 178.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 48.4 t -89.85 -32.15 17.03 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 118.79 0.723 . . . . 0.0 111.771 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 tp -56.58 -40.36 75.11 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.79 0.836 . . . . 0.0 111.311 176.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 33.7 mtm105 -78.32 -16.43 57.73 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 175.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -88.69 -56.19 2.03 Favored Glycine 0 N--CA 1.47 0.954 0 C-N-CA 125.931 1.729 . . . . 0.0 111.883 -177.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 52.0 m -64.27 -6.66 7.29 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 125.309 1.444 . . . . 0.0 111.942 168.052 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.49 6.62 84.52 Favored Glycine 0 C--N 1.341 0.849 0 C-N-CA 124.979 1.276 . . . . 0.0 114.176 171.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.7 mt -48.41 -28.73 3.42 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.262 1.425 . . . . 0.0 113.15 170.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.7 m -132.12 143.73 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 126.173 1.789 . . . . 0.0 112.23 173.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 45.4 t -126.5 143.3 40.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 127.154 2.182 . . . . 0.0 110.047 -175.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -89.54 154.03 20.32 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.111 1.364 . . . . 0.0 113.795 173.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.4 m -163.01 161.59 25.55 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.702 1.601 . . . . 0.0 108.471 -174.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.422 ' HA ' ' HA ' ' A' ' 73' ' ' VAL . 17.4 m-85 -80.47 156.63 26.49 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 119.672 1.124 . . . . 0.0 113.05 169.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -115.41 -152.5 0.5 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.04 1.336 . . . . 0.0 108.825 166.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -61.02 -22.19 60.07 Favored Glycine 0 CA--C 1.537 1.414 0 CA-C-N 121.01 1.732 . . . . 0.0 115.156 -175.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.74 -23.34 0.08 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.708 1.203 . . . . 0.0 113.871 169.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -95.14 -170.24 2.15 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.484 1.914 . . . . 0.0 109.982 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' A' ' 68' ' ' TYR . 35.1 m -109.9 166.09 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 124.61 1.164 . . . . 0.0 109.959 169.282 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.0 ptt180 -140.8 171.04 14.64 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 128.178 2.591 . . . . 0.0 110.319 -170.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -124.03 139.05 54.32 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.88 1.272 . . . . 0.0 108.008 167.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.577 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -131.98 161.4 33.22 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 126.314 1.846 . . . . 0.0 109.547 175.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.0 mt -60.77 159.53 10.87 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 118.732 0.696 . . . . 0.0 110.248 169.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -42.49 -44.37 4.05 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.436 1.494 . . . . 0.0 114.334 -176.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.411 ' CG ' ' H ' ' A' ' 80' ' ' SER . 17.4 t70 -177.55 -172.35 0.36 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 129.491 3.116 . . . . 0.0 109.576 169.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.411 ' H ' ' CG ' ' A' ' 79' ' ' ASP . 14.3 t -53.37 -20.92 5.0 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 127.32 2.248 . . . . 0.0 113.396 174.185 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -46.92 87.76 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.224 1.009 . . . . 0.0 111.692 176.406 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 8.8 mt -86.52 -31.99 20.98 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.193 0.906 . . . . 0.0 111.202 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.58 -28.6 65.69 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.036 0.835 . . . . 0.0 112.893 170.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.9 mmt180 -69.33 -65.68 0.68 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.256 1.422 . . . . 0.0 112.002 169.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.83 -19.54 64.18 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -175.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.34 -38.82 14.82 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.6 -1.312 . . . . 0.0 111.949 167.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.47 -52.71 20.16 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 126.361 1.934 . . . . 0.0 114.372 -177.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.26 -6.89 56.32 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 118.562 1.181 . . . . 0.0 112.56 169.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 18.8 tp 77.79 128.47 0.05 OUTLIER 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 129.393 3.077 . . . . 0.0 113.201 167.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.415 ' HB ' HG22 ' A' ' 92' ' ' VAL . 2.4 m -34.13 -21.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 131.129 3.771 . . . . 0.0 116.532 170.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 76.57 -9.9 1.41 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.287 1.835 . . . . 0.0 114.063 165.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.415 HG22 ' HB ' ' A' ' 90' ' ' VAL . 17.3 m -64.57 57.44 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.717 1 C-N-CA 132.497 4.319 . . . . 0.0 112.159 169.704 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . 0.396 0.5 OUTLIER 19.04 44.86 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.424 -1.762 0 CA-C-N 108.581 -3.918 . . . . 0.0 116.272 -162.805 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 50.8 tp 61.29 83.91 0.14 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 126.851 2.061 . . . . 0.0 111.674 -169.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.69 85.76 0.05 OUTLIER 'General case' 0 CA--C 1.55 0.948 0 O-C-N 121.057 -1.027 . . . . 0.0 111.712 170.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 89.9 t -59.04 153.94 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 127.829 2.452 . . . . 0.0 111.199 169.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -42.96 1.79 0.0 OUTLIER 'General case' 0 CA--C 1.565 1.524 1 C-N-CA 131.727 4.011 . . . . 0.0 117.162 169.885 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -97.17 146.82 24.7 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 128.23 2.612 . . . . 0.0 116.501 -169.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 28.0 t0 -89.21 73.29 8.11 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.967 1.707 . . . . 0.0 109.759 167.012 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -65.64 146.91 98.95 Favored Pre-proline 0 CA--C 1.549 0.907 0 O-C-N 120.845 -1.16 . . . . 0.0 109.93 169.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.67 97.17 0.78 Allowed 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 123.477 2.785 . . . . 0.0 112.746 -178.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -55.15 -6.16 0.14 Allowed 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 129.452 3.101 . . . . 0.0 116.155 -178.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 14.4 t 71.3 -51.05 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 128.853 2.861 . . . . 0.0 111.263 -173.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -77.96 -65.94 0.91 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.335 1.454 . . . . 0.0 111.881 -173.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -78.29 -31.52 48.95 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 117.835 0.289 . . . . 0.0 110.859 168.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 . . . . . 0 CA--C 1.548 0.878 0 C-N-CA 127.106 2.162 . . . . 0.0 110.583 175.991 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.058 0 CA-C-O 118.727 -0.654 . . . . 0.0 110.074 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 19.0 tp -51.31 -47.1 62.71 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.124 0.875 . . . . 0.0 110.691 170.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.48 -3.07 3.87 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 116.416 2.006 . . . . 0.0 116.416 178.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 66.2 mtt-85 -124.29 -42.21 2.13 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.004 1.321 . . . . 0.0 110.757 -179.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.425 HD13 ' C ' ' B' ' 14' ' ' LEU . 0.9 OUTLIER -53.73 -52.89 58.67 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.94 1.696 . . . . 0.0 108.763 168.283 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.52 -23.19 78.34 Favored Glycine 0 C--O 1.222 -0.649 0 CA-C-O 118.645 -1.086 . . . . 0.0 111.392 -178.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.402 HH11 ' HG3' ' B' ' 16' ' ' ARG . 2.1 ttm-85 -68.37 -44.51 75.04 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.214 1.507 . . . . 0.0 110.515 168.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.99 -30.13 70.63 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.987 0.812 . . . . 0.0 112.511 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 5.9 mp -93.42 9.56 35.97 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 124.335 1.054 . . . . 0.0 113.095 169.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -111.6 1.63 16.91 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.625 1.57 . . . . 0.0 112.16 165.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -75.19 146.3 81.61 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 126.034 1.734 . . . . 0.0 112.371 -169.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -59.31 -19.3 49.92 Favored 'Trans proline' 0 C--N 1.349 0.571 1 C-N-CA 125.479 4.119 . . . . 0.0 116.073 179.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -143.09 -30.57 0.51 Allowed 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 117.685 -1.15 . . . . 0.0 113.121 -176.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.584 ' HG2' HD13 ' B' ' 58' ' ' LEU . 0.0 OUTLIER -61.11 -30.6 70.46 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 120.359 1.436 . . . . 0.0 112.744 176.974 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 88.0 m -53.4 -52.76 58.32 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.581 1.152 . . . . 0.0 111.134 168.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 12.5 ttm180 -61.53 -43.19 99.31 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.274 1.03 . . . . 0.0 112.413 173.288 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . 0.648 HG12 HD11 ' B' ' 44' ' ' LEU . 2.5 mt -51.36 -57.65 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 C-N-CA 124.734 1.214 . . . . 0.0 110.839 174.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 86.4 mt -55.81 -44.34 77.75 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.501 1.12 . . . . 0.0 111.817 -175.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 8.8 p -76.45 -31.41 20.44 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 CA-C-N 119.373 0.988 . . . . 0.0 113.1 178.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . 0.423 ' HB1' ' CD2' ' B' ' 43' ' ' HIS . . . -72.13 -31.51 66.07 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.716 -0.615 . . . . 0.0 111.985 174.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' B' ' 30' ' ' LEU . 10.7 tp -60.64 -41.27 94.6 Favored 'General case' 0 C--N 1.341 0.221 0 O-C-N 120.924 -1.11 . . . . 0.0 112.828 178.366 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -43.33 -36.74 1.98 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 129.377 3.071 . . . . 0.0 113.423 173.17 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -90.33 -34.17 15.81 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.447 1.899 . . . . 0.0 112.697 178.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -93.38 -68.27 1.09 Allowed Glycine 0 C--N 1.338 0.676 0 C-N-CA 123.706 0.669 . . . . 0.0 114.105 -168.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . 0.409 HG12 ' HA ' ' B' ' 76' ' ' ALA . 31.2 m 36.78 33.98 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 C-N-CA 126.47 1.908 . . . . 0.0 115.311 -167.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.04 -63.6 1.35 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.456 -0.778 . . . . 0.0 113.064 -169.022 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . 0.41 ' HA ' ' HA ' ' B' ' 74' ' ' ARG . 6.0 p90 -161.1 161.31 24.0 Favored Pre-proline 0 C--O 1.24 0.59 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 -169.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -58.65 127.16 23.52 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 122.288 1.992 . . . . 0.0 107.601 167.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.47 2.93 90.7 Favored Glycine 0 CA--C 1.531 1.048 0 CA-C-O 117.321 -1.822 . . . . 0.0 114.782 -175.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . 0.524 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -62.8 -41.07 99.12 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 121.279 2.539 . . . . 0.0 110.394 169.731 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 29.7 mt -54.66 -19.07 5.38 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 125.647 1.579 . . . . 0.0 112.958 176.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.89 -32.47 67.74 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.571 1.078 . . . . 0.0 112.553 172.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.81 -51.29 11.61 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.286 0.634 . . . . 0.0 111.96 170.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . 0.524 ' CD2' HE22 ' B' ' 39' ' ' GLN . 3.7 m-70 -56.03 -24.29 38.37 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.997 1.481 . . . . 0.0 114.997 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.648 HD11 HG12 ' B' ' 26' ' ' ILE . 56.4 mt -112.29 -4.16 14.39 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 125.845 1.658 . . . . 0.0 113.277 -177.067 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 61.05 7.81 9.62 Favored Glycine 0 CA--C 1.536 1.377 0 CA-C-O 119.013 -0.881 . . . . 0.0 114.818 -172.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 16.2 mt -102.04 162.44 12.91 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.703 1.601 . . . . 0.0 113.067 -169.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.494 HG23 ' H ' ' B' ' 50' ' ' ASN . 1.5 t -61.57 138.5 58.3 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 121.237 -0.914 . . . . 0.0 111.24 172.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 66.7 mtt180 -49.93 -31.62 12.84 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 126.561 1.945 . . . . 0.0 111.936 173.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 60.7 p -72.47 -52.39 15.99 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 118.664 0.665 . . . . 0.0 112.724 173.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . 0.494 ' H ' HG23 ' B' ' 47' ' ' THR . 44.2 t30 -69.5 -25.57 64.12 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 120.662 1.573 . . . . 0.0 113.259 -179.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . 0.543 HG22 HD12 ' B' ' 44' ' ' LEU . 37.2 t -61.1 -51.87 68.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 O-C-N 121.514 -0.741 . . . . 0.0 109.436 167.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 78.0 p -75.77 -27.56 58.09 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 115.741 1.756 . . . . 0.0 115.741 -176.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -36.86 -56.15 0.87 Allowed 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 123.984 1.85 . . . . 0.0 109.895 168.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 27.4 m-70 -90.43 -4.33 57.08 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -178.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 86.9 mt -72.19 -16.64 61.96 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.73 -1.231 . . . . 0.0 108.979 164.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 21.3 t -49.92 -42.11 47.5 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.911 1.232 . . . . 0.0 112.64 168.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 7.2 t -84.34 -44.84 13.4 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 119.478 1.035 . . . . 0.0 112.03 178.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.584 HD13 ' HG2' ' B' ' 23' ' ' ARG . 6.9 tp -56.71 -34.61 67.64 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.382 0.673 . . . . 0.0 111.683 -176.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 38.3 mtm105 -81.68 -31.46 32.23 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.121 0.968 . . . . 0.0 113.551 174.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.5 -50.14 39.67 Favored Glycine 0 N--CA 1.473 1.116 0 CA-C-N 119.253 0.933 . . . . 0.0 111.931 177.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 56.9 m -65.95 -0.63 2.43 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 125.737 1.615 . . . . 0.0 113.115 172.013 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.04 -8.78 10.82 Favored Glycine 0 C--N 1.342 0.863 0 C-N-CA 125.67 1.605 . . . . 0.0 114.88 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 20.7 mt -52.33 -28.12 18.05 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 125.819 1.647 . . . . 0.0 113.59 -176.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.414 HG12 ' CD2' ' B' ' 30' ' ' LEU . 3.0 m -125.98 141.64 45.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 126.624 1.97 . . . . 0.0 112.036 167.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 64.7 t -132.58 141.73 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 127.376 2.27 . . . . 0.0 109.557 -174.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.67 164.43 22.83 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.971 1.309 . . . . 0.0 113.175 178.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.44 ' HB ' ' HG2' ' B' ' 74' ' ' ARG . 0.2 OUTLIER -165.89 173.1 10.88 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.325 1.05 . . . . 0.0 108.671 178.896 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -94.9 157.15 16.04 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.21 0.604 . . . . 0.0 110.196 164.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -120.92 -151.03 0.47 Allowed 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.282 1.433 . . . . 0.0 109.321 167.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.6 -24.61 59.91 Favored Glycine 0 CA--C 1.535 1.299 0 CA-C-N 120.719 1.599 . . . . 0.0 115.105 -174.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.79 -21.94 0.08 Allowed 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 118.628 1.214 . . . . 0.0 113.93 168.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -97.1 -174.21 2.9 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.307 1.843 . . . . 0.0 109.78 -178.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 34.6 m -105.46 162.02 4.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.514 1.125 . . . . 0.0 109.482 168.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . 0.44 ' HG2' ' HB ' ' B' ' 67' ' ' THR . 6.7 ptt180 -137.54 175.45 9.59 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 126.928 2.091 . . . . 0.0 111.039 -171.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -129.14 141.41 51.19 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.435 1.094 . . . . 0.0 109.032 166.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.409 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -138.47 159.77 41.22 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 125.855 1.662 . . . . 0.0 110.113 178.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 50.0 mt -58.21 152.62 16.74 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 122.699 0.4 . . . . 0.0 111.362 172.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -46.89 -46.64 21.31 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.834 1.654 . . . . 0.0 114.01 -174.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -162.3 166.12 25.74 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 127.014 2.126 . . . . 0.0 108.58 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 8.0 t -52.12 -20.11 2.33 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.035 1.334 . . . . 0.0 113.322 168.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.54 -48.07 82.08 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.86 1.664 . . . . 0.0 113.428 170.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 18.2 mt -75.96 -35.37 59.69 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 119.578 1.081 . . . . 0.0 110.084 176.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.17 -28.59 66.75 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 118.848 0.749 . . . . 0.0 112.823 173.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 12.0 mmt180 -76.15 -64.31 1.13 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.679 1.591 . . . . 0.0 112.314 174.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.81 -22.46 64.18 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -178.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.35 -45.12 13.1 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 121.262 -0.899 . . . . 0.0 111.097 168.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.59 -49.21 45.4 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 125.895 1.712 . . . . 0.0 115.006 -173.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.9 -5.23 55.17 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.644 1.222 . . . . 0.0 112.292 169.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 17.9 tp 77.49 127.58 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 128.825 2.85 . . . . 0.0 113.294 168.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . 0.414 ' HB ' HG22 ' B' ' 92' ' ' VAL . 2.2 m -35.71 -19.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 131.234 3.814 . . . . 0.0 115.951 168.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 75.37 -7.48 1.77 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 127.272 2.229 . . . . 0.0 114.273 167.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.414 HG22 ' HB ' ' B' ' 90' ' ' VAL . 13.5 m -69.45 60.29 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.616 1 C-N-CA 131.715 4.006 . . . . 0.0 112.069 174.055 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.39 0.5 OUTLIER 21.79 38.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.425 -1.697 2 CA-C-N 107.302 -4.499 . . . . 0.0 116.461 -163.375 . . . . . . . . 4 3 . 1 . 017 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 37.8 tp 64.39 73.8 0.42 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.023 1.729 . . . . 0.0 111.511 -169.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.02 98.17 0.07 Allowed 'General case' 0 CA--C 1.55 0.955 0 O-C-N 120.764 -1.21 . . . . 0.0 111.91 169.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -74.56 160.08 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 C-N-CA 126.874 2.07 . . . . 0.0 112.412 174.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -44.06 -6.69 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.235 1 C-N-CA 131.802 4.041 . . . . 0.0 117.63 178.087 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.13 152.16 19.42 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 126.382 1.873 . . . . 0.0 115.21 -172.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -92.05 80.46 5.12 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.073 1.749 . . . . 0.0 109.544 167.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -64.5 162.87 30.65 Favored Pre-proline 0 CA--C 1.557 1.242 0 C-N-CA 124.812 1.245 . . . . 0.0 112.187 174.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -75.74 73.34 4.77 Favored 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 124.112 3.208 . . . . 0.0 113.945 -176.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . 0.458 ' HB2' ' HD2' ' A' ' 13' ' ' ARG . 2.5 t -35.17 -17.89 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.178 1 C-N-CA 133.037 4.535 . . . . 0.0 119.842 175.789 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER 63.35 -26.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 130.939 3.696 . . . . 0.0 115.654 -170.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -103.18 -44.55 5.16 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 116.007 1.854 . . . . 0.0 116.007 -167.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -104.94 -62.7 1.31 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.322 0.965 . . . . 0.0 111.949 -176.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 . . . . . 0 CA--C 1.55 0.952 0 C-N-CA 126.804 2.041 . . . . 0.0 114.031 177.431 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.652 0 CA-C-O 120.871 0.367 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.1 tt -59.99 -41.86 92.97 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.653 0.781 . . . . 0.0 111.22 -175.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.41 -9.28 32.25 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.2 mmp_? -96.2 -58.53 2.05 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.376 -0.828 . . . . 0.0 108.983 165.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.411 ' CD2' HD21 ' A' ' 63' ' ' LEU . 1.6 tm? -59.94 -54.49 45.5 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.246 1.418 . . . . 0.0 111.878 -173.12 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.91 -28.79 73.96 Favored Glycine 0 CA--C 1.528 0.864 0 O-C-N 121.647 -0.658 . . . . 0.0 113.015 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 54.8 ttt-85 -74.9 -26.93 60.0 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.119 0.967 . . . . 0.0 111.78 174.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -87.21 -3.92 59.08 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.293 1.037 . . . . 0.0 113.616 172.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.1 mt -99.42 -24.22 14.86 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.747 1.219 . . . . 0.0 110.857 168.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.38 82.78 3.17 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.205 1.402 . . . . 0.0 114.166 -174.032 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -150.82 154.26 34.49 Favored Pre-proline 0 CA--C 1.541 0.607 0 C-N-CA 125.743 1.617 . . . . 0.0 111.229 -176.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -57.74 -67.4 0.07 OUTLIER 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 124.103 3.202 . . . . 0.0 112.025 175.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 55.9 m -74.2 -43.71 56.13 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 124.386 1.074 . . . . 0.0 111.241 -177.012 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.535 ' CD ' HD13 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -60.17 -32.83 71.43 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 118.343 -0.837 . . . . 0.0 112.704 -175.486 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.5 t -56.54 -53.45 57.38 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.292 0.951 . . . . 0.0 111.072 168.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -57.76 -46.28 84.74 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.747 -0.596 . . . . 0.0 112.49 175.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.7 mt -45.33 -56.48 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-N 118.677 0.671 . . . . 0.0 110.075 173.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 27' ' ' LEU . 21.5 mt -65.77 -32.78 74.51 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -169.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.6 m -66.85 -34.63 71.24 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 CA-C-N 120.435 1.471 . . . . 0.0 111.62 170.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.52 -6.15 57.77 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.078 1.351 . . . . 0.0 113.766 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -80.5 -48.11 13.28 Favored 'General case' 0 CA--C 1.519 -0.242 0 C-N-CA 125.262 1.425 . . . . 0.0 109.219 -178.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.0 mt -48.38 -59.36 3.52 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.913 2.485 . . . . 0.0 110.873 172.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -85.95 26.67 0.97 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.636 1.575 . . . . 0.0 111.827 174.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.07 -87.28 0.7 Allowed Glycine 0 C--N 1.337 0.601 0 C-N-CA 125.469 1.509 . . . . 0.0 111.274 -173.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.467 HG12 ' HA ' ' A' ' 76' ' ' ALA . 26.9 m 36.6 22.5 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 N-CA-C 118.826 2.899 . . . . 0.0 118.826 -179.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 98.5 m -83.72 -67.08 0.82 Allowed 'General case' 0 N--CA 1.471 0.579 0 O-C-N 120.137 -1.602 . . . . 0.0 112.887 -177.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.4 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 45.4 p90 -156.57 162.15 28.11 Favored Pre-proline 0 CA--C 1.544 0.749 0 O-C-N 121.25 -0.906 . . . . 0.0 113.015 -172.283 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -56.79 109.98 0.52 Allowed 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.607 2.871 . . . . 0.0 111.304 175.357 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 90.99 7.75 65.62 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-O 117.464 -1.742 . . . . 0.0 115.532 -175.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.4 ' HG2' ' H ' ' A' ' 36' ' ' TYR . 0.0 OUTLIER -59.66 -37.22 78.15 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 120.582 2.191 . . . . 0.0 110.564 168.799 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 20.3 mt -50.76 -26.21 5.34 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 126.054 1.741 . . . . 0.0 112.562 173.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.64 -36.95 77.4 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.895 -0.574 . . . . 0.0 112.253 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -42.58 62.33 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.233 0.469 . . . . 0.0 111.527 175.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.4 m-70 -60.13 -32.58 71.15 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 176.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 16.8 mt -105.6 -21.28 13.23 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -172.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.79 2.51 64.98 Favored Glycine 0 CA--C 1.536 1.374 0 CA-C-N 119.323 0.965 . . . . 0.0 114.331 -171.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -98.13 142.28 30.02 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.282 1.433 . . . . 0.0 109.759 175.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.8 p -61.4 150.94 33.79 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.136 -0.977 . . . . 0.0 111.853 -173.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -59.43 -19.83 50.39 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 175.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -78.17 -46.25 21.04 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 118.937 0.79 . . . . 0.0 110.981 171.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -65.73 -45.08 83.99 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.363 1.065 . . . . 0.0 112.552 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 80.9 t -61.22 -39.17 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 CA-C-N 118.53 0.604 . . . . 0.0 111.504 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 69.6 m -66.26 -26.46 67.36 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -178.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -51.32 -37.27 46.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.902 1.281 . . . . 0.0 111.727 170.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -90.34 -12.38 37.86 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 176.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 95.0 mt -81.23 -27.71 35.14 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 117.922 -1.037 . . . . 0.0 111.675 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.42 -37.47 83.62 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 121.0 1.727 . . . . 0.0 113.467 -177.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 51.5 t -86.48 -15.33 40.47 Favored 'General case' 0 CA--C 1.558 1.265 0 O-C-N 120.827 -1.171 . . . . 0.0 111.718 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.535 HD13 ' CD ' ' A' ' 23' ' ' ARG . 7.4 tp -68.11 -41.79 81.23 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 119.579 -1.95 . . . . 0.0 108.895 167.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 45.5 mtm180 -78.44 -13.51 59.81 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 126.066 1.746 . . . . 0.0 112.292 176.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -96.07 -57.38 1.15 Allowed Glycine 0 N--CA 1.47 0.901 0 C-N-CA 125.97 1.748 . . . . 0.0 111.659 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.7 m -74.48 23.63 0.09 Allowed 'General case' 0 CA--C 1.566 1.58 0 C-N-CA 125.098 1.359 . . . . 0.0 112.854 173.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 59.2 28.73 64.61 Favored Glycine 0 N--CA 1.476 1.313 0 C-N-CA 127.152 2.31 . . . . 0.0 117.482 167.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.411 HD21 ' CD2' ' A' ' 14' ' ' LEU . 70.6 mt -82.21 -30.14 31.02 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.187 0.995 . . . . 0.0 113.324 177.225 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.0 m -133.33 144.93 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.951 1.7 . . . . 0.0 111.092 -178.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 72.0 t -129.09 139.95 50.51 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 126.295 1.838 . . . . 0.0 109.179 -175.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.94 142.92 52.83 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.577 1.151 . . . . 0.0 112.267 172.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 16.8 m -155.58 155.38 33.24 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.438 1.095 . . . . 0.0 108.233 176.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.23 125.71 31.25 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 119.379 0.99 . . . . 0.0 109.144 167.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.42 -16.32 63.87 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.525 1.057 . . . . 0.0 113.525 175.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 154.71 -32.89 0.68 Allowed Glycine 0 CA--C 1.531 1.087 0 C-N-CA 126.804 2.145 . . . . 0.0 112.153 -179.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.48 -21.45 0.2 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.346 1.458 . . . . 0.0 113.376 172.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -104.59 169.26 8.56 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.393 2.277 . . . . 0.0 110.028 174.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 10.0 p -92.58 145.52 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.621 0.768 . . . . 0.0 110.948 173.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -131.27 164.4 25.67 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 126.139 1.775 . . . . 0.0 110.855 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -115.93 120.02 37.83 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.265 1.026 . . . . 0.0 108.547 167.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.467 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -121.76 155.37 35.42 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 118.59 0.632 . . . . 0.0 112.191 175.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.2 tp -52.82 140.71 23.42 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.855 1.262 . . . . 0.0 109.626 173.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.57 -31.55 72.66 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -171.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -164.79 179.56 6.46 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 -178.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 20.1 m -55.89 -33.03 64.24 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.088 1.755 . . . . 0.0 114.208 171.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -68.74 -45.02 72.56 Favored 'General case' 0 C--N 1.344 0.333 0 CA-C-N 119.926 1.239 . . . . 0.0 112.467 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.9 mt -69.94 -40.65 75.37 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 120.13 1.332 . . . . 0.0 109.881 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.9 -35.15 75.92 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.455 0.702 . . . . 0.0 109.877 -178.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -71.95 -50.2 31.02 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 126.377 1.871 . . . . 0.0 112.649 172.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.94 -46.63 77.48 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 121.115 1.779 . . . . 0.0 111.593 -177.266 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.4 -51.27 70.22 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.715 0.806 . . . . 0.0 109.647 171.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -79.99 21.69 4.71 Favored Glycine 0 CA--C 1.537 1.462 0 C-N-CA 126.465 1.983 . . . . 0.0 114.699 -179.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 23.5 tp10 -101.8 -65.49 0.98 Allowed 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 126.427 1.891 . . . . 0.0 108.782 167.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 7.7 tp 165.85 -29.34 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.95 1.7 . . . . 0.0 112.021 -167.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.293 22.9 t 58.39 11.59 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 127.514 2.326 . . . . 0.0 111.837 -166.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.467 ' C ' ' H ' ' A' ' 93' ' ' VAL . 1.8 tp-100 88.01 -19.32 0.23 Allowed 'General case' 0 C--O 1.218 -0.575 0 O-C-N 120.315 -1.49 . . . . 0.0 109.452 135.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.9 p -75.01 37.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 127.338 2.255 . . . . 0.0 110.268 163.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.467 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.6 t 71.19 -8.9 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 C-N-CA 127.776 2.43 . . . . 0.0 114.106 174.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 99.02 102.75 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 131.112 3.765 . . . . 0.0 107.865 -169.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.13 137.6 58.23 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.251 1.821 . . . . 0.0 115.179 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 25.4 m -74.97 162.39 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 126.53 1.932 . . . . 0.0 113.906 171.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.03 -41.13 97.53 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 128.738 2.815 . . . . 0.0 115.235 178.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 23.6 p -71.26 76.77 0.72 Allowed 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 119.767 1.167 . . . . 0.0 111.007 170.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . 0.267 1.8 p-10 -71.43 80.3 0.77 Allowed 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 123.799 1.762 . . . . 0.0 109.473 169.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 50.0 mm-40 -61.2 138.42 94.45 Favored Pre-proline 0 CA--C 1.545 0.762 0 CA-C-N 114.205 -1.362 . . . . 0.0 109.894 176.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.76 160.49 49.52 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 123.97 3.114 . . . . 0.0 116.077 -166.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 8.1 t -44.6 116.4 1.05 Allowed 'General case' 0 C--N 1.347 0.476 0 C-N-CA 125.721 1.608 . . . . 0.0 111.303 -169.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 3.4 p -76.55 -8.95 12.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 -166.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -78.27 128.62 33.98 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.603 -0.686 . . . . 0.0 110.075 -175.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 24.9 mp0 48.87 24.06 0.78 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 125.763 1.625 . . . . 0.0 114.112 -173.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 . . . . . 0 C--O 1.237 0.439 0 N-CA-C 117.162 2.282 . . . . 0.0 117.162 -164.807 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.707 0 CA-C-O 121.476 0.655 . . . . 0.0 111.813 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 tt -55.66 -41.84 74.21 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.552 1.541 . . . . 0.0 111.235 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.28 -11.36 30.97 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 178.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 13.0 mmp_? -98.2 -56.2 2.55 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.227 1.011 . . . . 0.0 109.663 167.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -60.49 -51.58 68.84 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.369 1.468 . . . . 0.0 111.618 -173.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.97 -34.1 89.0 Favored Glycine 0 CA--C 1.529 0.952 0 C-N-CA 124.094 0.854 . . . . 0.0 112.976 175.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 78.5 ttt-85 -70.19 -36.58 74.73 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.208 1.004 . . . . 0.0 111.109 175.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.3 -24.65 60.43 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.971 0.908 . . . . 0.0 112.745 175.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 11.7 mt -77.89 -29.87 50.48 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.414 1.086 . . . . 0.0 111.387 168.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -99.93 50.37 0.91 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.465 1.506 . . . . 0.0 114.436 -171.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -114.87 149.72 42.9 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 127.21 2.204 . . . . 0.0 108.593 174.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -61.48 -52.84 2.78 Favored 'Trans proline' 0 CA--C 1.534 0.485 0 C-N-CA 124.317 3.345 . . . . 0.0 111.888 -171.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.437 ' HB ' ' CD2' ' B' ' 54' ' ' HIS . 15.9 m -76.6 -41.63 45.43 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 117.866 -1.064 . . . . 0.0 110.759 177.124 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 22.3 mtm180 -59.51 -36.9 76.98 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 120.177 1.353 . . . . 0.0 112.963 -176.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 53.8 t -48.79 -55.92 10.17 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.547 0.739 . . . . 0.0 110.37 169.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . 0.493 ' HB3' HD22 ' B' ' 44' ' ' LEU . 7.9 mpt_? -57.93 -51.86 67.9 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 118.502 -0.761 . . . . 0.0 113.027 172.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 3.8 mt -44.7 -55.69 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 CA-C-N 119.387 0.994 . . . . 0.0 109.6 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 29.2 mt -64.26 -38.11 89.87 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 116.701 -1.618 . . . . 0.0 114.374 -169.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -65.92 -35.44 75.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 CA-C-N 120.88 1.673 . . . . 0.0 111.296 172.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.58 -13.44 56.54 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.793 1.237 . . . . 0.0 113.821 179.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.45 -47.08 28.84 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.045 0.938 . . . . 0.0 109.748 -175.279 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 mt -48.46 -48.35 37.66 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 128.735 2.814 . . . . 0.0 112.382 172.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -94.79 18.81 11.06 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.052 1.741 . . . . 0.0 111.968 175.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -117.73 -85.46 1.08 Allowed Glycine 0 C--O 1.222 -0.609 0 C-N-CA 125.343 1.449 . . . . 0.0 111.16 -172.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . 0.461 HG12 ' HA ' ' B' ' 76' ' ' ALA . 11.5 m 32.15 27.57 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 N-CA-C 118.761 2.874 . . . . 0.0 118.761 -174.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 73.1 m -81.82 -75.99 0.27 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 120.941 1.7 . . . . 0.0 111.497 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -155.72 166.52 16.13 Favored Pre-proline 0 CA--C 1.55 0.968 0 O-C-N 120.55 -1.344 . . . . 0.0 113.052 -170.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.18 89.73 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 0.987 0 C-N-CA 124.756 3.637 . . . . 0.0 113.017 177.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 123.83 -4.97 9.14 Favored Glycine 0 C--O 1.221 -0.67 0 CA-C-O 117.309 -1.828 . . . . 0.0 115.624 -176.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . 0.486 HE22 ' CD2' ' B' ' 43' ' ' HIS . 0.0 OUTLIER -57.75 -34.99 70.12 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 120.425 2.113 . . . . 0.0 112.426 175.563 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 23.2 mt -53.85 -22.68 10.32 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 124.669 1.188 . . . . 0.0 112.445 177.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.33 88.84 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 118.926 -0.559 . . . . 0.0 111.938 -177.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.3 -34.86 65.96 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 122.999 0.52 . . . . 0.0 112.02 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . 0.486 ' CD2' HE22 ' B' ' 39' ' ' GLN . 5.4 m-70 -65.54 -27.61 68.57 Favored 'General case' 0 CA--C 1.553 1.067 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 174.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.493 HD22 ' HB3' ' B' ' 25' ' ' ARG . 15.1 mt -114.7 -20.39 10.68 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.684 1.364 . . . . 0.0 114.684 -170.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.94 -2.1 61.19 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 125.204 1.383 . . . . 0.0 114.417 -171.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -93.96 143.72 26.1 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.693 1.197 . . . . 0.0 110.113 176.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.4 p -61.52 149.99 37.21 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 121.14 -0.975 . . . . 0.0 111.175 -177.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -60.8 -19.25 59.17 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 174.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 6.5 t -77.24 -37.66 52.74 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 118.752 0.705 . . . . 0.0 112.185 170.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -74.68 -47.91 29.03 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.751 0.821 . . . . 0.0 111.424 175.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 63.2 t -58.92 -38.1 71.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-N 119.643 1.11 . . . . 0.0 111.803 178.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 55.5 m -66.6 -21.52 66.13 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -56.38 -51.19 69.24 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 122.947 1.356 . . . . 0.0 109.835 174.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . 0.437 ' CD2' ' HB ' ' B' ' 22' ' ' THR . 55.4 m-70 -73.84 -8.92 57.89 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 172.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 95.6 mt -83.25 -22.69 33.0 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 117.358 -1.306 . . . . 0.0 112.285 173.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.34 -37.81 81.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 121.201 1.819 . . . . 0.0 112.627 178.243 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 48.5 t -91.06 -13.74 32.61 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 118.129 0.422 . . . . 0.0 111.32 176.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 4.9 tp -70.34 -42.99 71.14 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 119.461 -2.024 . . . . 0.0 109.286 167.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 37.1 mtm105 -83.07 -5.98 59.31 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.966 1.706 . . . . 0.0 112.519 174.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.22 -65.11 1.12 Allowed Glycine 0 C--N 1.336 0.536 0 N-CA-C 109.409 -1.477 . . . . 0.0 109.409 174.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 60.6 m -72.22 26.43 0.05 Allowed 'General case' 0 CA--C 1.564 1.482 0 C-N-CA 126.517 1.927 . . . . 0.0 113.287 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.95 20.76 58.07 Favored Glycine 0 N--CA 1.474 1.18 0 C-N-CA 127.515 2.483 . . . . 0.0 117.409 167.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 60.4 mt -77.65 -35.9 52.06 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.885 0.874 . . . . 0.0 113.205 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 1.7 m -126.64 142.07 44.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 126.273 1.829 . . . . 0.0 111.225 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 54.6 t -123.76 138.31 53.94 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 C-N-CA 127.068 2.147 . . . . 0.0 108.85 -178.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.06 139.99 38.0 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 123.976 0.91 . . . . 0.0 111.317 176.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 41.1 m -152.48 159.58 43.33 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.584 1.554 . . . . 0.0 107.128 -174.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -87.86 135.69 33.28 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.497 1.499 . . . . 0.0 112.246 169.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -78.13 45.2 0.53 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.269 1.428 . . . . 0.0 109.808 167.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 76.51 -46.5 2.27 Favored Glycine 0 CA--C 1.534 1.262 0 O-C-N 120.204 -1.56 . . . . 0.0 113.011 -169.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -126.37 -46.43 1.62 Allowed 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 118.725 1.263 . . . . 0.0 114.073 -173.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -97.9 175.49 6.12 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 119.896 1.225 . . . . 0.0 110.504 173.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 14.9 p -93.34 141.29 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.255 1.022 . . . . 0.0 111.26 174.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 29.4 ptt180 -125.38 163.11 23.31 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 127.477 2.311 . . . . 0.0 110.853 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -113.19 118.82 35.76 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.993 0.917 . . . . 0.0 108.728 168.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.461 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -119.09 152.26 36.8 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.077 0.951 . . . . 0.0 111.355 178.243 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 tp -52.77 141.69 20.69 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.95 0.9 . . . . 0.0 109.989 171.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.54 -32.28 72.1 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -172.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -164.94 176.1 8.95 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 116.138 1.903 . . . . 0.0 116.138 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 22.5 m -52.23 -31.66 33.22 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.104 1.762 . . . . 0.0 114.501 171.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 7.9 m-70 -72.19 -44.37 63.1 Favored 'General case' 0 C--N 1.345 0.37 0 CA-C-O 117.286 -1.34 . . . . 0.0 112.822 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 9.5 mt -69.13 -40.28 78.38 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 120.665 1.575 . . . . 0.0 109.701 174.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.23 -38.7 84.19 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.612 0.765 . . . . 0.0 109.874 -179.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 4.8 tpm_? -71.36 -50.13 35.3 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.571 1.549 . . . . 0.0 112.776 171.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.61 -44.36 86.76 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 121.589 1.995 . . . . 0.0 111.657 -173.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.67 -53.26 58.48 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.616 1.167 . . . . 0.0 109.45 170.545 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -75.46 -7.86 83.25 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.175 1.369 . . . . 0.0 115.63 -172.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 28.1 tp10 -69.07 -63.51 1.05 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 126.387 1.875 . . . . 0.0 109.016 169.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 10.7 tp 163.22 -26.59 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.838 2.055 . . . . 0.0 113.232 -170.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . 0.305 42.1 t 58.17 11.97 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 126.827 2.051 . . . . 0.0 111.935 -164.065 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . 0.432 ' C ' ' H ' ' B' ' 93' ' ' VAL . 3.0 tp-100 86.34 -23.06 0.15 Allowed 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 125.136 1.374 . . . . 0.0 110.818 135.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.6 p -69.01 33.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 C-N-CA 129.068 2.947 . . . . 0.0 112.444 168.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . 0.432 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.3 OUTLIER 67.88 11.56 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 126.966 2.106 . . . . 0.0 113.402 176.0 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 tt 91.97 101.23 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 130.228 3.411 . . . . 0.0 109.709 -176.039 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.28 127.27 31.28 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -178.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 26.8 m -69.08 159.39 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 125.915 1.686 . . . . 0.0 114.726 171.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.44 -37.56 80.37 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 128.435 2.694 . . . . 0.0 115.413 -178.471 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 61.2 p -78.02 91.64 4.27 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 119.714 1.143 . . . . 0.0 110.759 172.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -73.35 86.04 1.48 Allowed 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 122.945 1.355 . . . . 0.0 108.868 167.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 72.0 mm-40 -64.23 140.98 98.05 Favored Pre-proline 0 CA--C 1.55 0.95 0 O-C-N 120.887 -1.133 . . . . 0.0 109.091 174.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -69.73 152.95 69.57 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 123.748 2.965 . . . . 0.0 117.345 -165.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 35.5 t -46.27 108.75 0.15 Allowed 'General case' 0 C--N 1.345 0.409 0 C-N-CA 126.557 1.943 . . . . 0.0 111.592 -171.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 5.6 p -73.13 -6.29 7.88 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 116.308 1.966 . . . . 0.0 116.308 -167.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.87 119.04 17.54 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.587 -0.696 . . . . 0.0 110.832 -175.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 46.5 mp0 50.4 25.79 2.04 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.413 1.885 . . . . 0.0 113.763 -175.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 . . . . . 0 CA--C 1.535 0.379 0 N-CA-C 116.318 1.97 . . . . 0.0 116.318 -164.544 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.305 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.17 -32.92 74.86 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.072 0.851 . . . . 0.0 111.482 -171.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.82 -44.15 90.8 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.652 1.115 . . . . 0.0 112.569 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -64.58 -61.21 2.35 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.704 -0.622 . . . . 0.0 111.312 172.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -52.67 63.99 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.757 1.623 . . . . 0.0 110.272 -171.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -69.63 -32.49 71.01 Favored Glycine 0 CA--C 1.529 0.942 0 CA-C-O 118.672 -1.071 . . . . 0.0 113.411 -170.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -33.87 66.18 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.412 1.606 . . . . 0.0 111.19 175.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.13 -31.25 71.57 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 118.648 0.658 . . . . 0.0 111.754 176.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.7 mp -84.48 -30.31 25.31 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 118.567 -0.73 . . . . 0.0 111.496 174.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.12 60.65 1.05 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.374 1.47 . . . . 0.0 113.961 171.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -153.26 155.14 31.59 Favored Pre-proline 0 CA--C 1.547 0.838 0 C-N-CA 124.663 1.185 . . . . 0.0 109.042 174.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -59.76 -95.24 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.76 1 C-N-CA 126.156 4.571 . . . . 0.0 113.733 -166.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.6 p -44.92 -30.09 0.94 Allowed 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 127.386 2.274 . . . . 0.0 113.436 169.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.3 ttm105 -73.74 -43.16 59.89 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.076 0.853 . . . . 0.0 112.407 -175.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 8.2 t -54.21 -51.96 62.77 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.547 0.739 . . . . 0.0 109.346 166.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -52.17 -50.78 61.15 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.35 1.06 . . . . 0.0 113.2 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.7 mm -50.76 -48.12 28.19 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 124.049 0.94 . . . . 0.0 111.736 174.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 77.4 mt -65.22 -48.23 74.06 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 118.726 0.694 . . . . 0.0 112.278 -176.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.1 p -69.42 -27.42 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 123.483 0.713 . . . . 0.0 112.301 179.018 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.21 -38.46 66.08 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.75 0.82 . . . . 0.0 111.697 169.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.527 ' O ' HG13 ' A' ' 34' ' ' VAL . 3.3 tp -64.61 -28.75 69.84 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 120.308 1.413 . . . . 0.0 114.569 -175.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 mt -42.32 -30.02 0.29 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.88 1.672 . . . . 0.0 112.614 169.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -110.74 -32.43 6.86 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 126.987 2.115 . . . . 0.0 111.446 167.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.22 8.06 34.01 Favored Glycine 0 C--N 1.336 0.548 0 C-N-CA 128.711 3.053 . . . . 0.0 116.034 -166.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.574 HG12 ' HA ' ' A' ' 76' ' ' ALA . 23.5 m -58.87 26.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.029 0 C-N-CA 127.215 2.206 . . . . 0.0 116.583 168.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 73.6 m -82.44 -81.86 0.15 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.425 1.09 . . . . 0.0 111.464 172.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -135.23 156.54 78.01 Favored Pre-proline 0 N--CA 1.47 0.568 0 CA-C-O 118.11 -0.948 . . . . 0.0 111.461 -172.112 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -56.92 -36.31 99.01 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.035 2.49 . . . . 0.0 113.448 -174.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -85.3 1.52 88.52 Favored Glycine 0 CA--C 1.533 1.217 0 CA-C-O 118.554 -1.137 . . . . 0.0 115.327 177.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.29 -30.4 66.22 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.807 1.804 . . . . 0.0 113.28 -170.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.4 mt -60.3 -16.9 38.66 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.091 0.557 . . . . 0.0 111.81 -179.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.32 -36.87 76.42 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.812 0.845 . . . . 0.0 111.702 175.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -51.73 16.57 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.01 0.924 . . . . 0.0 111.313 175.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -55.94 -33.35 64.66 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 21.7 mt -105.37 -15.68 14.96 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -174.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.75 11.19 68.86 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-N 119.657 1.117 . . . . 0.0 114.035 -170.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.9 mp -95.11 155.63 16.65 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 117.996 0.898 . . . . 0.0 112.492 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.7 p -64.84 151.81 44.51 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.245 0.618 . . . . 0.0 110.308 170.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -40.84 81.58 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 121.941 -0.475 . . . . 0.0 111.148 176.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.1 m -63.38 -38.5 91.41 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.353 0.661 . . . . 0.0 112.219 176.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 44.4 t-20 -70.99 -49.26 47.23 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.807 -0.558 . . . . 0.0 111.199 176.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 1.3 t -55.98 -35.88 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 O-C-N 120.338 -1.476 . . . . 0.0 112.765 172.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 72.0 m -66.69 -32.78 74.31 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -57.64 -38.63 75.35 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.759 0.708 . . . . 0.0 111.616 171.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 23.3 m80 -69.72 -39.5 76.8 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.396 -0.815 . . . . 0.0 112.577 175.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.8 mt -75.28 -12.92 60.38 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.771 0.828 . . . . 0.0 113.137 177.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.6 t -60.4 -55.36 34.52 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 119.404 1.002 . . . . 0.0 110.675 168.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.8 t -67.69 -39.67 84.43 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.326 -0.859 . . . . 0.0 111.739 177.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.4 tp -62.02 -37.69 85.86 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -175.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.422 ' HG2' HG23 ' A' ' 64' ' ' VAL . 45.0 mtm105 -82.46 -7.3 59.64 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.865 0.866 . . . . 0.0 111.9 177.091 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -102.13 -45.24 1.76 Allowed Glycine 0 CA--C 1.535 1.283 0 C-N-CA 126.036 1.779 . . . . 0.0 114.685 178.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 7.2 m -67.36 4.41 1.0 Allowed 'General case' 0 CA--C 1.563 1.447 0 C-N-CA 126.008 1.723 . . . . 0.0 112.229 168.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.97 21.21 78.24 Favored Glycine 0 C--N 1.343 0.955 0 C-N-CA 126.018 1.771 . . . . 0.0 114.36 170.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.1 mt -85.13 -22.92 28.65 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.121 1.368 . . . . 0.0 113.61 -174.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.422 HG23 ' HG2' ' A' ' 59' ' ' ARG . 2.4 m -137.28 147.4 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 C-N-CA 125.795 1.638 . . . . 0.0 111.286 -178.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 88.5 t -130.37 144.63 37.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 125.82 1.648 . . . . 0.0 109.849 -179.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.59 134.36 34.81 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.91 0.884 . . . . 0.0 111.769 172.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.9 166.6 24.34 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.483 0.713 . . . . 0.0 109.596 171.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -80.39 127.48 32.45 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 165.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.265 0.0 OUTLIER -78.73 -16.22 57.5 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 120.038 1.29 . . . . 0.0 114.313 171.706 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 130.65 -21.74 4.71 Favored Glycine 0 N--CA 1.477 1.4 0 C-N-CA 125.602 1.572 . . . . 0.0 113.987 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.1 -19.78 1.49 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 128.558 2.743 . . . . 0.0 112.62 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 -148.28 173.14 13.32 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 129.564 3.146 . . . . 0.0 111.071 -177.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 14.1 p -88.97 145.13 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 167.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 -126.98 165.83 18.68 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 125.978 1.711 . . . . 0.0 111.224 -179.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 17.2 m-30 -112.49 120.75 42.71 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 164.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.574 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -121.44 154.36 36.66 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.932 1.293 . . . . 0.0 109.819 -178.299 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 81.6 mt -57.58 151.01 17.85 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.994 0.815 . . . . 0.0 110.226 169.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.51 -37.21 75.12 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 -168.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -162.18 167.8 23.52 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 126.288 1.835 . . . . 0.0 109.064 175.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 51.1 m -44.76 -32.16 1.44 Allowed 'General case' 0 C--O 1.214 -0.775 0 CA-C-O 117.604 -1.189 . . . . 0.0 110.998 167.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -37.58 -65.03 0.34 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.702 1.601 . . . . 0.0 114.026 169.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 15.3 mt -73.46 -41.0 63.72 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.749 1.613 . . . . 0.0 110.826 -176.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.67 -26.55 65.64 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 177.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -79.22 -59.79 2.63 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 126.793 2.037 . . . . 0.0 109.469 178.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.88 -37.72 85.6 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.83 -42.9 85.04 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 121.74 -0.6 . . . . 0.0 109.483 169.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.51 -34.17 73.3 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 126.296 1.903 . . . . 0.0 117.043 -174.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.77 -11.97 59.91 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 121.533 2.666 . . . . 0.0 112.261 167.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 41.2 tp 64.08 113.33 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 127.85 2.46 . . . . 0.0 109.225 -174.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 19.3 m -66.61 26.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 126.281 1.832 . . . . 0.0 114.907 -175.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.438 ' C ' ' H ' ' A' ' 93' ' ' VAL . 39.2 mm-40 79.98 -2.96 2.01 Favored 'General case' 0 N--CA 1.442 -0.856 0 O-C-N 119.911 -1.743 . . . . 0.0 111.271 157.371 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 13.5 p -60.63 31.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 131.153 3.781 . . . . 0.0 113.871 166.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.438 ' H ' ' C ' ' A' ' 91' ' ' GLN . 1.3 t 56.87 18.96 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 127.987 2.515 . . . . 0.0 113.99 169.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.0 tt 99.59 105.74 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 129.891 3.276 . . . . 0.0 107.099 -169.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.29 61.5 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.992 2.117 . . . . 0.0 116.078 -176.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 21.5 t -64.35 152.51 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 125.165 1.386 . . . . 0.0 108.427 167.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.93 -72.45 0.38 Allowed 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.796 1.638 . . . . 0.0 113.186 178.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.1 p 70.91 144.36 0.06 Allowed 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 129.596 3.158 . . . . 0.0 115.13 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -90.93 131.94 36.25 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 163.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -168.32 138.43 2.06 Favored Pre-proline 0 CA--C 1.541 0.597 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.46 -179.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -69.55 166.27 27.89 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 122.676 2.251 . . . . 0.0 111.626 174.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 5.7 t -104.44 -157.1 0.59 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 126.582 1.953 . . . . 0.0 111.151 -176.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 4.0 t 41.79 53.47 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 C-N-CA 126.136 1.774 . . . . 0.0 114.128 168.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . 76.13 -13.43 0.9 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 126.502 1.921 . . . . 0.0 115.511 177.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 74.8 mt-10 -69.12 162.64 26.55 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 122.829 1.3 . . . . 0.0 112.117 174.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 . . . . . 0 N--CA 1.464 0.272 0 C-N-CA 125.998 1.719 . . . . 0.0 110.214 176.577 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.468 0 N-CA-C 110.753 -0.091 . . . . 0.0 110.753 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.02 -26.92 67.02 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.629 1.172 . . . . 0.0 112.645 -172.375 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.75 -56.18 17.51 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.999 1.272 . . . . 0.0 111.752 171.051 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -59.03 -58.95 6.41 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.802 0.841 . . . . 0.0 111.828 175.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.72 -52.52 56.66 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 125.869 1.668 . . . . 0.0 109.945 -172.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.59 -39.25 96.62 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-O 118.358 -1.246 . . . . 0.0 112.247 -175.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -37.59 79.77 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.123 1.461 . . . . 0.0 110.923 174.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.86 -16.43 60.68 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 178.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 10.3 mp -90.62 -32.73 16.13 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 118.962 0.801 . . . . 0.0 110.031 168.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -74.85 56.0 0.71 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.392 1.877 . . . . 0.0 113.633 169.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -146.63 135.15 10.94 Favored Pre-proline 0 CA--C 1.544 0.714 0 C-N-CA 125.419 1.488 . . . . 0.0 107.167 178.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -46.89 -70.01 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.803 1 C-N-CA 125.628 4.218 . . . . 0.0 113.525 -166.219 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 12.1 p -70.18 -16.49 63.08 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 117.849 -1.072 . . . . 0.0 112.59 -178.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.535 ' HG3' HD13 ' B' ' 58' ' ' LEU . 0.0 OUTLIER -72.16 -46.3 56.96 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 116.551 -1.69 . . . . 0.0 112.252 -176.486 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 38.0 t -45.99 -52.34 11.93 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.454 1.025 . . . . 0.0 110.404 169.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -61.01 -50.37 73.64 Favored 'General case' 0 C--O 1.225 -0.221 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 179.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . 0.437 HG13 HH22 ' B' ' 23' ' ' ARG . 5.2 mm -51.37 -56.99 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 CA-C-N 119.841 1.2 . . . . 0.0 110.526 171.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 59.7 mt -62.17 -42.76 99.57 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 118.699 -0.667 . . . . 0.0 111.906 -169.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 6.3 p -73.23 -32.64 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 123.614 0.765 . . . . 0.0 112.69 177.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . 0.434 ' HB1' ' CD2' ' B' ' 43' ' ' HIS . . . -75.33 -31.6 60.65 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.409 0.55 . . . . 0.0 111.891 176.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.403 ' O ' HG13 ' B' ' 34' ' ' VAL . 7.8 tp -62.0 -40.83 96.99 Favored 'General case' 0 C--N 1.341 0.235 0 O-C-N 121.093 -1.004 . . . . 0.0 112.536 -178.344 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.76 -31.0 1.81 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 130.023 3.329 . . . . 0.0 114.383 172.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -100.99 -14.06 18.01 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 127.032 2.133 . . . . 0.0 112.626 -178.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -114.68 -71.91 0.53 Allowed Glycine 0 C--N 1.344 1.006 0 C-N-CA 124.87 1.224 . . . . 0.0 115.642 -169.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . 0.51 HG12 ' HA ' ' B' ' 76' ' ' ALA . 35.0 m 32.6 34.48 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 N-CA-C 117.314 2.339 . . . . 0.0 117.314 -169.004 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 68.6 m -82.9 -84.08 0.13 Allowed 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 125.975 1.71 . . . . 0.0 112.326 176.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . 0.405 ' H ' ' HB3' ' B' ' 39' ' ' GLN . 0.1 OUTLIER -130.72 163.31 49.53 Favored Pre-proline 0 CA--C 1.543 0.701 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -172.459 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -57.81 -42.2 61.65 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.336 2.024 . . . . 0.0 111.943 178.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -72.11 -1.83 50.69 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 117.955 -1.47 . . . . 0.0 114.645 174.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . 0.405 ' HB3' ' H ' ' B' ' 36' ' ' TYR . 5.8 pt20 -64.17 -51.5 63.52 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.533 1.666 . . . . 0.0 111.322 -177.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 5.3 mt -66.48 -28.57 68.68 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 118.77 0.714 . . . . 0.0 109.248 -174.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -75.06 23.96 0.1 Allowed 'General case' 0 CA--C 1.552 1.056 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 172.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -143.43 -45.39 0.28 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.385 2.674 . . . . 0.0 108.111 168.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . 0.434 ' CD2' ' HB1' ' B' ' 29' ' ' ALA . 0.3 OUTLIER -53.13 -29.55 31.71 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 126.323 1.849 . . . . 0.0 113.819 170.756 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.7 mt -101.61 -18.59 15.82 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 126.045 1.738 . . . . 0.0 113.323 175.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.27 -2.47 52.0 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 124.285 0.945 . . . . 0.0 114.667 -170.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mp -92.84 144.84 24.88 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.052 1.426 . . . . 0.0 110.383 -178.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 21.2 p -58.86 156.35 11.52 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.065 0.946 . . . . 0.0 113.544 -169.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -37.39 79.14 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 121.465 -0.772 . . . . 0.0 111.314 178.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 26.6 m -63.3 -47.08 83.8 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.754 0.822 . . . . 0.0 111.933 170.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -62.78 -50.43 71.05 Favored 'General case' 0 CA--C 1.546 0.795 0 O-C-N 121.038 -1.039 . . . . 0.0 112.375 178.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 3.9 t -67.8 -19.57 25.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 O-C-N 121.007 -1.058 . . . . 0.0 111.739 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 61.2 m -72.2 -46.61 55.52 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.496 1.498 . . . . 0.0 113.674 171.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -49.74 -46.91 50.89 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 123.644 1.687 . . . . 0.0 111.208 173.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -59.46 -55.08 39.21 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 113.134 -1.848 . . . . 0.0 113.783 170.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 52.5 mt -67.59 -14.99 63.41 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 120.003 -1.686 . . . . 0.0 112.78 -178.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.2 t -50.69 -50.96 53.68 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 119.452 1.024 . . . . 0.0 111.065 168.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.95 -21.19 31.88 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.821 1.191 . . . . 0.0 112.875 -171.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.535 HD13 ' HG3' ' B' ' 23' ' ' ARG . 4.7 tp -73.02 -47.17 47.35 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 121.659 -0.651 . . . . 0.0 111.69 176.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 43.3 mtm180 -72.35 -26.4 61.9 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.786 0.834 . . . . 0.0 110.94 174.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.3 -46.32 12.83 Favored Glycine 0 CA--C 1.529 0.949 0 CA-C-O 119.292 -0.727 . . . . 0.0 113.745 176.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 54.1 m -75.8 -15.93 60.18 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 119.161 1.481 . . . . 0.0 113.772 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 107.65 9.36 28.91 Favored Glycine 0 C--N 1.344 0.992 0 C-N-CA 125.259 1.409 . . . . 0.0 115.622 169.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 3.1 mt -85.12 -17.26 37.82 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 120.006 1.903 . . . . 0.0 114.55 -169.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.4 m -129.73 143.09 42.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 126.455 1.902 . . . . 0.0 110.455 177.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 98.1 t -131.1 141.2 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.304 1.041 . . . . 0.0 110.024 -176.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.49 136.87 33.24 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.496 1.119 . . . . 0.0 112.144 173.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -142.15 166.22 25.31 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.113 0.965 . . . . 0.0 109.506 172.235 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -77.36 127.38 32.47 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 165.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.254 0.0 OUTLIER -75.15 -21.13 59.01 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 172.757 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 135.21 -19.44 3.86 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.781 1.658 . . . . 0.0 114.02 -177.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 5.1 tmt_? -142.63 -25.48 0.63 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 129.503 3.121 . . . . 0.0 111.608 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -138.66 179.39 6.51 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 127.557 2.343 . . . . 0.0 110.8 -177.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 14.8 p -91.1 145.16 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.943 0.897 . . . . 0.0 108.865 166.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 20.2 ptt180 -128.92 164.29 23.44 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 126.295 1.838 . . . . 0.0 110.093 176.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -108.0 149.21 28.68 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 106.005 -1.85 . . . . 0.0 106.005 162.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.51 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -146.56 158.3 43.88 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 125.227 1.411 . . . . 0.0 108.571 176.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 62.3 mt -59.28 152.91 19.83 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.385 0.993 . . . . 0.0 109.32 167.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.79 -34.99 76.88 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 -168.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -159.62 167.56 28.18 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 123.121 1.439 . . . . 0.0 110.292 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 14.7 m -50.28 -30.62 12.25 Favored 'General case' 0 C--O 1.22 -0.473 0 C-N-CA 125.601 1.56 . . . . 0.0 110.337 167.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -46.73 -65.52 0.55 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.118 1.367 . . . . 0.0 113.789 171.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 11.9 mt -67.68 -41.09 84.25 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 121.075 1.761 . . . . 0.0 111.036 -177.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.02 -24.09 65.9 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 177.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -80.03 -64.52 1.17 Allowed 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 124.982 1.313 . . . . 0.0 110.707 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.54 -34.9 77.84 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.112 1.152 . . . . 0.0 114.112 -178.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tt -65.32 -41.57 93.84 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 121.4 -0.813 . . . . 0.0 109.459 169.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.86 -40.14 95.37 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 126.709 2.099 . . . . 0.0 115.835 -175.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.06 -15.23 62.53 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 120.88 2.34 . . . . 0.0 112.9 169.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 43.2 tp 67.78 111.41 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 127.603 2.361 . . . . 0.0 109.834 -169.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 20.1 m -61.41 28.21 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 128.207 2.603 . . . . 0.0 115.232 174.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 81.87 -15.17 0.73 Allowed 'General case' 0 CA--C 1.535 0.394 0 O-C-N 119.768 -1.832 . . . . 0.0 113.077 156.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.3 p -56.14 31.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.098 1 C-N-CA 132.854 4.461 . . . . 0.0 115.649 168.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 2.0 t 56.71 26.27 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 128.15 2.58 . . . . 0.0 113.415 167.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 4.5 tt 80.42 106.47 0.07 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 127.51 2.324 . . . . 0.0 105.109 -167.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.79 75.84 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.156 1.783 . . . . 0.0 115.695 -169.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.3 146.05 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 126.273 1.829 . . . . 0.0 112.855 -179.139 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.32 -20.19 60.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 127.46 2.304 . . . . 0.0 113.919 179.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 22.5 p -49.29 124.65 9.48 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.884 1.674 . . . . 0.0 113.743 -169.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -67.44 152.98 44.74 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 106.444 -1.687 . . . . 0.0 106.444 165.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -167.9 143.27 3.14 Favored Pre-proline 0 N--CA 1.448 -0.558 0 CA-C-O 116.806 -1.569 . . . . 0.0 107.778 172.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -60.79 158.87 31.11 Favored 'Trans proline' 0 CA--C 1.536 0.599 0 C-N-CA 122.809 2.34 . . . . 0.0 112.521 177.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 15.4 t -85.28 -145.41 0.1 Allowed 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 122.537 1.16 . . . . 0.0 112.87 -176.235 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 25.2 t 12.22 68.92 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 C-N-CA 130.825 3.65 . . . . 0.0 114.199 174.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . 77.02 -9.09 1.58 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.834 2.054 . . . . 0.0 115.613 171.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -73.29 164.14 27.09 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.633 1.173 . . . . 0.0 112.263 174.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.6 mtp180 . . . . . 0 N--CA 1.469 0.477 0 C-N-CA 127.964 2.506 . . . . 0.0 109.764 172.906 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.555 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -52.68 -53.42 47.63 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.801 1.182 . . . . 0.0 113.019 -170.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.449 ' HA ' ' HB1' ' B' ' 19' ' ' ALA . . . -64.58 -14.9 59.9 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 175.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.593 HH22 ' CA ' ' B' ' 102' ' ' CYS . 34.3 ttt180 -93.03 -43.57 8.84 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.376 1.07 . . . . 0.0 111.991 172.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.684 ' CD1' HG21 ' B' ' 92' ' ' VAL . 3.4 tm? -62.89 -37.63 87.71 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.635 1.574 . . . . 0.0 112.417 -177.125 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.18 -23.23 52.14 Favored Glycine 0 CA--C 1.536 1.389 0 CA-C-N 120.034 1.288 . . . . 0.0 112.741 170.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.9 ttp85 -100.24 -0.43 38.62 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.903 1.446 . . . . 0.0 114.903 171.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -86.64 -35.66 19.24 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.918 1.235 . . . . 0.0 109.248 167.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.6 mp -70.65 -38.01 73.78 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 167.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -92.54 35.45 1.02 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 171.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.73 149.17 74.0 Favored Pre-proline 0 CA--C 1.542 0.664 0 N-CA-C 106.167 -1.79 . . . . 0.0 106.167 165.513 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -41.79 -89.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.351 0.659 1 C-N-CA 126.495 4.797 . . . . 0.0 113.793 -167.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.52 -31.14 72.04 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 124.997 1.319 . . . . 0.0 111.066 175.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 54.5 mtm-85 -58.69 -33.76 70.52 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 119.547 1.067 . . . . 0.0 113.746 -177.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 49.3 t -58.64 -54.29 48.73 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.295 0.952 . . . . 0.0 110.694 172.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -72.01 -34.26 68.72 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.356 -0.84 . . . . 0.0 112.295 -179.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.5 mm -52.14 -46.39 43.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 124.61 1.164 . . . . 0.0 109.222 167.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 41.7 mt -64.71 -46.06 83.92 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 117.298 -1.334 . . . . 0.0 111.969 178.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.4 m -64.29 -35.23 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 CA-C-N 121.391 1.905 . . . . 0.0 112.235 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.37 -1.74 46.63 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.978 1.311 . . . . 0.0 113.483 177.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.54 -52.72 7.28 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 124.87 1.268 . . . . 0.0 108.533 169.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -44.47 -60.31 2.02 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.823 2.849 . . . . 0.0 114.015 -171.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -101.16 18.09 20.77 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 126.324 1.849 . . . . 0.0 111.279 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.574 ' HA3' HE22 ' A' ' 39' ' ' GLN . . . -109.44 -80.01 1.15 Allowed Glycine 0 C--N 1.337 0.635 0 C-N-CA 127.718 2.58 . . . . 0.0 111.164 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.4 m 36.93 28.72 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 116.405 2.002 . . . . 0.0 116.405 -177.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 31.5 m -83.57 -72.12 0.47 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 120.506 1.503 . . . . 0.0 113.588 -173.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.43 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 0.0 OUTLIER -137.36 160.8 64.1 Favored Pre-proline 0 N--CA 1.471 0.621 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -178.234 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -60.94 113.22 1.63 Allowed 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.234 1.956 . . . . 0.0 108.76 171.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.35 -2.33 60.97 Favored Glycine 0 CA--C 1.538 1.508 0 CA-C-O 118.099 -1.389 . . . . 0.0 116.042 -173.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.574 HE22 ' HA3' ' A' ' 33' ' ' GLY . 2.5 pp0? -58.13 -20.1 37.76 Favored 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 120.579 2.189 . . . . 0.0 114.597 176.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.5 HD12 ' H ' ' A' ' 40' ' ' LEU . 1.8 mp -71.87 -9.16 57.93 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-O 118.758 -0.639 . . . . 0.0 112.327 176.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.96 -44.09 94.63 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.668 0.667 . . . . 0.0 111.688 177.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.7 -50.91 63.16 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 123.458 0.703 . . . . 0.0 110.684 172.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 -59.1 -27.62 65.74 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -177.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.9 mt -113.39 -22.39 10.41 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -173.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.44 -3.19 33.99 Favored Glycine 0 CA--C 1.535 1.301 0 CA-C-N 119.545 1.066 . . . . 0.0 114.337 -169.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -84.31 139.21 32.46 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.44 1.12 . . . . 0.0 109.803 175.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.403 HG23 ' H ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER -55.16 147.82 15.51 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 121.545 -0.722 . . . . 0.0 111.053 -179.373 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -48.78 -27.75 3.19 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.483 1.113 . . . . 0.0 113.057 169.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.2 m -69.03 -46.35 68.18 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.1 0.96 . . . . 0.0 111.62 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.403 ' H ' HG23 ' A' ' 47' ' ' THR . 29.1 t-20 -74.41 -39.35 62.69 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.119 0.872 . . . . 0.0 111.978 177.049 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.2 t -55.87 -48.43 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 118.621 -0.704 . . . . 0.0 110.57 169.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 39.2 m -64.88 -40.01 94.44 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 120.087 1.312 . . . . 0.0 113.073 175.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -56.08 -51.79 66.62 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.476 1.11 . . . . 0.0 111.675 176.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 -70.74 -28.51 64.76 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 120.595 -1.316 . . . . 0.0 113.506 177.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.9 mt -70.26 -30.07 67.01 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 117.933 -1.032 . . . . 0.0 112.751 172.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.1 p -49.52 -44.26 46.19 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.346 1.43 . . . . 0.0 113.259 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.5 t -70.51 -42.09 71.74 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.615 1.966 . . . . 0.0 112.873 173.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.1 tp -63.4 -29.54 70.82 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.927 1.691 . . . . 0.0 112.03 -177.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 56.1 mtm180 -83.67 -12.38 55.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.474 1.509 . . . . 0.0 113.651 172.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -97.17 -48.38 2.06 Favored Glycine 0 N--CA 1.474 1.21 0 C-N-CA 124.446 1.022 . . . . 0.0 111.13 179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 69.1 m -68.49 10.62 0.23 Allowed 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 127.836 2.454 . . . . 0.0 114.142 170.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 63.48 14.5 54.62 Favored Glycine 0 N--CA 1.474 1.171 0 C-N-CA 126.581 2.038 . . . . 0.0 116.583 174.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 86.1 mt -75.7 -28.72 58.73 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 120.619 -1.518 . . . . 0.0 113.427 -179.147 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -134.05 135.12 55.14 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 125.757 1.623 . . . . 0.0 112.834 176.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 87.0 t -124.89 138.88 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 125.817 1.647 . . . . 0.0 109.235 -175.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.19 152.22 36.68 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 122.624 1.202 . . . . 0.0 112.9 178.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.2 m -160.4 163.21 33.3 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.769 1.627 . . . . 0.0 108.103 -170.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -85.87 148.32 25.85 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 119.125 0.875 . . . . 0.0 111.248 167.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.93 -14.39 41.98 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 121.35 -0.844 . . . . 0.0 111.745 167.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 138.21 -14.92 3.49 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 126.976 2.227 . . . . 0.0 113.628 -176.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 65.3 ttt-85 -157.49 -43.91 0.07 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.038 2.135 . . . . 0.0 111.861 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -101.33 179.33 4.39 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.408 1.883 . . . . 0.0 110.459 169.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 25.9 m -105.6 160.11 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 123.793 0.837 . . . . 0.0 112.484 171.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.8 ptt85 -142.88 170.28 15.98 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 129.397 3.079 . . . . 0.0 109.788 -172.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -110.9 120.36 42.14 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.358 1.063 . . . . 0.0 108.703 167.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -108.71 146.15 33.95 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.491 1.516 . . . . 0.0 111.159 174.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 tp -56.83 135.28 55.65 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 118.238 -0.886 . . . . 0.0 108.837 170.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.47 -42.34 70.56 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -170.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -154.35 159.28 41.09 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.849 1.66 . . . . 0.0 112.796 176.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.56 -36.98 0.12 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 130.797 3.639 . . . . 0.0 113.468 165.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -56.37 -48.3 77.12 Favored 'General case' 0 C--N 1.342 0.252 0 C-N-CA 126.178 1.791 . . . . 0.0 113.336 174.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 11.0 mt -69.59 -41.63 75.52 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 175.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.57 -37.99 76.94 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.974 1.309 . . . . 0.0 111.027 -175.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 -68.04 -55.42 12.65 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-O 117.538 -1.22 . . . . 0.0 112.177 173.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.41 -40.2 95.75 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 121.895 2.134 . . . . 0.0 112.753 -177.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.0 tp -61.54 -43.99 97.86 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.65 1.98 . . . . 0.0 112.664 170.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -78.55 -32.56 41.57 Favored Glycine 0 N--CA 1.478 1.442 0 C-N-CA 126.882 2.182 . . . . 0.0 114.301 -176.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -66.99 -6.12 15.61 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.538 1.135 . . . . 0.0 110.084 166.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 32.1 tp 78.56 -34.65 0.17 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 130.661 3.584 . . . . 0.0 112.794 167.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 153.37 -21.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.021 1 C-N-CA 134.012 4.925 . . . . 0.0 111.423 173.19 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 46.2 mm-40 71.24 -23.99 0.18 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.866 2.066 . . . . 0.0 114.428 -178.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.8 p -71.51 42.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 126.59 1.956 . . . . 0.0 115.135 -172.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER 63.28 17.73 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 C-N-CA 126.996 2.119 . . . . 0.0 112.504 177.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 62.4 mt 84.6 107.51 0.05 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 129.976 3.31 . . . . 0.0 109.693 -171.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.75 76.1 0.85 Allowed 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.089 -1.007 . . . . 0.0 110.002 169.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.0 t -44.74 149.09 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 127.487 2.315 . . . . 0.0 114.652 -169.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.62 25.75 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 128.532 2.733 . . . . 0.0 114.937 171.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 44.0 p -104.53 170.61 7.79 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.655 -1.278 . . . . 0.0 112.723 175.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -99.94 2.95 44.1 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 128.83 2.852 . . . . 0.0 113.842 -176.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -53.43 141.7 42.36 Favored Pre-proline 0 CA--C 1.556 1.192 0 N-CA-C 116.151 1.908 . . . . 0.0 116.151 -167.113 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -72.97 -168.97 0.45 Allowed 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 125.236 3.957 . . . . 0.0 111.489 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 49.6 t -56.21 148.83 17.39 Favored 'General case' 0 CA--C 1.548 0.874 0 O-C-N 120.429 -1.42 . . . . 0.0 111.881 175.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 93.5 t -73.5 -18.48 17.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.877 -169.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -81.41 24.04 0.58 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.682 1.593 . . . . 0.0 114.222 173.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -128.68 161.96 28.46 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.245 1.818 . . . . 0.0 110.719 -171.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.785 0 C-N-CA 126.004 1.722 . . . . 0.0 112.858 177.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.548 0.887 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -35.84 -73.0 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 127.61 2.364 . . . . 0.0 114.139 -176.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.68 -5.7 39.4 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.933 1.457 . . . . 0.0 114.933 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -86.08 -46.64 10.28 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 118.658 -0.687 . . . . 0.0 110.464 168.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.96 -41.37 99.51 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.368 0.985 . . . . 0.0 112.104 -168.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.8 -6.3 11.63 Favored Glycine 0 CA--C 1.542 1.774 0 CA-C-O 119.004 -0.887 . . . . 0.0 114.432 173.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 49.6 ttp85 -115.4 -3.68 12.41 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 127.187 2.195 . . . . 0.0 113.851 172.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -92.65 -27.96 16.97 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.478 1.511 . . . . 0.0 110.906 167.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 3.8 mp -79.18 -44.58 21.61 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 168.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.449 ' HB1' ' HA ' ' A' ' 12' ' ' ALA . . . -87.69 32.57 0.72 Allowed 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 125.299 1.44 . . . . 0.0 114.619 171.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -64.17 151.94 89.25 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 126.924 2.09 . . . . 0.0 111.977 172.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -44.67 -36.27 10.17 Favored 'Trans proline' 0 C--N 1.357 0.987 1 C-N-CA 125.579 4.186 . . . . 0.0 114.718 177.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.45 ' HB ' HH21 ' B' ' 23' ' ' ARG . 5.6 m -130.18 -34.89 1.62 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.824 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.618 ' HG2' HD13 ' B' ' 58' ' ' LEU . 0.0 OUTLIER -60.28 -26.94 66.89 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 117.211 -1.376 . . . . 0.0 112.091 -179.742 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 42.3 t -55.13 -65.43 0.59 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 120.14 1.336 . . . . 0.0 112.193 168.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 17.4 ttm180 -68.65 -33.2 73.6 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.152 -0.968 . . . . 0.0 111.713 -177.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.1 mm -48.92 -55.03 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 O-C-N 121.049 -1.032 . . . . 0.0 109.053 168.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.416 HD22 HD11 ' B' ' 77' ' ' LEU . 56.6 mt -62.82 -36.44 83.17 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 116.798 -1.572 . . . . 0.0 112.613 -174.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 3.6 m -64.27 -38.48 82.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 CA-C-N 120.849 1.659 . . . . 0.0 111.045 175.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.35 -7.1 59.14 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.307 1.043 . . . . 0.0 113.547 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.15 -55.3 6.25 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 170.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -44.05 -61.29 1.51 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 128.433 2.693 . . . . 0.0 112.558 177.586 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -86.97 5.19 38.47 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.051 1.34 . . . . 0.0 112.086 -176.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -115.53 -73.16 0.53 Allowed Glycine 0 C--N 1.341 0.833 0 C-N-CA 126.465 1.983 . . . . 0.0 113.657 -173.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 25.4 m 37.65 29.52 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 116.183 1.92 . . . . 0.0 116.183 -174.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 25.7 m -82.91 -73.37 0.41 Allowed 'General case' 0 C--N 1.342 0.251 0 CA-C-N 120.358 1.435 . . . . 0.0 114.218 -173.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . 0.469 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 1.0 OUTLIER -148.36 164.68 20.79 Favored Pre-proline 0 N--CA 1.47 0.526 0 N-CA-C 114.012 1.115 . . . . 0.0 114.012 -175.486 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -55.1 119.65 6.87 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.136 1.891 . . . . 0.0 108.768 169.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.43 -4.05 83.97 Favored Glycine 0 CA--C 1.535 1.339 0 CA-C-O 117.249 -1.861 . . . . 0.0 115.897 -174.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . 0.469 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 2.4 pp0? -57.22 -27.17 61.78 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 121.203 2.501 . . . . 0.0 112.948 176.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 3.4 mt -67.96 -22.7 65.02 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 124.509 1.124 . . . . 0.0 111.593 178.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.16 -43.49 98.79 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 118.549 0.613 . . . . 0.0 111.156 -173.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.94 -50.86 64.76 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.664 0.786 . . . . 0.0 111.571 173.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -54.75 -35.77 64.09 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 178.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 17.3 mt -103.21 -21.64 13.84 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 -172.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.41 -1.69 33.96 Favored Glycine 0 CA--C 1.537 1.467 0 CA-C-N 119.177 0.899 . . . . 0.0 113.418 -168.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -90.08 121.85 32.52 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 125.386 1.474 . . . . 0.0 108.531 176.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.8 t -47.7 139.08 7.63 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.29 1.036 . . . . 0.0 112.548 -175.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.12 -28.35 4.19 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.816 1.647 . . . . 0.0 113.577 174.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 50.3 m -62.32 -58.28 8.26 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.002 0.921 . . . . 0.0 111.358 170.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -76.12 -34.91 59.47 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.427 1.012 . . . . 0.0 113.483 -178.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 1.5 t -50.2 -47.83 24.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.906 1.23 . . . . 0.0 109.648 169.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 5.2 m -83.22 -27.9 29.64 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -177.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -45.88 -34.8 4.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.27 1.428 . . . . 0.0 112.429 173.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -113.26 2.12 15.44 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 127.373 2.269 . . . . 0.0 114.311 -178.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 46.7 mt -72.58 -24.64 61.12 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 119.615 -1.928 . . . . 0.0 109.116 166.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 18.3 p -43.11 -42.74 4.15 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.092 1.357 . . . . 0.0 111.75 167.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 12.5 t -75.36 -43.03 52.6 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.618 HD13 ' HG2' ' B' ' 23' ' ' ARG . 6.5 tp -62.85 -34.57 77.62 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.488 1.515 . . . . 0.0 110.967 -176.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.449 ' HG2' HG23 ' B' ' 64' ' ' VAL . 60.5 mtm180 -82.46 -7.56 59.64 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.164 1.385 . . . . 0.0 113.867 173.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -97.89 -49.37 1.78 Allowed Glycine 0 N--CA 1.474 1.174 0 CA-C-N 119.391 0.996 . . . . 0.0 111.778 175.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 99.5 m -72.02 13.46 0.3 Allowed 'General case' 0 CA--C 1.565 1.551 0 C-N-CA 126.741 2.016 . . . . 0.0 113.223 175.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.89 0.04 12.53 Favored Glycine 0 N--CA 1.471 1.025 0 C-N-CA 127.597 2.522 . . . . 0.0 116.59 176.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.556 HD12 HD12 ' B' ' 58' ' ' LEU . 41.6 mt -65.62 -30.29 70.98 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.654 1.727 . . . . 0.0 113.702 -171.037 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.449 HG23 ' HG2' ' B' ' 59' ' ' ARG . 0.7 OUTLIER -123.7 141.08 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 126.433 1.893 . . . . 0.0 111.771 170.842 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 74.3 t -123.7 138.15 54.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 125.538 1.535 . . . . 0.0 109.118 174.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.62 148.5 30.24 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.458 1.103 . . . . 0.0 113.013 179.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 8.7 m -160.48 162.87 33.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.144 1.378 . . . . 0.0 108.194 -168.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -81.75 147.28 29.52 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.842 1.201 . . . . 0.0 111.55 167.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.21 -14.62 43.38 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.169 0.895 . . . . 0.0 111.781 167.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 139.51 -18.01 3.06 Favored Glycine 0 CA--C 1.536 1.398 0 C-N-CA 126.851 2.167 . . . . 0.0 113.02 -177.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 58.5 ttt-85 -153.37 -46.09 0.09 Allowed 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 127.326 2.251 . . . . 0.0 111.446 -176.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -97.61 -177.88 3.94 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.599 1.96 . . . . 0.0 109.975 170.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 33.8 m -109.09 158.74 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 123.869 0.868 . . . . 0.0 112.822 171.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 10.0 ptt85 -140.08 173.57 11.39 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 128.71 2.804 . . . . 0.0 110.12 -171.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -117.9 120.14 36.96 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.304 1.042 . . . . 0.0 108.476 167.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -103.96 151.43 23.19 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.901 1.28 . . . . 0.0 110.196 172.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.416 HD11 HD22 ' B' ' 27' ' ' LEU . 2.0 tp -60.43 143.81 52.48 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 168.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -42.66 -60.42 1.56 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.107 0.963 . . . . 0.0 112.612 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . 0.461 ' CG ' ' H ' ' B' ' 80' ' ' SER . 11.8 t70 -166.8 -174.83 2.87 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.42 1.488 . . . . 0.0 113.658 171.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.461 ' H ' ' CG ' ' B' ' 79' ' ' ASP . 4.2 m -35.65 -39.26 0.14 Allowed 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 130.196 3.398 . . . . 0.0 113.757 172.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -55.45 -52.41 63.71 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.344 1.057 . . . . 0.0 113.035 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 19.2 mt -75.1 -34.39 61.73 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.036 1.289 . . . . 0.0 110.08 175.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.31 -38.19 88.47 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.32 0.648 . . . . 0.0 110.729 -174.122 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -67.95 -55.04 14.21 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-O 117.425 -1.274 . . . . 0.0 111.816 169.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.99 -32.45 72.92 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 122.407 2.367 . . . . 0.0 113.977 -174.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.41 -43.37 50.28 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.245 1.418 . . . . 0.0 112.285 171.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -79.72 -26.35 56.56 Favored Glycine 0 CA--C 1.54 1.645 0 C-N-CA 124.809 1.195 . . . . 0.0 114.918 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -69.57 -10.6 58.83 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.704 1.202 . . . . 0.0 109.397 165.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 60.2 tp 80.87 -42.6 0.19 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 130.798 3.639 . . . . 0.0 110.574 171.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . 0.46 ' CG2' HG22 ' B' ' 92' ' ' VAL . 0.0 OUTLIER 160.54 -27.25 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.548 1 C-N-CA 133.057 4.543 . . . . 0.0 110.573 170.438 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 79.93 -12.2 1.08 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 127.323 2.249 . . . . 0.0 113.129 -178.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.684 HG21 ' CD1' ' A' ' 14' ' ' LEU . 27.2 m -80.34 70.02 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 CA-C-O 125.641 2.639 . . . . 0.0 114.749 -168.117 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . 0.344 0.7 OUTLIER 34.38 27.47 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.432 -1.347 2 C-N-CA 133.825 4.85 . . . . 0.0 114.595 -167.312 . . . . . . . . 4 3 . 1 . 020 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 34.3 mt 74.61 71.32 0.1 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.497 2.319 . . . . 0.0 110.985 -168.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.4 99.3 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.063 -1.023 . . . . 0.0 111.731 169.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 2.8 t -65.68 159.67 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 126.037 1.735 . . . . 0.0 110.978 177.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.59 9.13 0.69 Allowed 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 128.247 2.619 . . . . 0.0 115.488 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 61.7 p -78.25 154.32 31.09 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 116.426 2.01 . . . . 0.0 116.426 -167.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -65.17 1.93 0.91 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 130.124 3.37 . . . . 0.0 116.356 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -68.68 141.79 93.19 Favored Pre-proline 0 CA--C 1.555 1.136 0 N-CA-C 115.091 1.515 . . . . 0.0 115.091 -167.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . 0.545 ' C ' HH12 ' A' ' 13' ' ' ARG . 66.2 Cg_endo -75.29 -171.23 0.95 Allowed 'Trans proline' 0 C--N 1.361 1.196 1 C-N-CA 125.634 4.223 . . . . 0.0 111.704 175.761 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . 0.593 ' CA ' HH22 ' A' ' 13' ' ' ARG . 0.1 OUTLIER -59.04 149.08 28.6 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 120.696 -1.252 . . . . 0.0 112.369 -176.613 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 61.0 t -63.04 -23.66 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -168.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -90.19 44.28 1.19 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.022 1.329 . . . . 0.0 113.31 177.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -143.29 158.43 43.63 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.765 2.026 . . . . 0.0 110.65 -172.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.89 0 C-N-CA 127.076 2.15 . . . . 0.0 112.969 -179.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.555 1.172 0 N-CA-C 119.851 3.278 . . . . 0.0 119.851 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp 2.43 -92.14 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 128.459 2.703 . . . . 0.0 116.876 -179.472 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.93 -36.88 64.71 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.302 0.955 . . . . 0.0 111.475 -169.352 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.402 ' CZ ' ' HA ' ' B' ' 101' ' ' PRO . 8.7 ttm105 -58.55 -48.05 82.18 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 117.648 -1.168 . . . . 0.0 110.622 169.748 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -58.66 -51.5 69.68 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.11 1.364 . . . . 0.0 111.095 -179.051 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.22 -38.86 91.35 Favored Glycine 0 CA--C 1.533 1.213 0 CA-C-N 119.044 0.838 . . . . 0.0 112.372 177.262 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -87.11 10.14 17.64 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.249 1.42 . . . . 0.0 114.174 175.972 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -117.93 -2.48 11.3 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.761 2.424 . . . . 0.0 111.469 169.364 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.0 mp -105.13 -36.26 7.33 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.232 0.923 . . . . 0.0 109.734 165.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -75.44 86.14 2.57 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 168.12 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -130.69 156.3 80.03 Favored Pre-proline 0 CA--C 1.54 0.576 0 C-N-CA 127.489 2.315 . . . . 0.0 110.71 -173.335 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -77.64 -122.81 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.361 3.374 . . . . 0.0 109.575 -174.603 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 54.1 m -57.65 -17.38 14.37 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 119.924 -1.735 . . . . 0.0 113.003 170.707 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.46 -18.27 60.66 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 120.8 -1.188 . . . . 0.0 112.606 171.475 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.5 t -85.38 -29.43 24.43 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 120.351 -1.468 . . . . 0.0 110.911 166.077 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.2 -43.28 74.27 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.678 -0.639 . . . . 0.0 109.798 167.859 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.549 HG23 HD13 ' A' ' 40' ' ' LEU . 1.3 mm -52.14 -51.3 31.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 CA-C-N 118.94 0.791 . . . . 0.0 112.177 169.211 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 52.9 mt -62.88 -38.39 90.67 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.126 0.788 . . . . 0.0 113.126 -177.167 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.9 p -79.18 -28.83 13.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 CA-C-N 119.395 0.998 . . . . 0.0 113.195 175.701 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.41 3.15 13.96 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.654 1.182 . . . . 0.0 112.953 169.351 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.474 HD22 ' CE2' ' A' ' 75' ' ' TYR . 0.3 OUTLIER -83.62 -52.38 6.5 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 125.02 1.328 . . . . 0.0 108.603 168.163 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.46 -52.73 27.17 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 128.728 2.811 . . . . 0.0 111.94 178.144 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -90.85 36.97 0.91 Allowed 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.861 2.064 . . . . 0.0 111.358 174.163 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -147.28 -93.26 0.12 Allowed Glycine 0 C--N 1.338 0.667 0 C-N-CA 125.588 1.566 . . . . 0.0 113.331 -172.77 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 28.4 m 38.84 29.44 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 C-N-CA 127.356 2.262 . . . . 0.0 116.053 -170.805 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.432 ' HB2' ' HG2' ' A' ' 39' ' ' GLN . 69.4 m -68.44 -89.43 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 127.872 2.469 . . . . 0.0 113.489 176.166 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.426 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 17.7 m-85 -142.93 144.63 30.02 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 126.622 1.969 . . . . 0.0 110.72 -172.935 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -63.24 135.31 49.8 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 123.081 2.521 . . . . 0.0 111.162 -174.107 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.64 -3.13 56.44 Favored Glycine 0 CA--C 1.534 1.224 0 CA-C-O 118.628 -1.095 . . . . 0.0 114.589 -175.211 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.432 ' HG2' ' HB2' ' A' ' 35' ' ' CYS . 2.7 pp0? -70.17 -17.85 63.18 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.773 1.787 . . . . 0.0 112.841 176.198 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.549 HD13 HG23 ' A' ' 26' ' ' ILE . 5.8 mt -50.68 -22.02 1.87 Allowed 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.5 0.591 . . . . 0.0 111.525 171.227 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.39 -32.32 73.89 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.685 0.994 . . . . 0.0 113.685 178.468 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.8 -44.43 27.48 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.105 0.562 . . . . 0.0 110.448 169.118 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -63.65 -30.78 71.84 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.743 1.217 . . . . 0.0 114.081 -176.139 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 27.6 mt -101.41 -14.09 17.7 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.008 1.723 . . . . 0.0 113.71 176.223 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.57 0.39 31.32 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.43 1.014 . . . . 0.0 114.241 -170.612 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 88.8 mt -89.62 136.68 32.89 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.062 1.345 . . . . 0.0 109.732 -179.488 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.1 p -59.07 159.14 7.64 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -168.405 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 71.6 mtp85 -54.37 -30.4 51.65 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.836 176.634 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.4 m -69.09 -57.62 5.17 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.467 1.031 . . . . 0.0 111.225 169.56 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -54.9 -41.37 70.84 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.388 -0.82 . . . . 0.0 112.995 -178.797 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.4 t -71.95 -32.65 44.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 O-C-N 121.486 -0.759 . . . . 0.0 111.962 176.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 68.8 m -69.55 -33.75 73.22 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.364 0.984 . . . . 0.0 112.19 178.477 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -54.9 -48.81 72.56 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.729 0.695 . . . . 0.0 111.788 169.649 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 32.0 m80 -62.6 -40.28 96.43 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 177.538 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 84.1 mt -75.9 -17.86 59.62 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.54 1.536 . . . . 0.0 114.218 179.769 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.3 t -66.31 -41.84 89.16 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.858 1.208 . . . . 0.0 111.895 179.479 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 46.4 t -67.57 -48.28 67.36 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-O 122.8 1.286 . . . . 0.0 110.884 168.839 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.472 ' HB3' ' CG2' ' A' ' 64' ' ' VAL . 1.1 tp -62.45 -37.75 87.12 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.591 1.557 . . . . 0.0 114.362 -169.241 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.431 ' HG2' HG23 ' A' ' 64' ' ' VAL . 1.2 mtt85 -89.76 8.65 30.72 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 114.679 1.362 . . . . 0.0 114.679 173.808 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -108.38 -55.77 0.58 Allowed Glycine 0 N--CA 1.474 1.224 0 C-N-CA 124.959 1.266 . . . . 0.0 111.138 171.879 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 56.0 m -74.76 15.31 0.39 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 128.262 2.625 . . . . 0.0 112.863 179.409 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.97 -5.68 24.09 Favored Glycine 0 C--N 1.34 0.799 0 C-N-CA 128.415 2.912 . . . . 0.0 116.296 169.497 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.4 mt -60.93 -30.42 70.19 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.57 1.685 . . . . 0.0 114.106 -173.059 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.472 ' CG2' ' HB3' ' A' ' 58' ' ' LEU . 1.5 m -138.87 151.21 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 125.854 1.662 . . . . 0.0 111.115 169.395 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.2 t -149.86 144.7 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 123.234 0.614 . . . . 0.0 112.559 176.059 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -78.89 140.43 38.11 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.108 1.363 . . . . 0.0 113.092 178.527 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.5 m -143.07 134.07 25.6 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 126.062 1.745 . . . . 0.0 106.956 -168.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -61.78 127.04 29.54 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 121.18 1.809 . . . . 0.0 111.191 172.851 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.313 2.8 pp20? -85.34 -134.15 0.06 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 118.147 -0.93 . . . . 0.0 110.314 174.344 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -72.77 -37.77 57.12 Favored Glycine 0 CA--C 1.531 1.068 0 CA-C-N 120.892 1.678 . . . . 0.0 113.408 176.27 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 8.0 ttp85 -154.9 -9.38 0.13 Allowed 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -179.524 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -111.8 -173.08 2.17 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.618 2.367 . . . . 0.0 107.707 171.37 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 4.3 m -104.8 146.42 12.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 124.017 0.927 . . . . 0.0 108.916 166.768 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -111.27 -162.66 0.81 Allowed 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 127.279 2.231 . . . . 0.0 109.713 172.752 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.474 ' CE2' HD22 ' A' ' 30' ' ' LEU . 1.1 p90 -159.24 96.87 1.33 Allowed 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 127.107 2.163 . . . . 0.0 106.557 -172.092 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -94.23 156.16 16.68 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.701 1.6 . . . . 0.0 111.233 -177.466 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 13.1 mt -62.7 160.13 14.84 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 165.471 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -42.44 -47.04 4.94 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.545 1.138 . . . . 0.0 114.056 -177.932 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -169.02 172.37 7.59 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 126.309 1.843 . . . . 0.0 108.63 176.728 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -34.33 -36.67 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 128.762 2.825 . . . . 0.0 111.226 162.836 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -38.96 -67.83 0.19 Allowed 'General case' 0 C--N 1.344 0.35 0 C-N-CA 128.552 2.741 . . . . 0.0 113.542 168.662 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 17.4 mt -79.07 -36.01 41.56 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 118.673 -0.679 . . . . 0.0 109.757 -173.16 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.77 -34.19 62.29 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.924 0.784 . . . . 0.0 112.597 170.096 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.7 tpt180 -83.14 -59.73 2.38 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.738 178.738 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.35 -32.36 73.76 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -176.232 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.77 -35.98 59.96 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 121.417 -0.802 . . . . 0.0 110.656 169.846 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.58 -42.87 62.29 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 125.403 1.478 . . . . 0.0 114.44 -173.76 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -77.83 -23.61 48.95 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.734 1.267 . . . . 0.0 111.96 169.352 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 22.1 tp 80.74 146.38 0.09 Allowed 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 129.583 3.153 . . . . 0.0 113.859 166.19 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.9 m -48.9 -7.39 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 129.142 2.977 . . . . 0.0 117.14 -178.387 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 74.89 -44.01 0.53 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 128.147 2.579 . . . . 0.0 113.008 172.893 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.8 p -50.94 44.68 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.34 1 C-N-CA 133.793 4.837 . . . . 0.0 118.435 -169.804 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 59.25 10.35 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 128.896 2.878 . . . . 0.0 112.756 -172.622 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.2 tt 75.28 113.9 0.06 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.821 2.448 . . . . 0.0 106.056 -165.503 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.51 77.94 0.11 Allowed 'General case' 0 CA--C 1.551 1.013 0 O-C-N 121.137 -0.977 . . . . 0.0 112.477 -177.274 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 4.0 m -57.98 140.81 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 125.743 1.617 . . . . 0.0 114.468 -174.948 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.79 104.0 0.07 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.94 2.496 . . . . 0.0 110.216 171.544 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 11.9 p -153.18 -72.3 0.14 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.458 1.103 . . . . 0.0 111.041 -169.157 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . 0.251 30.9 m-20 64.21 43.49 4.88 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 127.377 2.271 . . . . 0.0 112.996 171.591 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -66.39 158.12 79.29 Favored Pre-proline 0 CA--C 1.544 0.735 0 CA-C-N 113.769 -1.56 . . . . 0.0 110.413 168.028 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -59.8 161.8 17.47 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.463 2.776 . . . . 0.0 111.357 169.412 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -60.33 145.87 46.18 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.29 0.566 . . . . 0.0 111.004 -178.408 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 22.0 t -52.63 -29.26 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 124.809 1.244 . . . . 0.0 113.228 -173.108 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -94.15 -17.45 22.75 Favored 'General case' 0 CA--C 1.553 1.071 0 N-CA-C 115.556 1.687 . . . . 0.0 115.556 -179.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -105.91 -142.7 0.37 Allowed 'General case' 0 N--CA 1.478 0.954 0 CA-C-O 116.251 -1.833 . . . . 0.0 110.643 -179.503 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.3 ptp180 . . . . . 0 N--CA 1.493 1.679 0 C-N-CA 127.753 2.421 . . . . 0.0 115.364 -173.093 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 0.992 0 N-CA-C 118.21 2.67 . . . . 0.0 118.21 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 27.2 tp -2.19 -96.94 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 128.319 2.647 . . . . 0.0 116.708 -174.356 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.09 -33.67 63.71 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 119.217 0.917 . . . . 0.0 111.041 -169.339 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 7.0 ttm105 -55.23 -46.81 76.0 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 118.521 -0.752 . . . . 0.0 110.719 169.267 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.34 -50.0 74.34 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.906 1.282 . . . . 0.0 111.063 -179.666 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -59.07 -31.3 68.52 Favored Glycine 0 CA--C 1.534 1.229 0 CA-C-N 119.323 0.965 . . . . 0.0 112.831 177.624 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.6 3.08 55.09 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 174.436 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -106.09 -17.49 14.31 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 127.587 2.355 . . . . 0.0 111.706 172.701 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 4.3 mp -93.8 -44.91 7.89 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.416 0.687 . . . . 0.0 110.853 168.151 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.71 70.55 7.49 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.734 0.778 . . . . 0.0 110.807 172.675 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -127.12 132.97 24.57 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 128.066 2.546 . . . . 0.0 106.105 176.404 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -52.89 -94.01 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.862 1 C-N-CA 126.603 4.868 . . . . 0.0 115.806 -165.936 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 5.3 m -58.19 -25.37 61.49 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.623 1.569 . . . . 0.0 111.214 178.517 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 13.4 ttp180 -73.91 -34.69 64.47 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 179.635 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 52.8 t -63.03 -36.97 85.35 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.573 1.533 . . . . 0.0 109.572 167.605 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.1 mtm180 -61.78 -41.41 97.68 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.949 0.9 . . . . 0.0 112.354 169.823 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mm -61.41 -47.47 93.3 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 CA-C-N 120.235 1.38 . . . . 0.0 111.48 170.284 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 52.8 mt -62.47 -40.9 98.13 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.814 0.845 . . . . 0.0 112.101 -179.301 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 3.7 p -77.59 -28.2 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 177.462 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.17 -12.23 59.67 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 121.138 -0.976 . . . . 0.0 113.183 170.208 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.08 -54.07 16.97 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.292 1.037 . . . . 0.0 108.806 169.263 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 2.6 mt -41.3 -66.7 0.31 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 128.164 2.586 . . . . 0.0 111.201 173.273 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -79.75 32.05 0.25 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.667 1.987 . . . . 0.0 112.403 177.836 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -143.74 -80.91 0.05 OUTLIER Glycine 0 C--N 1.338 0.693 0 C-N-CA 125.002 1.287 . . . . 0.0 113.832 -173.867 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 23.6 m 37.43 22.83 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 N-CA-C 118.447 2.758 . . . . 0.0 118.447 -175.289 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 91.3 m -76.11 -69.66 0.49 Allowed 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.979 1.718 . . . . 0.0 113.274 179.87 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -144.14 159.12 53.75 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 123.684 0.794 . . . . 0.0 112.785 -168.629 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -60.79 138.18 77.67 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 123.748 2.965 . . . . 0.0 111.757 173.892 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 66.39 0.0 7.27 Favored Glycine 0 CA--C 1.533 1.204 0 CA-C-O 119.099 -0.834 . . . . 0.0 114.578 177.79 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -67.51 -29.16 68.5 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 119.077 1.439 . . . . 0.0 111.217 -178.154 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.7 mp -56.07 -15.16 3.24 Favored 'General case' 0 C--O 1.22 -0.496 0 C-N-CA 124.23 1.012 . . . . 0.0 112.892 177.591 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.0 -46.04 78.85 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.635 0.774 . . . . 0.0 111.739 170.75 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.25 -42.24 75.88 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.096 0.862 . . . . 0.0 111.417 174.494 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -63.57 -31.05 72.1 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.103 1.361 . . . . 0.0 113.751 -177.48 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 29.9 mt -99.18 -10.38 22.54 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.55 1.54 . . . . 0.0 113.485 175.391 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.63 8.11 55.72 Favored Glycine 0 CA--C 1.537 1.428 0 CA-C-N 118.984 0.811 . . . . 0.0 113.737 -169.303 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 91.3 mt -88.83 162.82 15.96 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 118.615 1.208 . . . . 0.0 111.742 -177.232 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.5 p -70.67 154.81 41.5 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 120.634 -1.291 . . . . 0.0 110.287 175.26 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 68.0 mtp85 -54.03 -40.47 67.09 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.096 172.019 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 5.6 m -59.2 -49.39 78.04 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.172 0.989 . . . . 0.0 112.877 173.163 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -61.6 -46.62 89.05 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.595 -0.691 . . . . 0.0 110.934 178.657 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 19.3 t -67.18 -37.1 78.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.047 -179.204 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 56.6 m -58.86 -42.91 90.52 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 119.825 1.193 . . . . 0.0 112.855 170.984 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 34.9 m-20 -56.52 -46.57 80.5 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.05 0.841 . . . . 0.0 111.269 176.374 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 27.7 m80 -66.26 -40.65 90.3 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 121.719 -0.613 . . . . 0.0 112.32 176.759 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 88.2 mt -68.5 -18.49 64.4 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.908 0.883 . . . . 0.0 113.054 175.24 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.03 -53.74 54.28 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 120.229 1.377 . . . . 0.0 112.225 -179.16 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 17.5 t -65.99 -44.51 84.64 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.244 0.545 . . . . 0.0 110.326 173.86 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 2.5 tp -55.54 -40.53 71.99 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.092 1.757 . . . . 0.0 113.796 -172.816 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 64.5 mtm180 -83.53 -11.86 56.9 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.057 1.343 . . . . 0.0 113.367 176.447 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -85.62 -54.34 2.82 Favored Glycine 0 N--CA 1.47 0.949 0 C-N-CA 124.466 1.031 . . . . 0.0 110.673 170.828 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 31.2 m -58.45 -6.06 0.63 Allowed 'General case' 0 CA--C 1.56 1.356 0 C-N-CA 126.583 1.953 . . . . 0.0 114.519 174.708 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.87 -2.18 42.88 Favored Glycine 0 CA--C 1.531 1.08 0 C-N-CA 124.65 1.119 . . . . 0.0 114.065 -175.396 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 79.6 mt -57.24 -26.4 60.69 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.387 1.875 . . . . 0.0 113.386 -177.281 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -132.43 143.75 38.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 127.276 2.23 . . . . 0.0 110.177 168.508 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 22.1 t -143.3 139.09 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 125.726 1.61 . . . . 0.0 109.624 -172.54 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.7 153.59 40.01 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 114.008 1.114 . . . . 0.0 114.008 178.108 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 93.7 m -162.01 139.67 8.69 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.36 1.464 . . . . 0.0 108.639 -178.828 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -71.12 123.39 22.04 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 119.946 1.248 . . . . 0.0 109.489 169.037 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.296 0.0 OUTLIER -69.97 -76.35 0.1 Allowed 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.711 1.141 . . . . 0.0 110.351 179.251 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -142.29 -29.98 0.14 Allowed Glycine 0 CA--C 1.534 1.277 0 C-N-CA 127.408 2.432 . . . . 0.0 113.282 169.714 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 6.4 ttp85 -145.93 -10.21 0.52 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.703 1.601 . . . . 0.0 113.914 179.067 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -117.56 172.07 7.59 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 127.0 2.12 . . . . 0.0 109.413 170.012 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 27.8 m -97.88 145.88 8.79 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 164.439 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -126.51 175.49 7.87 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 126.864 2.066 . . . . 0.0 109.718 -176.008 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -120.65 117.03 26.47 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 164.349 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -93.03 166.05 12.55 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.488 1.515 . . . . 0.0 109.123 169.525 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -66.93 166.67 13.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.857 0.863 . . . . 0.0 109.428 167.363 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -47.68 -47.52 29.56 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.538 1.135 . . . . 0.0 113.649 174.77 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -176.72 170.36 2.39 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 126.638 1.975 . . . . 0.0 109.427 -179.442 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -34.65 -36.96 0.05 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 129.373 3.069 . . . . 0.0 111.491 162.723 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -43.25 -69.39 0.14 Allowed 'General case' 0 C--N 1.341 0.205 0 C-N-CA 128.698 2.799 . . . . 0.0 113.295 169.626 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 19.0 mt -70.55 -28.76 65.16 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.22 0.918 . . . . 0.0 111.237 177.528 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -66.49 -34.54 78.14 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.001 0.818 . . . . 0.0 111.388 -176.81 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -79.57 -55.51 4.98 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 117.273 -1.346 . . . . 0.0 110.134 171.611 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.92 -32.17 67.51 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -176.019 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -83.63 -43.89 15.15 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.386 -0.822 . . . . 0.0 110.939 169.796 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -69.47 -29.51 71.58 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 125.106 1.336 . . . . 0.0 114.776 -170.134 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -82.88 -25.0 32.94 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.827 1.251 . . . . 0.0 112.451 168.556 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 21.4 tp 71.22 142.71 0.06 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 129.962 3.305 . . . . 0.0 112.238 -177.754 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . 0.477 HG23 HG12 ' B' ' 92' ' ' VAL . 12.1 m -42.62 -4.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 C-N-CA 129.487 3.115 . . . . 0.0 117.187 168.606 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 71.68 -29.55 0.2 Allowed 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 128.969 2.908 . . . . 0.0 114.565 173.29 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.477 HG12 HG23 ' B' ' 90' ' ' VAL . 4.5 p -58.8 39.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 131.619 3.968 . . . . 0.0 116.488 -175.736 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 60.83 11.63 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 128.779 2.832 . . . . 0.0 113.259 -177.13 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.0 tt 78.85 113.68 0.07 Allowed 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 128.74 2.816 . . . . 0.0 106.35 -166.905 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.28 80.86 0.05 Allowed 'General case' 0 CA--C 1.548 0.887 0 O-C-N 121.045 -1.035 . . . . 0.0 111.868 175.721 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 6.6 m -56.74 146.81 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 127.046 2.138 . . . . 0.0 114.777 -176.322 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -51.11 108.72 0.27 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 127.307 2.243 . . . . 0.0 110.244 169.976 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 3.0 p -158.63 -73.59 0.08 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.138 0.975 . . . . 0.0 109.332 -171.486 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 69.24 36.05 2.48 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.658 1.983 . . . . 0.0 113.133 168.223 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -62.2 164.88 9.75 Favored Pre-proline 0 CA--C 1.545 0.783 0 CA-C-N 114.486 -1.234 . . . . 0.0 111.259 168.543 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . 0.402 ' HA ' ' CZ ' ' A' ' 13' ' ' ARG . 37.5 Cg_endo -59.56 162.37 15.28 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 123.238 2.626 . . . . 0.0 111.92 169.448 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -68.2 151.39 47.03 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.577 0.751 . . . . 0.0 109.351 177.065 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 27.4 t -65.22 -38.8 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 O-C-N 120.924 -1.11 . . . . 0.0 111.574 -168.729 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.36 -13.54 62.43 Favored 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 175.583 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -128.0 -154.76 0.65 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 126.103 1.761 . . . . 0.0 112.328 -176.253 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 1.2 ptp85 . . . . . 0 N--CA 1.486 1.349 0 C-N-CA 125.943 1.697 . . . . 0.0 115.33 -168.318 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.471 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -70.76 -19.6 62.7 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.304 -0.872 . . . . 0.0 110.624 168.226 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.11 -42.29 96.92 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 120.661 -1.274 . . . . 0.0 113.363 168.962 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.5 mmt180 -59.93 -43.93 94.64 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 121.461 -0.774 . . . . 0.0 110.367 173.129 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -58.93 -42.26 89.3 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.421 1.888 . . . . 0.0 112.551 176.25 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.7 -30.11 76.59 Favored Glycine 0 N--CA 1.47 0.904 0 O-C-N 120.689 -1.257 . . . . 0.0 112.999 177.199 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.7 ttt-85 -73.44 -41.3 63.39 Favored 'General case' 0 C--O 1.221 -0.395 0 O-C-N 121.725 -0.867 . . . . 0.0 110.817 169.991 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.83 -32.65 65.97 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 176.554 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.5 mt -75.15 -44.93 44.15 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.344 1.058 . . . . 0.0 112.772 172.122 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -84.28 -14.24 50.35 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 116.56 2.059 . . . . 0.0 116.56 -175.507 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -50.94 148.7 7.21 Favored Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 126.74 2.016 . . . . 0.0 115.082 -170.843 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -49.41 -64.97 0.18 Allowed 'Trans proline' 0 C--N 1.351 0.666 1 C-N-CA 125.889 4.393 . . . . 0.0 112.652 -173.538 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 52.8 m -82.39 -31.58 29.61 Favored 'General case' 0 C--O 1.226 -0.145 0 CA-C-O 118.452 -0.785 . . . . 0.0 111.756 175.054 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.514 ' CD ' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -72.89 -32.06 65.12 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 120.313 1.415 . . . . 0.0 114.406 -171.304 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.8 t -61.46 -50.38 73.02 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.0 0.818 . . . . 0.0 110.39 170.438 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -57.63 -45.48 85.36 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.812 1.245 . . . . 0.0 113.044 174.363 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 mm -51.6 -53.39 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.388 1.075 . . . . 0.0 110.607 169.515 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.6 mt -56.28 -51.91 66.43 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 117.617 -1.183 . . . . 0.0 111.74 178.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.2 m -61.21 -38.18 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 CA-C-N 119.532 1.06 . . . . 0.0 112.404 -178.645 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.83 -15.41 61.17 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 176.327 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.0 tp -74.12 -40.16 62.85 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 120.778 1.626 . . . . 0.0 112.806 175.487 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.434 HD12 HD22 ' A' ' 86' ' ' LEU . 3.4 mt -51.56 -46.61 63.47 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.596 1.559 . . . . 0.0 110.978 175.116 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -86.12 11.98 10.64 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 126.533 1.933 . . . . 0.0 113.277 176.305 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -125.41 -92.79 0.92 Allowed Glycine 0 N--CA 1.468 0.794 0 C-N-CA 126.848 2.166 . . . . 0.0 114.447 -174.345 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.465 HG12 ' HA ' ' A' ' 76' ' ' ALA . 30.4 m 36.04 41.12 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 127.182 2.193 . . . . 0.0 114.75 -167.326 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 98.9 m -87.38 -102.99 0.07 Allowed 'General case' 0 C--O 1.211 -0.95 0 C-N-CA 124.14 0.976 . . . . 0.0 110.679 175.761 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -112.52 168.87 7.03 Favored Pre-proline 0 CA--C 1.55 0.976 0 O-C-N 120.034 -1.666 . . . . 0.0 114.356 -170.17 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.25 111.4 2.26 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.14 1.893 . . . . 0.0 109.899 -176.002 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.54 7.21 76.05 Favored Glycine 0 CA--C 1.532 1.096 0 CA-C-O 119.166 -0.797 . . . . 0.0 114.354 -175.974 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.01 -21.79 23.4 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 119.45 1.625 . . . . 0.0 115.076 177.97 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.7 mp -63.72 -17.04 62.6 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 123.384 0.674 . . . . 0.0 111.845 175.971 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.33 -25.2 67.76 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.915 0.78 . . . . 0.0 112.992 173.607 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.55 -50.17 14.58 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.656 0.662 . . . . 0.0 110.146 168.706 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -56.29 -38.78 71.68 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 179.752 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.4 mt -99.36 -19.83 16.81 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.42 1.088 . . . . 0.0 113.438 -172.515 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.64 -11.03 3.51 Favored Glycine 0 CA--C 1.539 1.544 0 C-N-CA 124.525 1.059 . . . . 0.0 113.254 -168.303 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -74.38 128.15 34.81 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 125.147 1.379 . . . . 0.0 108.051 175.461 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.2 t -56.33 154.99 7.42 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 122.29 1.043 . . . . 0.0 112.019 -176.649 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.6 ptt-85 -54.93 -16.53 2.78 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.129 0.971 . . . . 0.0 113.316 175.02 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.6 t -65.32 -67.79 0.41 Allowed 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.404 1.002 . . . . 0.0 109.48 167.766 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -54.5 -42.81 71.22 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.604 1.093 . . . . 0.0 112.836 176.947 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.3 t -63.4 -45.48 97.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-O 118.389 -0.815 . . . . 0.0 111.41 177.005 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 26.0 m -71.57 -35.4 70.56 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 120.793 1.633 . . . . 0.0 112.837 178.311 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -56.15 -56.79 16.56 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.595 1.558 . . . . 0.0 110.094 173.746 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -73.0 -28.65 62.5 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -179.87 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 44.0 mt -64.3 -33.9 76.89 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.895 1.225 . . . . 0.0 111.72 169.671 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 66.7 m -62.04 -45.31 94.13 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 120.368 1.44 . . . . 0.0 113.683 -170.795 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 17.6 t -72.14 -21.07 61.52 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 119.432 1.015 . . . . 0.0 112.293 170.816 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.514 HD13 ' CD ' ' A' ' 23' ' ' ARG . 8.2 tp -67.31 -38.12 84.45 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 120.525 1.511 . . . . 0.0 110.439 171.528 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.423 ' HG2' HG23 ' A' ' 64' ' ' VAL . 90.9 mtm-85 -73.78 -15.24 61.2 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.078 1.351 . . . . 0.0 112.305 172.889 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.18 -58.51 1.56 Allowed Glycine 0 C--N 1.338 0.69 0 N-CA-C 109.323 -1.511 . . . . 0.0 109.323 179.499 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 69.7 m -60.89 10.82 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 128.113 2.565 . . . . 0.0 114.375 173.191 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 62.87 16.12 56.3 Favored Glycine 0 N--CA 1.469 0.864 0 C-N-CA 127.229 2.347 . . . . 0.0 115.631 173.668 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 82.6 mt -78.45 -26.91 46.3 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.532 1.166 . . . . 0.0 112.941 -179.566 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.423 HG23 ' HG2' ' A' ' 59' ' ' ARG . 2.8 m -132.54 142.81 41.56 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.771 1.228 . . . . 0.0 113.686 178.249 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 20.5 t -129.78 139.88 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.979 2.112 . . . . 0.0 109.893 -177.987 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.03 138.16 43.88 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.272 0.629 . . . . 0.0 112.272 170.726 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.98 161.51 35.47 Favored 'General case' 0 CA--C 1.509 -0.604 0 CA-C-O 121.706 0.765 . . . . 0.0 110.191 170.503 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -73.69 122.66 22.7 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 105.893 -1.892 . . . . 0.0 105.893 165.152 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 19.2 pt-20 -75.39 -22.99 57.02 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.773 1.169 . . . . 0.0 112.542 169.804 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 118.69 105.32 2.21 Favored Glycine 0 C--N 1.337 0.584 0 N-CA-C 106.798 -2.521 . . . . 0.0 106.798 -168.344 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 13.8 ttt85 76.01 -57.33 0.57 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.615 1.966 . . . . 0.0 111.621 -169.209 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -98.14 -166.95 1.44 Allowed 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 119.13 0.877 . . . . 0.0 111.249 -179.426 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 10.4 p -128.67 149.63 33.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 126.255 1.822 . . . . 0.0 108.649 -176.797 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.5 ptt180 -136.0 169.73 17.14 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 126.268 1.827 . . . . 0.0 110.998 -177.732 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -112.34 139.5 47.85 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 164.012 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.465 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -139.81 150.86 45.21 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.533 1.133 . . . . 0.0 110.394 -178.142 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -50.05 129.41 20.72 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.28 1.032 . . . . 0.0 108.302 170.031 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.9 -24.34 66.83 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -170.533 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -161.09 156.61 24.76 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 123.217 1.484 . . . . 0.0 112.9 -179.817 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 91.2 p -43.04 -36.48 1.61 Allowed 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 128.809 2.844 . . . . 0.0 114.87 168.519 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 -58.5 -42.88 88.62 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.08 -1.012 . . . . 0.0 112.559 175.904 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.3 mt -73.06 -38.3 66.51 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 118.685 0.675 . . . . 0.0 109.389 179.062 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.88 -40.55 89.05 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.469 0.708 . . . . 0.0 109.23 -179.53 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.9 tpt180 -70.98 -51.97 22.47 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.951 1.7 . . . . 0.0 113.495 175.581 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.2 -45.19 95.62 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.734 1.152 . . . . 0.0 112.736 -179.654 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.434 HD22 HD12 ' A' ' 31' ' ' LEU . 2.0 tt -56.49 -55.59 31.88 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.836 0.855 . . . . 0.0 108.99 169.468 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.78 -17.54 78.32 Favored Glycine 0 CA--C 1.543 1.835 0 C-N-CA 125.601 1.572 . . . . 0.0 115.603 -167.93 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -73.58 -23.25 59.92 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 119.36 1.58 . . . . 0.0 110.361 166.998 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 52.7 tp 72.81 117.83 0.05 OUTLIER 'General case' 0 C--N 1.343 0.314 0 C-N-CA 129.261 3.024 . . . . 0.0 107.68 -171.872 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 21.7 t -69.1 18.78 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 125.902 1.681 . . . . 0.0 113.591 -169.078 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 91.19 -21.64 0.1 Allowed 'General case' 0 C--O 1.221 -0.446 0 O-C-N 119.494 -2.004 . . . . 0.0 110.349 126.319 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.413 ' C ' ' H ' ' A' ' 94' ' ' LEU . 7.7 p -72.44 41.61 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 127.628 2.371 . . . . 0.0 111.43 165.376 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER 68.6 -27.05 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 C-N-CA 129.608 3.163 . . . . 0.0 113.57 -173.162 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.413 ' H ' ' C ' ' A' ' 92' ' ' VAL . 45.8 tp 138.28 112.67 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.35 1 C-N-CA 133.116 4.566 . . . . 0.0 106.032 -169.644 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -55.41 106.84 0.27 Allowed 'General case' 0 CA--C 1.546 0.813 0 O-C-N 121.603 -0.686 . . . . 0.0 111.356 169.432 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.2 t -58.87 158.8 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 127.494 2.317 . . . . 0.0 110.916 169.89 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -85.85 18.83 2.76 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.261 1.824 . . . . 0.0 115.015 -179.568 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.4 p -75.36 96.99 3.5 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.198 0.999 . . . . 0.0 111.906 -178.347 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -88.79 49.34 1.77 Allowed 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 126.662 1.985 . . . . 0.0 110.534 170.503 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.422 ' HB3' ' HD2' ' A' ' 101' ' ' PRO . 66.6 mm-40 -103.1 -174.41 0.34 Allowed Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 127.674 2.389 . . . . 0.0 112.43 -169.738 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.422 ' HD2' ' HB3' ' A' ' 100' ' ' GLN . 36.9 Cg_endo -65.28 149.7 88.2 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.988 2.459 . . . . 0.0 110.495 164.207 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.9 t -61.13 172.81 0.94 Allowed 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 124.303 2.002 . . . . 0.0 114.994 -170.339 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 2.4 t -72.69 -17.36 18.35 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 CA-C-N 113.387 -1.733 . . . . 0.0 110.91 172.511 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.96 -24.5 40.92 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.739 1.216 . . . . 0.0 112.099 168.121 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -91.71 -122.48 0.08 Allowed 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 128.756 2.823 . . . . 0.0 105.345 173.119 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . 0.335 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.507 0 C-N-CA 131.174 3.789 . . . . 0.0 114.8 165.149 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.541 0 N-CA-C 117.224 2.305 . . . . 0.0 117.224 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -88.45 -17.74 29.76 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.339 1.056 . . . . 0.0 112.487 168.963 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.62 -29.08 69.82 Favored 'General case' 0 CA--C 1.546 0.793 0 O-C-N 119.605 -1.934 . . . . 0.0 112.45 170.44 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 11.8 mmt-85 -66.04 -39.52 90.24 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.94 0.896 . . . . 0.0 111.691 170.39 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -57.32 -41.29 79.67 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.146 1.378 . . . . 0.0 111.879 -178.55 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -61.77 -37.24 93.97 Favored Glycine 0 N--CA 1.476 1.305 0 CA-C-N 120.339 1.427 . . . . 0.0 113.535 -178.391 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 9.2 ttt-85 -80.58 -24.11 39.41 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 118.054 0.927 . . . . 0.0 111.937 170.611 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.39 -33.94 74.51 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.138 -1.601 . . . . 0.0 112.498 170.289 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 17.5 mt -83.62 -42.14 17.04 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.163 0.985 . . . . 0.0 111.242 174.409 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -100.08 65.23 1.26 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.833 1.253 . . . . 0.0 112.746 173.307 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -120.81 149.56 50.96 Favored Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 126.082 1.753 . . . . 0.0 108.974 176.881 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -59.74 -63.73 0.12 Allowed 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 124.601 3.534 . . . . 0.0 112.725 -171.839 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.3 m -77.99 -37.75 46.49 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-O 118.709 -0.662 . . . . 0.0 110.066 174.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.666 ' CD ' HD13 ' B' ' 58' ' ' LEU . 0.5 OUTLIER -67.0 -37.2 83.77 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -169.6 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 22.2 t -62.7 -49.53 74.74 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.644 1.111 . . . . 0.0 111.139 171.811 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 64.5 mtt180 -53.81 -46.67 71.18 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.243 1.017 . . . . 0.0 112.982 172.841 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 11.3 mm -51.9 -53.27 18.36 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 C-N-CA 124.63 1.172 . . . . 0.0 110.787 170.47 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 78.2 mt -57.85 -47.38 82.86 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 117.837 -1.077 . . . . 0.0 111.667 179.131 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.5 m -64.29 -39.52 85.81 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 119.914 1.233 . . . . 0.0 112.813 -179.995 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.32 -8.64 59.78 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -179.274 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' B' ' 30' ' ' LEU . 13.2 mt -69.42 -45.17 69.8 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 118.279 -0.867 . . . . 0.0 112.907 169.207 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . 0.409 HD12 HD22 ' B' ' 86' ' ' LEU . 0.9 OUTLIER -44.48 -63.29 0.92 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.27 2.628 . . . . 0.0 112.569 -176.525 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -95.63 8.31 43.76 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 126.53 1.932 . . . . 0.0 112.788 -177.365 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.14 -85.88 1.83 Allowed Glycine 0 C--N 1.338 0.66 0 C-N-CA 127.818 2.628 . . . . 0.0 110.435 173.185 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 34.11 44.53 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.754 1.621 . . . . 0.0 113.552 -167.728 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 88.6 m -105.18 -145.54 0.38 Allowed 'General case' 0 N--CA 1.446 -0.648 0 CA-C-O 123.571 1.653 . . . . 0.0 109.655 170.038 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.79 166.03 13.42 Favored Pre-proline 0 C--N 1.317 -0.847 0 N-CA-C 117.609 2.448 . . . . 0.0 117.609 -160.47 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -72.32 110.9 3.07 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 122.25 1.966 . . . . 0.0 107.797 -175.996 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.81 13.27 75.61 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-O 118.227 -1.319 . . . . 0.0 114.908 -171.676 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.59 -36.82 64.83 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.603 1.701 . . . . 0.0 111.297 171.013 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.5 mp -56.14 -15.8 4.26 Favored 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 124.634 1.174 . . . . 0.0 113.926 -179.756 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.16 -43.74 92.09 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 119.233 0.924 . . . . 0.0 111.507 172.933 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.43 -25.04 54.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.764 0.826 . . . . 0.0 113.125 175.347 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -70.26 -32.71 70.67 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.422 -0.799 . . . . 0.0 112.813 172.288 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 12.8 mt -111.0 -20.18 12.51 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 115.234 1.568 . . . . 0.0 115.234 -169.426 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.88 4.83 78.12 Favored Glycine 0 CA--C 1.535 1.285 0 CA-C-N 119.926 1.239 . . . . 0.0 113.75 -169.731 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -100.24 135.67 41.32 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 125.065 1.346 . . . . 0.0 110.82 178.503 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 6.2 t -55.9 154.47 7.24 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.385 -0.822 . . . . 0.0 112.544 177.796 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 32.9 ptt-85 -51.57 -23.76 4.57 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.251 1.42 . . . . 0.0 113.539 174.88 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 25.7 t -63.66 -67.08 0.46 Allowed 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 118.526 0.603 . . . . 0.0 110.751 169.484 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -58.07 -35.73 71.79 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.209 1.003 . . . . 0.0 113.455 -179.892 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 15.4 t -59.43 -47.96 88.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 118.767 0.712 . . . . 0.0 111.793 169.899 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 35.7 m -78.31 -32.54 49.36 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -175.638 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -60.15 -49.85 76.01 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.053 0.941 . . . . 0.0 110.176 176.477 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -72.95 -34.36 66.47 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 117.981 -1.009 . . . . 0.0 113.68 175.363 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 28.3 mt -56.38 -30.72 63.06 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 120.643 1.565 . . . . 0.0 112.526 169.571 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 67.7 m -69.54 -49.8 51.0 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 120.144 1.338 . . . . 0.0 114.571 -170.79 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 16.6 t -63.19 -27.55 69.44 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 119.708 1.14 . . . . 0.0 111.678 171.599 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.666 HD13 ' CD ' ' B' ' 23' ' ' ARG . 11.8 tp -66.36 -39.98 89.47 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.108 2.163 . . . . 0.0 112.35 177.271 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.472 ' HG2' HG23 ' B' ' 64' ' ' VAL . 82.2 mtm-85 -67.65 -33.52 75.11 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 119.145 0.884 . . . . 0.0 110.327 173.228 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -71.46 -53.64 9.87 Favored Glycine 0 N--CA 1.466 0.634 0 N-CA-C 110.251 -1.14 . . . . 0.0 110.251 179.226 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 57.1 m -55.98 -4.6 0.13 Allowed 'General case' 0 CA--C 1.56 1.332 0 C-N-CA 128.112 2.565 . . . . 0.0 113.961 173.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.78 16.66 67.47 Favored Glycine 0 C--N 1.343 0.953 0 C-N-CA 127.347 2.403 . . . . 0.0 113.645 170.083 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.618 HD12 HD12 ' B' ' 58' ' ' LEU . 90.7 mt -94.52 -21.11 19.08 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 115.501 1.667 . . . . 0.0 115.501 -169.648 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.472 HG23 ' HG2' ' B' ' 59' ' ' ARG . 4.5 m -140.44 156.17 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -173.77 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 96.2 t -147.21 149.48 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 125.702 1.601 . . . . 0.0 111.019 -173.144 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.4 125.2 41.89 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.012 0.925 . . . . 0.0 111.906 169.168 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.15 165.85 16.84 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.254 1.021 . . . . 0.0 110.313 -176.154 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -76.04 122.57 24.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.817 168.675 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -85.78 -24.97 26.63 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 118.316 0.507 . . . . 0.0 111.357 167.067 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 125.96 105.33 1.47 Allowed Glycine 0 C--N 1.34 0.778 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -174.191 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 71.15 -52.1 0.69 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.999 2.12 . . . . 0.0 111.403 -169.639 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -91.45 -178.04 4.99 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.643 1.177 . . . . 0.0 110.444 177.568 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 11.2 p -125.61 138.24 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 125.976 1.71 . . . . 0.0 108.884 179.896 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 38.1 ptt180 -115.17 166.28 12.0 Favored 'General case' 0 CA--C 1.509 -0.628 0 C-N-CA 124.708 1.203 . . . . 0.0 109.415 -176.78 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -115.75 135.94 53.54 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 168.979 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -141.77 160.91 39.22 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.88 1.672 . . . . 0.0 112.055 -169.098 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 49.7 mt -68.19 152.67 45.13 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 123.803 0.841 . . . . 0.0 109.271 167.421 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -81.22 -22.35 38.86 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 -169.5 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -167.07 158.14 12.0 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.383 1.473 . . . . 0.0 112.76 179.068 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 89.5 p -40.01 -39.84 0.94 Allowed 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 128.811 2.845 . . . . 0.0 114.949 168.221 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -55.97 -43.81 77.92 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.701 0.8 . . . . 0.0 111.571 175.9 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 1.9 mt -78.0 -42.14 33.61 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.408 1.004 . . . . 0.0 110.194 -176.471 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.12 -38.9 63.06 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.852 0.861 . . . . 0.0 111.043 171.777 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 18.5 tpt180 -70.95 -52.72 18.15 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.574 1.55 . . . . 0.0 113.659 177.041 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.94 -40.38 88.73 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 118.89 0.768 . . . . 0.0 112.43 177.622 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.409 HD22 HD12 ' B' ' 31' ' ' LEU . 0.8 OUTLIER -57.88 -49.32 77.13 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.971 1.308 . . . . 0.0 109.883 169.564 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -73.05 -29.95 63.94 Favored Glycine 0 CA--C 1.536 1.384 0 C-N-CA 125.636 1.588 . . . . 0.0 114.768 -169.552 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -73.75 -14.63 61.15 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-N 118.971 1.385 . . . . 0.0 111.128 167.197 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 28.2 tp 70.78 157.08 0.16 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 129.001 2.921 . . . . 0.0 107.922 -166.861 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . 0.535 HG21 ' H ' ' B' ' 95' ' ' ALA . 27.8 m -53.91 -11.84 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 O-C-N 121.055 -1.028 . . . . 0.0 112.654 167.397 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . 0.427 ' C ' ' H ' ' B' ' 93' ' ' VAL . 3.6 tp-100 76.5 -20.04 0.39 Allowed 'General case' 0 C--N 1.345 0.376 0 C-N-CA 127.742 2.417 . . . . 0.0 112.287 161.487 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.412 HG13 ' O ' ' B' ' 92' ' ' VAL . 3.9 p -68.05 38.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 128.593 2.757 . . . . 0.0 113.903 169.515 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . 0.427 ' H ' ' C ' ' B' ' 91' ' ' GLN . 2.3 t 74.72 -34.42 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 C-N-CA 130.039 3.336 . . . . 0.0 112.301 -178.718 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 38.3 tp 155.3 111.12 0.0 OUTLIER 'General case' 0 C--N 1.341 0.236 0 C-N-CA 131.664 3.986 . . . . 0.0 108.123 178.073 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.535 ' H ' HG21 ' B' ' 90' ' ' VAL . . . -64.07 87.11 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.82 0 O-C-N 121.638 -0.664 . . . . 0.0 109.557 165.943 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 4.2 t -53.7 162.04 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 128.091 2.556 . . . . 0.0 111.237 173.293 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -73.61 8.09 2.06 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 127.625 2.37 . . . . 0.0 116.544 -179.533 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 45.1 p -73.59 114.73 12.18 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 119.247 0.931 . . . . 0.0 113.351 -171.22 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -102.0 113.84 27.42 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 105.68 -1.97 . . . . 0.0 105.68 166.062 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . 0.4 ' HG3' ' HD2' ' B' ' 101' ' ' PRO . 1.3 tp-100 -161.78 -169.04 0.21 Allowed Pre-proline 0 CA--C 1.551 0.982 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 -163.933 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . 0.4 ' HD2' ' HG3' ' B' ' 100' ' ' GLN . 87.2 Cg_endo -75.43 -174.39 1.97 Allowed 'Trans proline' 0 N--CA 1.45 -1.056 0 C-N-CA 121.371 1.38 . . . . 0.0 111.43 175.124 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 5.2 t -68.16 171.54 6.89 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-O 123.339 1.542 . . . . 0.0 110.655 168.936 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 17.3 t -77.47 -22.11 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 C-N-CA 127.105 2.162 . . . . 0.0 111.7 175.389 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -76.69 -37.27 56.41 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.419 1.087 . . . . 0.0 111.681 169.373 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -68.27 175.86 3.07 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.985 1.714 . . . . 0.0 110.248 169.304 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.819 0 O-C-N 120.498 -1.376 . . . . 0.0 113.819 -179.851 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.842 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . 0.258 4.0 pp -67.19 -33.45 75.4 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -172.373 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.53 -46.75 89.01 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.465 1.03 . . . . 0.0 111.004 168.613 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -59.11 -38.31 79.26 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 120.452 1.478 . . . . 0.0 112.679 174.705 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -63.36 -57.47 10.23 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 119.036 0.834 . . . . 0.0 110.853 177.366 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -61.15 -32.34 80.12 Favored Glycine 0 CA--C 1.533 1.178 0 O-C-N 121.335 -0.853 . . . . 0.0 113.007 178.267 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -68.15 -4.04 12.47 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.295 1.548 . . . . 0.0 114.144 -178.807 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -128.31 -15.87 4.54 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 167.898 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.6 mp -101.39 -15.76 17.1 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 178.641 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.23 75.09 4.62 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.571 1.548 . . . . 0.0 107.329 167.281 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -164.46 147.92 7.69 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 123.757 0.823 . . . . 0.0 113.125 -168.441 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -63.63 -96.87 0.0 OUTLIER 'Trans proline' 0 CA--C 1.547 1.145 1 C-N-CA 125.45 4.1 . . . . 0.0 111.512 174.065 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.3 p -47.98 -35.6 11.17 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 128.12 2.568 . . . . 0.0 112.912 169.677 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.552 ' CG ' HD11 ' A' ' 58' ' ' LEU . 5.5 ttm180 -75.96 -46.71 28.33 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 121.532 1.969 . . . . 0.0 113.94 -169.17 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 37.3 t -59.17 -42.42 90.76 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.93 0.786 . . . . 0.0 109.514 169.943 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -54.66 -43.37 72.34 Favored 'General case' 0 CA--C 1.555 1.163 0 CA-C-O 117.93 -1.033 . . . . 0.0 112.641 171.251 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 1.1 mt -56.28 -51.7 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 CA-C-N 121.858 2.117 . . . . 0.0 110.338 172.338 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 81.6 mt -60.17 -40.05 88.56 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 118.486 -0.769 . . . . 0.0 112.796 -177.165 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.6 p -81.67 -24.62 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 CA-C-N 119.637 1.108 . . . . 0.0 113.067 178.324 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.75 -31.03 63.14 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.638 1.175 . . . . 0.0 111.972 172.844 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.587 ' O ' HG13 ' A' ' 34' ' ' VAL . 1.1 tp -64.64 -39.68 94.12 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 120.787 -1.196 . . . . 0.0 113.513 170.441 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -44.6 -44.41 8.87 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.626 2.37 . . . . 0.0 114.283 -174.753 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -103.56 -19.31 14.41 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.36 1.064 . . . . 0.0 112.978 169.089 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.71 -2.28 57.41 Favored Glycine 0 C--O 1.218 -0.871 0 CA-C-O 114.992 -3.115 . . . . 0.0 117.257 -165.076 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.587 HG13 ' O ' ' A' ' 30' ' ' LEU . 19.7 m -32.99 54.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 N-CA-C 119.668 3.21 . . . . 0.0 119.668 169.418 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.9 m -109.42 -67.47 0.98 Allowed 'General case' 0 C--O 1.224 -0.287 0 O-C-N 119.828 -1.795 . . . . 0.0 110.728 -174.167 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -148.78 157.14 41.13 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-O 117.901 -1.047 . . . . 0.0 110.976 -174.456 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -55.98 -31.93 83.94 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.166 2.578 . . . . 0.0 113.827 179.121 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -81.33 -8.26 87.36 Favored Glycine 0 CA--C 1.532 1.135 0 CA-C-O 118.352 -1.249 . . . . 0.0 114.851 176.338 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.85 -37.58 84.73 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 119.554 1.677 . . . . 0.0 111.531 -170.881 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.5 mt -58.5 -24.58 60.84 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 123.699 0.8 . . . . 0.0 111.33 178.996 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.59 -36.67 67.14 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 119.265 0.938 . . . . 0.0 111.427 -175.366 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.39 -51.94 10.88 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.933 0.893 . . . . 0.0 112.529 172.756 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -53.57 -32.92 52.89 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 178.239 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.485 HD12 HG22 ' A' ' 51' ' ' VAL . 55.6 mt -97.33 -11.31 24.19 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 126.442 1.897 . . . . 0.0 112.617 -179.104 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 61.69 18.42 56.41 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-O 118.598 -1.112 . . . . 0.0 113.867 -170.812 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.8 mt -122.19 148.17 45.28 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 119.277 1.539 . . . . 0.0 113.733 -169.661 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.3 t -58.79 138.12 57.35 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.074 178.572 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.4 -24.82 65.44 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -171.325 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.7 m -63.8 -47.89 79.06 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.4 1.08 . . . . 0.0 112.687 170.196 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 45.6 t30 -75.2 -32.83 61.31 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 118.76 0.709 . . . . 0.0 111.712 178.341 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.485 HG22 HD12 ' A' ' 44' ' ' LEU . 24.9 t -58.89 -41.52 83.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 120.982 -1.074 . . . . 0.0 110.343 167.848 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 57.8 m -63.1 -40.29 97.19 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 177.844 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -51.07 -50.52 58.53 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.488 1.115 . . . . 0.0 111.572 173.405 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -69.87 -37.23 76.01 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 115.4 -2.238 . . . . 0.0 113.598 176.205 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.445 ' HA ' HD13 ' A' ' 58' ' ' LEU . 37.7 mt -61.25 -34.09 74.58 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 121.437 1.926 . . . . 0.0 113.279 175.464 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.4 m -53.12 -39.26 63.34 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.184 -0.947 . . . . 0.0 113.441 -177.797 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 3.2 t -66.99 -51.08 59.45 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 118.878 0.763 . . . . 0.0 111.085 176.603 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.618 ' H ' HD12 ' A' ' 58' ' ' LEU . 2.6 mp -59.64 -36.2 75.9 Favored 'General case' 0 N--CA 1.484 1.259 0 O-C-N 120.792 -1.192 . . . . 0.0 111.885 -175.394 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 90.4 mtm180 -76.17 -21.7 56.22 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.336 1.055 . . . . 0.0 112.71 -176.721 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.3 -36.11 4.5 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 124.893 1.235 . . . . 0.0 114.49 176.991 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 59.9 m -70.63 -17.03 62.88 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 125.003 1.321 . . . . 0.0 112.441 173.396 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 95.17 20.14 28.7 Favored Glycine 0 CA--C 1.532 1.139 0 C-N-CA 128.137 2.78 . . . . 0.0 115.782 172.295 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.1 mt -83.4 -20.38 34.27 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 119.333 1.567 . . . . 0.0 114.499 177.091 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.531 HG23 ' HB3' ' A' ' 58' ' ' LEU . 61.9 t -134.33 140.74 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 C-N-CA 124.637 1.175 . . . . 0.0 110.612 -179.057 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.6 t -135.31 135.93 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 126.273 1.829 . . . . 0.0 108.672 -170.977 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.09 157.57 37.52 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 122.628 1.204 . . . . 0.0 112.214 172.399 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 30.3 m -153.54 154.34 34.11 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.842 1.657 . . . . 0.0 106.587 175.301 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -74.23 162.44 28.93 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.936 0.789 . . . . 0.0 112.379 169.758 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -139.91 171.32 14.38 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 126.309 1.844 . . . . 0.0 111.911 178.246 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -68.14 75.42 0.26 Allowed Glycine 0 CA--C 1.527 0.834 0 C-N-CA 125.837 1.684 . . . . 0.0 112.525 179.366 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 95.9 18.96 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 129.945 3.298 . . . . 0.0 111.987 179.7 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -158.06 -178.63 7.44 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 120.972 -1.08 . . . . 0.0 110.551 -175.17 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 32.5 m -121.76 156.48 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 124.148 0.979 . . . . 0.0 109.198 167.257 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -132.51 178.3 6.95 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 124.767 1.227 . . . . 0.0 110.452 -170.23 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -129.54 134.92 48.01 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.525 168.862 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.583 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -130.09 151.64 50.4 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 126.414 1.886 . . . . 0.0 108.834 179.596 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.12 157.76 15.22 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.257 0.48 . . . . 0.0 110.708 175.536 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -43.04 -54.61 4.23 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.748 1.619 . . . . 0.0 113.544 -178.201 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -165.7 165.66 18.47 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.834 1.653 . . . . 0.0 110.137 -173.843 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.16 -35.72 0.08 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 129.687 3.195 . . . . 0.0 111.642 165.803 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -46.53 -69.2 0.14 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.307 1.843 . . . . 0.0 113.145 169.172 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.4 mt -71.57 -34.01 69.57 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 119.083 0.856 . . . . 0.0 110.771 -174.487 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.65 -45.91 90.61 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 118.673 -0.68 . . . . 0.0 111.923 175.612 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.03 -43.28 71.63 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 117.318 -1.325 . . . . 0.0 111.651 176.416 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.37 -47.86 80.53 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 119.785 1.175 . . . . 0.0 113.238 177.063 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.25 -39.62 74.92 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.763 -0.585 . . . . 0.0 111.136 178.472 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.69 -36.79 61.83 Favored Glycine 0 CA--C 1.531 1.059 0 C-N-CA 125.311 1.434 . . . . 0.0 114.565 -176.7 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -72.68 -5.96 41.15 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.651 1.226 . . . . 0.0 112.521 172.655 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 52.0 tp 75.01 107.62 0.07 Allowed 'General case' 0 C--N 1.345 0.392 0 C-N-CA 129.764 3.226 . . . . 0.0 112.459 166.349 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.81 32.67 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 125.81 1.644 . . . . 0.0 112.328 -169.756 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 79.93 -10.8 1.25 Allowed 'General case' 0 C--O 1.221 -0.433 0 O-C-N 120.387 -1.445 . . . . 0.0 113.824 122.123 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.427 HG13 ' O ' ' A' ' 92' ' ' VAL . 12.3 p -71.94 54.08 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 C-N-CA 130.218 3.407 . . . . 0.0 109.963 166.647 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 71.92 -10.87 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 126.632 1.973 . . . . 0.0 114.355 178.268 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.3 tt 117.47 103.67 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 131.291 3.836 . . . . 0.0 106.755 -169.355 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.81 76.72 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.173 0 C-N-CA 125.115 1.366 . . . . 0.0 114.383 174.269 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.1 t -82.08 145.4 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 125.686 1.594 . . . . 0.0 107.728 167.269 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -69.82 13.99 0.12 Allowed 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 178.137 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.82 34.48 0.12 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.966 1.306 . . . . 0.0 109.771 166.74 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -57.83 130.54 46.92 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 125.254 1.422 . . . . 0.0 109.245 -166.742 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -132.31 132.78 23.1 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.958 -160.693 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -53.39 150.71 25.56 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 125.142 3.894 . . . . 0.0 117.968 -163.499 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 41.5 t -90.98 -134.47 0.13 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 127.066 2.146 . . . . 0.0 112.727 177.171 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 10.0 t 58.54 -116.17 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 127.917 2.487 . . . . 0.0 106.163 -168.472 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -175.67 149.42 0.97 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 129.603 3.161 . . . . 0.0 108.38 171.303 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -153.01 141.13 20.41 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.45 1.1 . . . . 0.0 108.674 -169.601 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 7.5 ttm180 . . . . . 0 CA--C 1.548 0.884 0 C-N-CA 123.666 0.786 . . . . 0.0 112.025 175.903 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.736 0 N-CA-C 114.115 1.154 . . . . 0.0 114.115 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 pp -60.96 -33.86 73.86 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 116.827 2.158 . . . . 0.0 116.827 -167.314 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.01 -30.21 62.33 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 121.048 1.749 . . . . 0.0 112.404 174.0 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -57.57 -51.23 70.34 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.369 0.986 . . . . 0.0 109.69 171.305 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -58.9 -63.36 1.32 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.827 0.851 . . . . 0.0 109.563 175.797 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -59.98 -40.84 97.49 Favored Glycine 0 C--O 1.219 -0.825 0 CA-C-O 117.64 -1.644 . . . . 0.0 112.831 -169.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -87.07 -12.31 47.59 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 120.212 2.006 . . . . 0.0 114.085 -179.428 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -86.95 -31.56 20.59 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.773 1.17 . . . . 0.0 111.467 168.103 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.6 mp -83.77 -19.12 35.64 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.616 0.766 . . . . 0.0 111.207 171.899 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.16 63.73 1.89 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.29 1.836 . . . . 0.0 110.597 167.713 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -144.22 137.39 13.96 Favored Pre-proline 0 CA--C 1.547 0.841 0 N-CA-C 104.19 -2.522 . . . . 0.0 104.19 167.831 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . 0.406 ' HG2' ' H ' ' B' ' 22' ' ' THR . 57.1 Cg_endo -52.13 -77.42 0.02 OUTLIER 'Trans proline' 0 CA--C 1.548 1.183 1 C-N-CA 125.816 4.344 . . . . 0.0 112.703 -175.853 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.406 ' H ' ' HG2' ' B' ' 21' ' ' PRO . 2.0 p -41.19 -49.89 3.56 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 129.605 3.162 . . . . 0.0 112.586 168.251 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 37.6 ttt180 -72.95 -34.83 66.77 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.12 0.968 . . . . 0.0 111.979 -168.076 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 46.8 t -63.09 -51.48 66.46 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.19 0.905 . . . . 0.0 109.802 167.595 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -57.99 -35.01 70.61 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.034 1.334 . . . . 0.0 112.364 178.729 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . 0.402 HD13 HD11 ' B' ' 44' ' ' LEU . 5.3 mm -56.1 -61.87 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 125.629 1.571 . . . . 0.0 108.644 169.085 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 82.1 mt -64.36 -40.2 95.37 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.585 0.754 . . . . 0.0 111.997 -169.366 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 8.6 p -70.96 -23.97 24.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 177.311 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . 0.544 ' HB1' ' CD2' ' B' ' 43' ' ' HIS . . . -92.38 -21.0 20.47 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 175.32 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.469 ' O ' HG13 ' B' ' 34' ' ' VAL . 11.6 mt -58.2 -46.37 85.95 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.112 -0.993 . . . . 0.0 110.021 168.664 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.7 mt -44.66 -36.62 3.19 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 129.355 3.062 . . . . 0.0 114.484 175.193 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -100.01 -18.79 16.86 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.276 1.831 . . . . 0.0 112.751 -177.963 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -108.32 -66.97 0.6 Allowed Glycine 0 C--N 1.341 0.861 0 C-N-CA 125.203 1.382 . . . . 0.0 115.033 -170.509 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . 0.469 HG13 ' O ' ' B' ' 30' ' ' LEU . 15.7 m 34.3 36.1 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 C-N-CA 127.069 2.147 . . . . 0.0 115.815 -169.182 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 72.7 m -85.02 -72.63 0.47 Allowed 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.066 0.947 . . . . 0.0 112.68 -176.587 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -148.29 153.08 40.41 Favored Pre-proline 0 N--CA 1.474 0.769 0 CA-C-O 117.767 -1.111 . . . . 0.0 112.306 -169.932 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -54.39 -31.31 67.44 Favored 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 123.127 2.551 . . . . 0.0 113.783 -178.063 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -84.46 -7.04 85.25 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-O 117.868 -1.518 . . . . 0.0 115.301 175.53 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.09 -30.4 70.9 Favored 'General case' 0 C--N 1.347 0.498 0 CA-C-N 120.534 2.167 . . . . 0.0 112.224 -170.704 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.4 mt -67.09 -13.33 61.83 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 119.082 -0.485 . . . . 0.0 111.567 -175.444 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.63 -31.71 66.53 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.286 0.948 . . . . 0.0 112.358 171.473 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -78.84 -48.91 13.83 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.312 0.645 . . . . 0.0 111.422 171.533 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . 0.544 ' CD2' ' HB1' ' B' ' 29' ' ' ALA . 5.5 m-70 -55.05 -32.38 61.84 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.731 HD12 HG22 ' B' ' 51' ' ' VAL . 67.0 mt -104.16 -23.43 13.27 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.751 1.62 . . . . 0.0 112.095 -176.077 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.65 8.63 72.6 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 124.271 0.938 . . . . 0.0 113.402 -169.073 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 92.0 mt -111.1 148.95 31.56 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 125.48 1.512 . . . . 0.0 110.674 -170.554 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.3 t -59.57 150.79 26.18 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -177.862 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -21.77 64.72 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 -174.993 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 9.4 m -73.7 -41.26 62.85 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 120.952 -1.093 . . . . 0.0 112.526 169.164 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -68.82 -39.72 79.89 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.599 0.76 . . . . 0.0 110.955 174.781 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . 0.731 HG22 HD12 ' B' ' 44' ' ' LEU . 43.7 t -54.3 -50.46 56.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.896 0.878 . . . . 0.0 109.725 167.09 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 68.6 m -60.56 -40.38 91.44 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 -178.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -53.99 -50.56 66.29 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.265 1.026 . . . . 0.0 112.217 -178.788 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 73.1 m-70 -79.04 -10.91 59.96 Favored 'General case' 0 CA--C 1.552 1.025 0 O-C-N 120.847 -1.158 . . . . 0.0 114.044 175.865 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 81.2 mt -80.26 -28.84 38.35 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 120.592 1.542 . . . . 0.0 111.651 167.422 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 68.9 m -53.74 -46.1 70.76 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 117.754 -1.117 . . . . 0.0 113.064 -176.65 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 4.0 t -72.16 -44.5 62.98 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.803 1.183 . . . . 0.0 109.579 176.91 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 3.6 tp -50.82 -38.23 47.52 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.873 2.469 . . . . 0.0 114.572 -173.26 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 47.3 mtp180 -80.74 -9.93 59.77 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.318 1.847 . . . . 0.0 112.604 -179.785 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -105.68 -32.93 3.71 Favored Glycine 0 CA--C 1.539 1.592 0 C-N-CA 127.166 2.317 . . . . 0.0 113.825 169.212 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 86.9 m -55.72 -27.68 51.76 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 126.389 1.876 . . . . 0.0 112.052 169.387 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.95 25.17 58.47 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 126.089 1.804 . . . . 0.0 112.488 -173.398 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 91.4 mt -86.83 -25.32 24.61 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.19 1.495 . . . . 0.0 113.279 175.562 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 2.1 m -127.61 131.85 69.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 124.772 1.229 . . . . 0.0 112.544 179.074 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 49.6 t -121.0 136.48 57.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.493 1.517 . . . . 0.0 109.83 -179.863 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.06 155.73 28.67 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.13 1.372 . . . . 0.0 113.35 170.571 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 87.3 m -155.15 151.55 28.38 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.853 1.661 . . . . 0.0 107.435 178.728 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 10.2 m-85 -76.84 150.58 36.08 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.792 0.723 . . . . 0.0 112.25 173.886 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -125.12 170.76 10.89 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 127.001 2.12 . . . . 0.0 112.377 178.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -67.46 78.86 0.17 Allowed Glycine 0 CA--C 1.528 0.846 0 C-N-CA 125.221 1.391 . . . . 0.0 112.209 177.16 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 93.62 17.43 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 129.418 3.087 . . . . 0.0 112.359 178.802 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -157.07 -179.67 8.43 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.806 1.242 . . . . 0.0 109.974 -176.727 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 27.2 m -117.68 158.61 18.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.122 0.969 . . . . 0.0 109.328 166.608 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -131.83 176.93 7.93 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 124.851 1.26 . . . . 0.0 110.653 -175.082 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -136.34 153.88 51.01 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 125.193 1.397 . . . . 0.0 109.236 170.607 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -157.3 154.91 29.81 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 124.278 1.031 . . . . 0.0 110.871 -172.742 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -50.71 129.47 22.87 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.02 1.328 . . . . 0.0 107.581 168.362 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.18 -38.89 74.28 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 -169.563 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -151.13 163.68 38.25 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 123.1 1.428 . . . . 0.0 111.775 174.892 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -36.53 -36.79 0.11 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 129.761 3.225 . . . . 0.0 111.603 165.867 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -47.75 -63.94 0.92 Allowed 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.198 1.799 . . . . 0.0 112.468 169.835 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 9.4 mt -71.59 -38.74 70.85 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.201 0.91 . . . . 0.0 110.369 -177.828 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.73 -47.13 77.45 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.307 0.643 . . . . 0.0 112.198 177.538 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 4.8 ppt_? -71.58 -47.54 54.14 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 117.868 -1.063 . . . . 0.0 111.589 178.706 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -54.62 -44.23 72.95 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.484 1.038 . . . . 0.0 113.387 176.776 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.82 -40.05 66.13 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.451 -0.781 . . . . 0.0 111.804 177.003 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -74.34 -36.38 50.22 Favored Glycine 0 CA--C 1.537 1.446 0 C-N-CA 124.935 1.255 . . . . 0.0 114.348 -174.727 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -74.01 -5.38 41.04 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 118.632 1.216 . . . . 0.0 112.548 169.855 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 50.3 tp 72.27 112.56 0.06 Allowed 'General case' 0 C--N 1.343 0.303 0 C-N-CA 129.582 3.153 . . . . 0.0 112.751 166.891 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.6 t -70.93 23.8 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 127.272 2.229 . . . . 0.0 113.186 -175.38 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 84.78 -14.89 0.58 Allowed 'General case' 0 N--CA 1.472 0.656 0 O-C-N 119.726 -1.859 . . . . 0.0 114.314 121.697 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.425 HG13 ' O ' ' B' ' 92' ' ' VAL . 8.1 p -64.34 49.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 130.492 3.517 . . . . 0.0 112.058 167.741 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 63.38 13.41 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 126.682 1.993 . . . . 0.0 114.306 -176.388 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 tt 100.73 108.35 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 130.004 3.322 . . . . 0.0 107.686 -169.519 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.97 67.93 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 125.226 1.41 . . . . 0.0 113.022 171.181 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 12.4 t -69.73 144.73 13.64 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 124.974 1.309 . . . . 0.0 109.418 172.441 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -76.07 18.36 0.28 Allowed 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 115.024 1.491 . . . . 0.0 115.024 177.684 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.31 45.81 0.58 Allowed 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 164.884 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -57.96 131.52 50.68 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 125.025 1.33 . . . . 0.0 110.728 -163.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -139.22 139.02 21.73 Favored Pre-proline 0 CA--C 1.556 1.191 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.905 -161.751 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.3 151.62 72.63 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 125.132 3.888 . . . . 0.0 119.656 -163.369 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 1.5 t -88.33 164.98 15.3 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 129.224 3.009 . . . . 0.0 112.182 169.378 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 26.3 t 88.44 138.83 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 129.15 2.98 . . . . 0.0 108.757 179.297 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -74.67 69.28 1.75 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 126.154 1.782 . . . . 0.0 113.765 -174.456 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -62.03 132.82 54.17 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.652 168.893 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 8.2 tmm_? . . . . . 0 CA--C 1.551 0.998 0 C-N-CA 124.485 1.114 . . . . 0.0 112.905 175.702 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.252 0 N-CA-C 111.833 0.308 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.8 mt -46.43 -63.22 1.06 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.576 1.15 . . . . 0.0 112.422 -179.205 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.23 9.94 4.11 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -178.472 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.42 -35.26 6.82 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.378 0.671 . . . . 0.0 111.781 167.339 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -61.05 -51.92 67.16 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.213 1.405 . . . . 0.0 110.254 176.921 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.67 -23.83 69.2 Favored Glycine 0 CA--C 1.534 1.255 0 O-C-N 121.136 -0.977 . . . . 0.0 113.058 173.489 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.18 -33.62 65.52 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 118.872 1.336 . . . . 0.0 110.761 172.714 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -79.99 -34.46 38.54 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.637 1.175 . . . . 0.0 113.542 177.846 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 mt -63.82 -41.88 97.76 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.705 0.802 . . . . 0.0 112.486 174.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -94.28 -10.01 34.2 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -173.474 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.429 ' CG ' ' HD2' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -51.76 147.22 12.14 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.006 1.722 . . . . 0.0 111.344 -178.845 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.429 ' HD2' ' CG ' ' A' ' 20' ' ' ASP . 55.8 Cg_endo -35.57 -79.13 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.709 1 C-N-CA 127.864 5.71 . . . . 0.0 113.112 -166.804 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.9 p -81.24 -22.26 38.89 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-O 116.42 -1.752 . . . . 0.0 113.23 178.385 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.4 mtm-85 -63.33 -45.6 90.55 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 121.531 1.968 . . . . 0.0 111.67 175.98 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 25.1 t -50.8 -48.63 59.51 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 119.611 1.096 . . . . 0.0 110.749 169.545 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.1 mtm-85 -62.41 -47.75 82.72 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.467 1.107 . . . . 0.0 113.521 176.997 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.1 mm -53.13 -47.11 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 125.613 1.565 . . . . 0.0 110.863 170.319 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.567 HD22 HD21 ' A' ' 77' ' ' LEU . 48.8 mt -70.15 -43.02 71.74 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 117.746 -1.121 . . . . 0.0 112.769 -177.711 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.4 p -73.0 -25.99 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 CA-C-N 119.95 1.25 . . . . 0.0 111.195 179.21 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.49 -12.95 59.48 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.743 1.217 . . . . 0.0 113.014 169.473 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.496 ' O ' HG13 ' A' ' 34' ' ' VAL . 13.1 tp -82.42 -36.49 26.61 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 116.948 -1.501 . . . . 0.0 112.139 169.223 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -43.48 -58.17 2.73 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.005 2.122 . . . . 0.0 112.881 -175.463 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -98.22 9.28 43.33 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.662 1.585 . . . . 0.0 112.403 172.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -108.54 -33.89 2.79 Favored Glycine 0 C--N 1.342 0.865 0 CA-C-O 114.585 -3.342 . . . . 0.0 117.92 -168.344 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.496 HG13 ' O ' ' A' ' 30' ' ' LEU . 33.9 m -15.59 43.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.069 2 C-N-CA 132.251 4.22 . . . . 0.0 122.122 175.801 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.8 m -95.78 -60.39 1.66 Allowed 'General case' 0 C--N 1.327 -0.386 0 O-C-N 118.763 -2.461 . . . . 0.0 111.514 178.205 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -146.41 151.55 43.9 Favored Pre-proline 0 N--CA 1.476 0.845 0 N-CA-C 116.633 2.086 . . . . 0.0 116.633 -169.214 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -63.83 133.1 37.45 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 123.479 2.786 . . . . 0.0 110.744 178.321 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.5 -2.62 52.52 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-O 118.753 -1.026 . . . . 0.0 114.444 -176.882 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -58.52 -28.91 65.88 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.344 1.572 . . . . 0.0 112.882 179.272 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mp -69.25 -2.52 10.81 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 122.481 0.312 . . . . 0.0 111.499 -172.067 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.99 -38.16 90.05 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.13 0.572 . . . . 0.0 110.541 169.091 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.94 -36.06 64.63 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.441 0.697 . . . . 0.0 111.999 170.708 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -66.73 -36.52 82.67 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 177.301 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.1 mt -105.03 -20.72 13.44 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -172.563 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.79 11.22 83.49 Favored Glycine 0 CA--C 1.537 1.416 0 CA-C-N 119.46 1.027 . . . . 0.0 113.091 -168.451 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.5 mt -100.75 148.18 25.19 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.697 1.199 . . . . 0.0 111.46 -176.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.435 HG23 ' H ' ' A' ' 50' ' ' ASN . 4.2 t -61.15 144.04 54.38 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 122.16 0.981 . . . . 0.0 111.891 -172.84 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.78 -20.15 54.91 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.222 1.009 . . . . 0.0 113.589 179.468 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.5 p -70.78 -60.12 2.42 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.442 1.019 . . . . 0.0 109.414 167.083 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.435 ' H ' HG23 ' A' ' 47' ' ' THR . 18.5 t-20 -54.32 -42.08 69.76 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.71 1.604 . . . . 0.0 114.684 178.481 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 5.0 t -64.32 -41.21 91.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 O-C-N 119.876 -1.765 . . . . 0.0 111.813 171.898 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 55.0 m -62.45 -43.36 99.01 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 119.159 0.89 . . . . 0.0 112.071 173.612 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -55.74 -45.36 78.02 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 127.004 2.121 . . . . 0.0 112.261 175.678 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 23.6 m170 -64.33 -40.51 96.04 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 121.149 -0.969 . . . . 0.0 112.863 171.693 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 12.6 mt -67.36 -25.32 65.92 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 118.691 0.678 . . . . 0.0 112.349 178.068 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.3 m -62.08 -44.76 95.97 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.213 1.37 . . . . 0.0 114.364 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 42.8 t -60.37 -54.0 50.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.975 1.31 . . . . 0.0 110.482 169.508 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.437 ' HG ' HD21 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -51.22 -42.59 61.06 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 128.535 2.734 . . . . 0.0 113.677 -177.668 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 9.1 mtm-85 -83.26 -4.4 58.39 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.538 1.535 . . . . 0.0 113.143 178.802 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -110.05 -26.31 5.0 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 126.236 1.874 . . . . 0.0 114.107 174.092 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 2.6 m -74.51 -1.46 21.44 Favored 'General case' 0 CA--C 1.564 1.504 0 C-N-CA 129.928 3.291 . . . . 0.0 111.724 168.86 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 60.82 14.45 37.37 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 126.184 1.849 . . . . 0.0 113.571 -175.122 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.9 mt -69.07 -30.23 68.51 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.458 -1.025 . . . . 0.0 111.676 172.777 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.8 t -134.43 132.44 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.902 0.881 . . . . 0.0 112.814 -167.472 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 89.0 t -126.61 141.13 46.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 126.058 1.743 . . . . 0.0 111.098 -168.074 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -93.68 148.7 21.86 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.202 1.401 . . . . 0.0 113.045 173.99 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.8 m -169.61 152.77 4.78 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.649 1.98 . . . . 0.0 107.119 -175.713 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -79.91 141.42 36.1 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 119.853 1.206 . . . . 0.0 112.895 174.788 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.263 0.0 OUTLIER -89.47 -17.94 27.7 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 122.603 0.361 . . . . 0.0 111.444 166.588 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 123.0 -30.26 5.1 Favored Glycine 0 N--CA 1.474 1.208 0 C-N-CA 126.592 2.044 . . . . 0.0 114.24 169.444 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.38 -15.96 14.88 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 128.226 2.611 . . . . 0.0 112.08 172.919 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -158.6 167.0 30.75 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 129.397 3.079 . . . . 0.0 109.469 -176.256 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 6.0 p -91.96 150.62 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.221 1.009 . . . . 0.0 109.908 168.543 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 12.3 ptt85 -126.49 163.93 22.28 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.95 0.881 . . . . 0.0 111.405 -176.422 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -111.28 156.41 21.55 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 114.294 -1.321 . . . . 0.0 107.584 164.519 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.474 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -163.19 151.22 13.57 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.143 0.977 . . . . 0.0 109.902 -176.413 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.567 HD21 HD22 ' A' ' 27' ' ' LEU . 14.5 mt -57.44 152.14 15.11 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 119.009 0.822 . . . . 0.0 109.02 167.314 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.14 -33.11 73.87 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 114.764 1.394 . . . . 0.0 114.764 -170.065 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -169.85 163.21 9.66 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.396 1.478 . . . . 0.0 112.684 -174.243 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 98.3 p -42.69 -33.81 0.79 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 128.491 2.717 . . . . 0.0 114.34 166.931 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -52.98 -52.09 59.42 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.864 1.666 . . . . 0.0 112.25 170.494 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 35.2 mt -73.0 -39.66 65.85 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 118.934 -0.555 . . . . 0.0 109.794 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -54.46 -44.52 72.61 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.441 1.096 . . . . 0.0 113.295 178.905 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -65.71 -49.8 67.18 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 120.007 1.276 . . . . 0.0 112.615 178.865 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.81 -44.99 83.98 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.46 1.027 . . . . 0.0 112.471 -179.46 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -64.84 -37.88 89.09 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.879 0.872 . . . . 0.0 110.714 176.605 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.9 -22.06 64.11 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 126.118 1.818 . . . . 0.0 114.102 176.996 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -115.75 23.5 12.25 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.129 1.372 . . . . 0.0 112.659 170.098 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.536 ' O ' HG13 ' A' ' 90' ' ' VAL . 30.6 tp 76.53 -38.85 0.33 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 128.969 2.908 . . . . 0.0 112.92 171.205 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.536 HG13 ' O ' ' A' ' 89' ' ' LEU . 2.6 m 160.96 -19.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.262 1 C-N-CA 132.312 4.245 . . . . 0.0 111.207 -170.389 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 93.59 -8.18 0.14 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 129.486 3.115 . . . . 0.0 113.533 175.96 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.1 p -66.85 41.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 C-N-CA 128.105 2.562 . . . . 0.0 116.646 -172.339 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER 71.09 13.5 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 C-N-CA 126.56 1.944 . . . . 0.0 112.371 174.138 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 88.91 95.13 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 130.111 3.364 . . . . 0.0 108.883 179.521 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.4 139.8 49.88 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.155 179.156 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 27.4 m -85.34 152.87 3.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 122.378 1.085 . . . . 0.0 111.492 179.239 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -79.84 12.35 2.72 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.472 1.509 . . . . 0.0 114.925 -168.749 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.9 m -104.29 47.35 0.88 Allowed 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.587 1.555 . . . . 0.0 109.863 -176.243 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -49.93 88.57 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 129.123 2.969 . . . . 0.0 113.14 -167.734 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -106.96 152.88 41.11 Favored Pre-proline 0 CA--C 1.54 0.58 0 N-CA-C 113.998 1.111 . . . . 0.0 113.998 -164.985 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -88.58 117.94 0.98 Allowed 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 122.087 1.858 . . . . 0.0 113.746 -175.24 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . 0.558 3.3 t 43.17 -179.18 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 111.344 -2.662 . . . . 0.0 113.854 -161.302 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 3.6 p -169.38 -16.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 CA-C-N 110.531 -3.031 . . . . 0.0 112.701 -155.855 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.48 110.26 7.64 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 166.037 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 81.85 -43.51 0.16 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.849 2.06 . . . . 0.0 112.338 177.082 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.545 0.76 0 C-N-CA 125.457 1.503 . . . . 0.0 113.945 -173.274 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.724 0 N-CA-C 116.154 1.909 . . . . 0.0 116.154 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 87.8 mt -119.73 -82.6 0.65 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.797 1.639 . . . . 0.0 109.18 171.712 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.28 -4.24 13.59 Favored 'General case' 0 CA--C 1.549 0.904 0 O-C-N 120.71 -1.244 . . . . 0.0 114.104 172.525 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.74 -43.74 13.11 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 120.597 -1.314 . . . . 0.0 109.038 163.078 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.12 -49.1 73.51 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 126.148 1.779 . . . . 0.0 111.21 -174.539 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -67.56 -7.27 46.34 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 123.866 0.746 . . . . 0.0 114.443 172.618 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.38 -45.22 9.63 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.158 1.383 . . . . 0.0 108.75 168.143 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.16 -42.35 76.03 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.187 1.795 . . . . 0.0 114.446 -176.867 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -39.54 94.49 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.147 0.979 . . . . 0.0 111.29 178.59 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -98.37 -2.99 37.97 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.929 1.291 . . . . 0.0 114.449 -173.415 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.481 ' CG ' ' HD2' ' B' ' 21' ' ' PRO . 0.3 OUTLIER -55.12 147.72 33.45 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 125.623 1.569 . . . . 0.0 112.525 177.882 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . 0.481 ' HD2' ' CG ' ' B' ' 20' ' ' ASP . 41.0 Cg_endo -37.66 -69.89 0.07 OUTLIER 'Trans proline' 0 C--N 1.354 0.824 1 C-N-CA 127.416 5.411 . . . . 0.0 113.407 -167.629 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.407 ' H ' ' HG2' ' B' ' 21' ' ' PRO . 2.2 p -90.65 -20.7 22.22 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 125.863 1.665 . . . . 0.0 112.95 179.731 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 9.3 mtm-85 -66.34 -42.85 87.56 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 121.493 1.951 . . . . 0.0 111.848 177.266 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 40.5 t -54.61 -49.67 69.91 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.36 0.982 . . . . 0.0 110.97 169.88 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -58.05 -54.23 49.34 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.157 0.983 . . . . 0.0 112.65 177.178 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 4.4 mm -45.76 -54.02 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 126.221 1.808 . . . . 0.0 111.175 169.87 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.592 HD22 HD21 ' B' ' 77' ' ' LEU . 42.5 mt -68.3 -37.44 80.61 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 117.806 -1.093 . . . . 0.0 113.434 -173.72 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.1 p -76.2 -27.4 17.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 CA-C-N 119.731 1.151 . . . . 0.0 111.434 176.961 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.97 -23.06 52.34 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.107 0.963 . . . . 0.0 112.858 173.075 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.435 ' O ' HG13 ' B' ' 34' ' ' VAL . 5.5 tp -73.5 -33.51 64.83 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 119.807 1.185 . . . . 0.0 113.76 171.187 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -45.52 -54.51 7.4 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.03 2.132 . . . . 0.0 113.299 -168.781 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -97.2 -11.42 24.26 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.415 1.486 . . . . 0.0 112.138 169.507 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -97.61 2.51 60.61 Favored Glycine 0 C--N 1.342 0.889 0 CA-C-O 116.64 -2.2 . . . . 0.0 118.235 -167.907 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . 0.435 HG13 ' O ' ' B' ' 30' ' ' LEU . 29.7 m -38.49 40.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.059 1 C-N-CA 131.81 4.044 . . . . 0.0 119.014 167.537 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 51.2 m -83.78 -74.5 0.37 Allowed 'General case' 0 C--O 1.223 -0.318 0 O-C-N 119.713 -1.867 . . . . 0.0 111.309 179.173 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.51 163.39 50.21 Favored Pre-proline 0 CA--C 1.547 0.829 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -169.889 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -63.1 130.18 28.12 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.158 1.906 . . . . 0.0 110.104 178.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.35 5.62 67.59 Favored Glycine 0 CA--C 1.538 1.49 0 CA-C-O 118.133 -1.371 . . . . 0.0 115.708 -178.304 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.6 -25.2 64.43 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 120.124 1.962 . . . . 0.0 113.24 -177.457 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.8 mt -52.96 -20.1 3.13 Favored 'General case' 0 C--O 1.222 -0.358 0 C-N-CA 125.946 1.698 . . . . 0.0 112.01 176.712 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.36 -30.44 70.53 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.312 0.645 . . . . 0.0 112.532 177.738 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.99 -50.82 11.38 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.39 0.676 . . . . 0.0 110.791 169.43 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -55.37 -38.38 68.76 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 -177.798 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.2 mt -96.83 -19.65 18.73 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.707 1.603 . . . . 0.0 112.756 -177.125 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.07 11.66 67.32 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-N 119.205 0.911 . . . . 0.0 113.2 -168.997 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 97.0 mt -102.13 141.11 35.5 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.115 1.366 . . . . 0.0 110.973 -174.276 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.401 HG23 ' H ' ' B' ' 50' ' ' ASN . 4.0 t -57.69 143.09 42.94 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.158 0.98 . . . . 0.0 112.186 -171.23 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.94 -19.13 39.96 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.755 1.222 . . . . 0.0 113.634 -179.463 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 7.5 p -72.29 -62.8 1.31 Allowed 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 119.656 1.116 . . . . 0.0 109.255 166.904 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . 0.401 ' H ' HG23 ' B' ' 47' ' ' THR . 10.1 t-20 -46.99 -46.84 21.95 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.433 1.493 . . . . 0.0 113.658 176.091 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.87 -40.52 89.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 O-C-N 120.474 -1.391 . . . . 0.0 112.661 175.507 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.0 m -66.74 -37.81 85.38 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 118.588 0.631 . . . . 0.0 111.645 176.156 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 9.5 m-20 -58.96 -45.03 91.51 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.0 1.72 . . . . 0.0 112.19 173.322 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -64.63 -40.93 96.33 Favored 'General case' 0 CA--C 1.548 0.872 0 O-C-N 120.403 -1.435 . . . . 0.0 112.967 172.129 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 49.6 mt -67.3 -31.32 71.53 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 179.291 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 37.6 m -61.22 -28.11 68.92 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -178.569 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 47.8 t -71.36 -51.31 24.89 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.075 0.95 . . . . 0.0 110.747 169.379 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.412 ' HB3' HG22 ' B' ' 64' ' ' VAL . 4.5 mp -63.43 -40.3 96.81 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.389 2.275 . . . . 0.0 112.746 -171.957 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 60.7 mtm-85 -75.06 -5.7 45.53 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.593 1.157 . . . . 0.0 112.965 174.321 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -104.53 -38.07 2.68 Favored Glycine 0 N--CA 1.472 1.07 0 C-N-CA 124.718 1.151 . . . . 0.0 112.146 171.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 7.3 m -61.51 -6.94 2.69 Favored 'General case' 0 CA--C 1.56 1.353 0 C-N-CA 128.349 2.66 . . . . 0.0 113.409 169.471 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 67.02 13.66 62.21 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 125.217 1.389 . . . . 0.0 113.716 -175.561 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 83.6 mt -70.94 -26.12 63.04 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.593 1.196 . . . . 0.0 112.632 178.003 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.412 HG22 ' HB3' ' B' ' 58' ' ' LEU . 2.6 m -141.41 142.8 28.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.353 1.461 . . . . 0.0 111.558 -174.595 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 68.9 t -122.83 140.19 47.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 127.433 2.293 . . . . 0.0 109.253 -174.335 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -92.97 146.5 23.57 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.343 1.057 . . . . 0.0 112.425 170.126 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 2.4 m -167.47 168.42 12.97 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.079 2.151 . . . . 0.0 107.534 -172.888 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.44 ' HA ' ' HA ' ' B' ' 73' ' ' VAL . 13.0 m-85 -81.19 155.35 26.2 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 174.746 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.04 -26.58 14.19 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.629 0.772 . . . . 0.0 109.144 162.28 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 141.19 -31.74 2.14 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 127.575 2.512 . . . . 0.0 113.738 171.412 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.58 -18.9 11.82 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 129.518 3.127 . . . . 0.0 112.503 178.604 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -150.72 167.71 26.55 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 129.696 3.198 . . . . 0.0 109.026 -179.576 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . 0.44 ' HA ' ' HA ' ' B' ' 68' ' ' TYR . 14.3 m -85.1 165.31 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 O-C-N 121.666 -0.646 . . . . 0.0 111.087 167.544 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 21.6 ptt85 -138.11 167.91 20.82 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 127.07 2.148 . . . . 0.0 109.872 -179.438 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -119.02 133.03 56.07 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.738 1.215 . . . . 0.0 108.326 168.167 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.432 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -136.25 151.25 49.47 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.479 1.112 . . . . 0.0 109.82 179.097 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.592 HD21 HD22 ' B' ' 27' ' ' LEU . 13.0 mt -55.5 149.0 14.32 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 168.735 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.43 -36.59 82.89 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -169.903 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -162.34 163.37 27.95 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.624 1.57 . . . . 0.0 112.23 178.366 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 95.6 p -44.22 -32.47 1.27 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.109 2.564 . . . . 0.0 113.546 167.643 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -52.89 -49.71 65.34 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 125.245 1.418 . . . . 0.0 112.507 170.512 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 21.4 mt -72.47 -46.94 52.48 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.964 0.802 . . . . 0.0 109.636 179.11 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.17 -40.2 64.18 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 117.776 -1.107 . . . . 0.0 113.738 -177.041 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -69.48 -47.35 64.18 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 120.408 1.458 . . . . 0.0 113.385 178.248 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.1 -43.26 95.89 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 118.928 0.785 . . . . 0.0 111.192 -179.267 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.54 -52.3 64.18 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.776 1.63 . . . . 0.0 110.374 170.919 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.94 -14.03 58.1 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.812 1.196 . . . . 0.0 114.567 -176.048 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . 0.257 20.7 pt-20 -114.91 18.48 16.42 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 169.876 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 21.4 tp 63.66 2.12 1.2 Allowed 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 128.522 2.729 . . . . 0.0 115.361 167.269 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 1.7 t 74.31 33.47 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 126.586 1.954 . . . . 0.0 110.37 -171.511 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . 0.405 ' C ' ' H ' ' B' ' 93' ' ' VAL . 0.8 OUTLIER 81.68 -14.07 0.83 Allowed 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 115.241 1.571 . . . . 0.0 115.241 118.417 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 13.1 p -67.46 39.09 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 129.558 3.143 . . . . 0.0 113.415 174.103 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . 0.405 ' H ' ' C ' ' B' ' 91' ' ' GLN . 0.2 OUTLIER 72.44 26.67 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 128.063 2.545 . . . . 0.0 113.182 177.001 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 84.36 90.15 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 126.77 2.028 . . . . 0.0 109.368 -177.724 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.47 149.52 45.89 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 114.521 -1.218 . . . . 0.0 113.421 178.517 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 30.2 m -56.91 156.05 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 125.625 1.57 . . . . 0.0 113.88 176.301 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -83.16 64.22 7.58 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.54 1.136 . . . . 0.0 109.927 169.87 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 41.8 m -160.09 148.09 16.77 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.579 1.551 . . . . 0.0 111.084 -174.062 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -116.8 137.82 51.93 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.831 1.652 . . . . 0.0 107.44 166.222 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -160.95 170.49 8.36 Favored Pre-proline 0 CA--C 1.557 1.233 0 CA-C-O 117.386 -1.292 . . . . 0.0 111.38 -167.566 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -95.36 120.22 0.26 Allowed 'Trans proline' 0 C--N 1.358 1.064 0 CA-C-N 122.315 1.863 . . . . 0.0 116.549 -167.27 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 28.7 t 45.68 -113.03 0.38 Allowed 'General case' 0 C--N 1.347 0.489 0 N-CA-C 105.279 -2.119 . . . . 0.0 105.279 -163.703 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 5.4 p 165.71 -33.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.843 0 C-N-CA 130.313 3.445 . . . . 0.0 111.758 168.758 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.42 123.73 15.71 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.29 0.95 . . . . 0.0 111.077 178.376 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 69.2 -49.21 0.6 Allowed 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 128.681 2.792 . . . . 0.0 113.019 -174.156 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.656 0 CA-C-O 123.157 1.456 . . . . 0.0 113.711 -170.001 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.351 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.71 -38.2 66.77 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.596 0.759 . . . . 0.0 111.317 168.801 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.79 -18.22 60.5 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.281 1.832 . . . . 0.0 113.946 179.504 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.31 -57.23 3.46 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.464 1.105 . . . . 0.0 109.195 167.402 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -55.25 -63.53 1.13 Allowed 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 126.645 1.978 . . . . 0.0 110.331 -174.225 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -60.81 -36.21 91.5 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.641 -0.583 . . . . 0.0 111.641 -172.281 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 16.3 ttt85 -67.33 -50.97 57.88 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.839 0.856 . . . . 0.0 111.226 179.761 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.85 -27.02 67.79 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 176.641 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.4 mp -90.98 -12.47 35.81 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.447 1.099 . . . . 0.0 113.567 174.282 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.56 -20.15 40.52 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.7 1.2 . . . . 0.0 114.058 169.888 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -72.63 140.41 81.57 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 126.835 2.054 . . . . 0.0 109.424 174.261 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -53.03 -84.89 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.647 1 C-N-CA 126.696 4.931 . . . . 0.0 113.738 -166.621 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 52.1 m -70.3 -15.43 62.89 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 124.551 1.141 . . . . 0.0 111.134 -179.701 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 12.2 ttm180 -68.63 -40.2 80.42 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 120.378 -1.452 . . . . 0.0 113.312 -177.854 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 13.2 t -59.28 -40.21 85.38 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 121.806 0.812 . . . . 0.0 110.806 169.432 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.484 ' HB3' HD22 ' A' ' 44' ' ' LEU . 12.4 mmp_? -66.64 -41.27 88.54 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 172.879 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.424 HD11 ' HA ' ' A' ' 51' ' ' VAL . 5.1 mm -50.63 -44.38 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 120.077 -1.639 . . . . 0.0 111.412 171.328 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.26 -24.95 67.46 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 175.28 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -78.66 -29.51 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 124.77 1.228 . . . . 0.0 112.729 171.25 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.89 -32.46 63.6 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.494 0.717 . . . . 0.0 112.717 178.855 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.471 HD23 HG11 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -85.92 -10.42 55.26 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 173.226 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.07 -23.52 63.83 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-O 119.505 -0.283 . . . . 0.0 111.401 165.622 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -124.19 -59.52 1.48 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 127.768 2.427 . . . . 0.0 114.564 -171.92 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.05 -74.77 0.63 Allowed Glycine 0 N--CA 1.468 0.818 0 C-N-CA 125.354 1.455 . . . . 0.0 113.226 -165.86 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.9 m 45.88 33.66 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 C-N-CA 125.851 1.66 . . . . 0.0 113.815 -179.001 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.2 m -82.61 -51.63 7.57 Favored 'General case' 0 C--O 1.226 -0.157 0 O-C-N 120.932 -1.105 . . . . 0.0 112.046 -175.56 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 50.3 p90 -165.69 157.2 12.42 Favored Pre-proline 0 N--CA 1.477 0.894 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -169.78 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -61.73 104.43 0.32 Allowed 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 123.868 3.045 . . . . 0.0 110.128 173.937 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 113.86 -11.5 22.87 Favored Glycine 0 CA--C 1.529 0.961 0 CA-C-O 118.021 -1.433 . . . . 0.0 114.651 -175.01 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.72 -34.08 69.11 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 120.651 2.226 . . . . 0.0 111.349 175.079 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.688 HD12 ' H ' ' A' ' 40' ' ' LEU . 0.5 OUTLIER -62.8 -21.06 65.61 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 126.22 1.808 . . . . 0.0 111.985 -178.317 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.19 -30.02 69.02 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.431 0.692 . . . . 0.0 111.786 -179.581 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.37 -44.85 61.97 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.527 0.331 . . . . 0.0 110.344 169.87 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -62.59 -35.53 79.82 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -179.174 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.484 HD22 ' HB3' ' A' ' 25' ' ' ARG . 26.0 mt -103.27 -16.38 15.69 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -174.363 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.56 -2.08 54.99 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-O 118.072 -1.404 . . . . 0.0 114.341 -175.409 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 mp -105.6 148.43 27.32 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.561 1.68 . . . . 0.0 110.947 177.23 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.444 HG23 ' H ' ' A' ' 50' ' ' ASN . 13.5 t -54.83 151.24 8.77 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.356 1.063 . . . . 0.0 113.005 -173.252 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -50.13 -23.25 2.04 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.054 1.741 . . . . 0.0 113.839 169.498 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 14.7 m -69.22 -56.99 5.96 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.461 1.028 . . . . 0.0 111.85 170.395 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.444 ' H ' HG23 ' A' ' 47' ' ' THR . 16.0 t-20 -61.9 -42.85 99.56 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.461 1.028 . . . . 0.0 112.074 176.113 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.424 ' HA ' HD11 ' A' ' 26' ' ' ILE . 2.5 t -53.26 -48.16 55.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 123.834 0.854 . . . . 0.0 111.166 172.01 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 51.1 m -66.26 -35.96 81.75 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 177.559 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -60.4 -52.46 65.13 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.006 0.922 . . . . 0.0 110.097 176.579 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -68.36 -27.38 66.2 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 120.332 -1.48 . . . . 0.0 113.777 176.648 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 36.4 mt -70.42 -20.86 62.89 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 120.378 1.444 . . . . 0.0 113.311 167.862 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.2 t -63.19 -51.81 64.86 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 120.189 1.359 . . . . 0.0 112.973 -169.175 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 42.0 t -54.74 -51.25 66.25 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 123.956 1.836 . . . . 0.0 110.018 174.822 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.411 ' HB3' ' CG2' ' A' ' 64' ' ' VAL . 1.0 OUTLIER -48.36 -41.48 28.8 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 130.797 3.639 . . . . 0.0 113.628 -177.081 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 80.1 mtm-85 -78.86 -24.14 44.52 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 179.423 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.12 -54.69 2.1 Favored Glycine 0 N--CA 1.471 0.974 0 CA-C-N 119.181 0.9 . . . . 0.0 111.271 177.78 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 73.0 m -67.29 -3.69 8.69 Favored 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 127.119 2.168 . . . . 0.0 112.135 -178.853 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 86.01 10.57 74.99 Favored Glycine 0 C--N 1.34 0.792 0 C-N-CA 127.293 2.378 . . . . 0.0 116.304 164.791 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.8 mt -70.56 -22.75 62.56 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 119.6 1.7 . . . . 0.0 113.127 178.024 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.471 HG11 HD23 ' A' ' 30' ' ' LEU . 2.8 m -133.53 156.13 41.2 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 126.952 2.101 . . . . 0.0 113.088 171.454 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.3 t -133.47 153.44 37.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 127.744 2.418 . . . . 0.0 109.748 -179.57 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.52 145.65 26.02 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.822 1.649 . . . . 0.0 112.512 175.224 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.466 ' HB ' ' HG2' ' A' ' 74' ' ' ARG . 9.6 m -140.86 144.66 35.43 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.677 1.191 . . . . 0.0 109.285 -177.836 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -80.75 115.86 20.46 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 120.985 0.421 . . . . 0.0 110.803 167.89 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -88.54 166.08 14.41 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.25 1.42 . . . . 0.0 110.531 168.854 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -66.69 15.28 0.32 Allowed Glycine 0 N--CA 1.481 1.677 0 N-CA-C 117.035 1.574 . . . . 0.0 117.035 -169.59 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.61 -1.13 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.831 2.053 . . . . 0.0 114.185 178.229 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -168.55 164.8 12.49 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 126.172 1.789 . . . . 0.0 108.783 -168.959 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 34.5 m -94.68 156.42 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 CA-C-N 119.856 1.207 . . . . 0.0 110.626 168.834 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.466 ' HG2' ' HB ' ' A' ' 67' ' ' THR . 9.8 ptt180 -127.26 178.34 6.11 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.379 1.071 . . . . 0.0 112.65 -179.424 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -124.7 128.82 49.4 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.367 1.467 . . . . 0.0 108.384 165.236 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -129.02 157.43 41.73 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 124.291 1.037 . . . . 0.0 109.946 173.83 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.474 ' HB3' ' CD1' ' A' ' 82' ' ' LEU . 0.3 OUTLIER -66.61 153.6 42.65 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.339 0.518 . . . . 0.0 109.813 170.968 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.02 -36.18 79.52 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -168.584 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -158.71 158.81 34.42 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 123.378 1.561 . . . . 0.0 113.244 176.641 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -35.21 -39.23 0.11 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 130.25 3.42 . . . . 0.0 112.701 165.724 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -44.29 -66.12 0.43 Allowed 'General case' 0 C--N 1.342 0.275 0 C-N-CA 127.862 2.465 . . . . 0.0 112.647 169.519 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.474 ' CD1' ' HB3' ' A' ' 77' ' ' LEU . 1.2 pp -79.39 -25.39 42.15 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 118.576 -0.726 . . . . 0.0 112.626 -172.502 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.48 -45.77 89.23 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 122.71 0.404 . . . . 0.0 110.428 167.855 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 24.7 ttp85 -62.87 -54.0 45.54 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.618 1.167 . . . . 0.0 111.968 178.063 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.48 -35.97 79.14 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -175.707 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.25 -42.02 66.12 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.567 -0.708 . . . . 0.0 111.009 172.894 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.05 -43.88 98.16 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.824 1.678 . . . . 0.0 114.585 -178.409 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -76.06 -2.02 28.75 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.556 1.142 . . . . 0.0 113.482 174.263 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 34.2 tp 76.08 124.8 0.04 OUTLIER 'General case' 0 C--N 1.345 0.378 0 C-N-CA 130.136 3.374 . . . . 0.0 110.914 168.473 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 46.4 t -75.62 21.69 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 CA-C-O 123.465 1.602 . . . . 0.0 112.233 -169.521 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 84.99 -12.63 0.71 Allowed 'General case' 0 C--O 1.219 -0.534 0 O-C-N 120.038 -1.664 . . . . 0.0 111.467 130.662 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 12.7 p -68.35 46.81 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 C-N-CA 129.75 3.22 . . . . 0.0 111.14 164.672 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t 69.71 -42.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 C-N-CA 130.486 3.514 . . . . 0.0 112.806 -169.893 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.1 tt 168.14 104.69 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 130.674 3.59 . . . . 0.0 106.03 -169.486 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.98 82.57 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.122 0 O-C-N 121.285 -0.885 . . . . 0.0 112.147 169.163 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 18.0 m -45.21 163.41 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 130.302 3.441 . . . . 0.0 116.788 -178.482 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -90.62 73.12 6.79 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.311 1.444 . . . . 0.0 109.263 166.444 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . 0.261 0.3 OUTLIER 172.8 138.83 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 128.477 2.711 . . . . 0.0 112.836 168.454 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -88.34 26.56 1.4 Allowed 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 130.526 3.53 . . . . 0.0 113.34 -171.244 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -33.43 134.82 0.32 Allowed Pre-proline 0 N--CA 1.483 1.176 0 C-N-CA 126.529 1.932 . . . . 0.0 112.821 -174.801 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -60.24 149.14 87.08 Favored 'Trans proline' 0 C--N 1.355 0.9 1 C-N-CA 126.12 4.546 . . . . 0.0 118.997 -164.94 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.12 121.6 15.97 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.286 1.434 . . . . 0.0 109.551 170.135 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 9.5 p -105.59 -38.91 4.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 N-CA-C 116.178 1.918 . . . . 0.0 116.178 -165.825 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -87.5 -7.91 57.04 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.738 1.154 . . . . 0.0 113.936 177.912 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -127.24 124.41 38.83 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 125.288 1.435 . . . . 0.0 108.289 170.315 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? . . . . . 0 CA--C 1.535 0.387 0 C-N-CA 124.928 1.291 . . . . 0.0 111.241 -168.669 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.456 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -54.29 -42.93 70.61 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.844 0.858 . . . . 0.0 112.065 169.992 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.26 -17.06 63.1 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.451 1.501 . . . . 0.0 112.967 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.43 -55.33 4.21 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.928 0.891 . . . . 0.0 110.216 167.439 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -54.93 -61.72 2.13 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.47 1.508 . . . . 0.0 110.716 -176.136 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.61 -38.63 95.93 Favored Glycine 0 CA--C 1.527 0.808 0 N-CA-C 111.781 -0.528 . . . . 0.0 111.781 -170.68 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 14.2 ttm105 -60.49 -48.51 81.46 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.704 1.602 . . . . 0.0 111.108 176.547 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.16 -29.94 69.78 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 177.51 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.0 mp -88.84 -8.0 55.11 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 113.858 1.058 . . . . 0.0 113.858 175.614 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -88.22 -15.64 35.39 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.637 1.575 . . . . 0.0 114.362 172.803 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -78.0 146.0 70.81 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 126.301 1.84 . . . . 0.0 110.825 174.33 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -59.13 -82.03 0.01 OUTLIER 'Trans proline' 0 CA--C 1.537 0.67 1 C-N-CA 126.474 4.783 . . . . 0.0 112.55 -168.974 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 5.7 m -59.42 -29.58 67.86 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.155 0.982 . . . . 0.0 111.114 176.48 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.407 ' HE ' ' HA ' ' B' ' 54' ' ' HIS . 11.0 ttm180 -66.74 -41.03 88.5 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -171.444 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 5.3 t -57.78 -47.24 83.12 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-O 122.238 1.018 . . . . 0.0 110.152 169.565 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . 0.436 ' HB3' HD22 ' B' ' 44' ' ' LEU . 11.2 mmp_? -63.05 -36.43 83.55 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.561 1.689 . . . . 0.0 115.561 175.911 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 4.8 mm -49.64 -41.4 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 120.319 -1.488 . . . . 0.0 111.91 173.283 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 83.0 mt -72.67 -29.62 63.57 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 112.808 0.669 . . . . 0.0 112.808 176.434 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . 0.426 HG23 HD22 ' B' ' 86' ' ' LEU . 0.3 OUTLIER -78.19 -25.59 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 O-C-N 120.585 -1.322 . . . . 0.0 112.096 176.46 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.77 -57.61 4.9 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.495 1.518 . . . . 0.0 108.822 168.337 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.411 HD12 HG11 ' B' ' 64' ' ' VAL . 10.4 mt -61.24 -23.38 65.6 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 117.163 2.282 . . . . 0.0 117.163 -176.126 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . 0.593 ' HA ' HD11 ' B' ' 77' ' ' LEU . 0.3 OUTLIER -42.5 -32.74 0.58 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 125.951 1.701 . . . . 0.0 112.109 168.427 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -120.05 -30.24 4.73 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 128.278 2.631 . . . . 0.0 112.324 168.563 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.8 21.55 1.58 Allowed Glycine 0 N--CA 1.465 0.633 0 C-N-CA 128.819 3.104 . . . . 0.0 115.39 -164.66 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . 0.575 HG12 ' HA ' ' B' ' 76' ' ' ALA . 13.3 m -64.87 29.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 C-N-CA 127.371 2.268 . . . . 0.0 114.613 173.818 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -85.17 -64.16 1.2 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.382 1.073 . . . . 0.0 111.457 -176.753 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 55.4 p90 -165.84 154.71 10.47 Favored Pre-proline 0 CA--C 1.545 0.751 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 -170.007 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -58.45 118.74 5.68 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 123.207 2.605 . . . . 0.0 109.894 175.971 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 94.22 -8.94 72.55 Favored Glycine 0 CA--C 1.531 1.038 0 CA-C-O 117.619 -1.656 . . . . 0.0 114.899 -174.64 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.67 -36.73 69.92 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 120.918 2.359 . . . . 0.0 110.545 172.855 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.694 ' H ' HD12 ' B' ' 40' ' ' LEU . 0.4 OUTLIER -61.6 -19.09 61.84 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 126.14 1.776 . . . . 0.0 112.361 -175.688 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.87 -31.27 71.76 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.145 0.578 . . . . 0.0 111.826 176.447 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.37 -43.81 59.9 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.661 0.384 . . . . 0.0 110.824 170.585 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -63.44 -33.41 75.51 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . 0.436 HD22 ' HB3' ' B' ' 25' ' ' ARG . 36.1 mt -104.35 -18.37 14.46 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.558 1.143 . . . . 0.0 113.725 -174.761 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.94 -0.72 61.48 Favored Glycine 0 CA--C 1.526 0.747 0 CA-C-O 118.156 -1.358 . . . . 0.0 113.756 -174.216 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 8.3 mp -107.2 143.32 35.59 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.031 1.415 . . . . 0.0 110.834 177.213 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.443 HG23 ' H ' ' B' ' 50' ' ' ASN . 9.8 t -51.35 149.97 3.78 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 126.189 1.796 . . . . 0.0 113.461 -173.295 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -49.12 -22.33 0.93 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.397 1.879 . . . . 0.0 113.458 169.372 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.4 m -67.22 -63.64 1.02 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.59 1.156 . . . . 0.0 112.374 169.516 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . 0.443 ' H ' HG23 ' B' ' 47' ' ' THR . 28.4 t-20 -65.04 -36.65 85.03 Favored 'General case' 0 N--CA 1.477 0.894 0 O-C-N 120.75 -1.219 . . . . 0.0 112.404 178.211 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 2.3 t -54.58 -48.79 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 122.963 0.505 . . . . 0.0 110.422 168.71 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.9 m -66.61 -38.81 87.76 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 117.809 -1.091 . . . . 0.0 113.926 177.508 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 34.6 t30 -54.36 -54.52 39.37 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.107 0.867 . . . . 0.0 109.692 174.57 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . 0.407 ' HA ' ' HE ' ' B' ' 23' ' ' ARG . 89.1 m-70 -70.9 -25.18 62.66 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.792 -1.193 . . . . 0.0 113.439 -178.872 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 32.0 mt -68.61 -25.52 64.89 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 120.436 1.471 . . . . 0.0 112.954 167.424 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 8.0 t -58.99 -55.79 30.65 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 119.983 1.265 . . . . 0.0 112.976 -169.44 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 40.5 t -53.46 -52.64 58.84 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 122.387 1.089 . . . . 0.0 109.476 172.655 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 1.4 tp -47.63 -38.16 14.14 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 128.293 2.637 . . . . 0.0 113.886 -174.291 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 25.2 mtm-85 -83.99 -32.62 24.88 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 119.684 1.129 . . . . 0.0 113.73 -179.211 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -83.3 -45.88 6.37 Favored Glycine 0 N--CA 1.467 0.755 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 -179.82 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 80.3 m -74.5 5.91 4.26 Favored 'General case' 0 CA--C 1.563 1.46 0 C-N-CA 127.484 2.313 . . . . 0.0 111.628 177.746 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.56 -6.46 83.38 Favored Glycine 0 C--N 1.344 1.01 0 C-N-CA 128.301 2.858 . . . . 0.0 119.078 165.594 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 59.9 mt -66.99 -26.93 67.05 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 119.366 1.583 . . . . 0.0 113.785 -172.713 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.411 HG11 HD12 ' B' ' 30' ' ' LEU . 11.1 m -132.01 161.09 41.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 126.767 2.027 . . . . 0.0 113.238 177.26 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 76.4 t -139.93 146.73 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 128.232 2.613 . . . . 0.0 109.877 -169.202 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -96.37 138.08 34.49 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.994 1.318 . . . . 0.0 111.605 170.493 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 9.5 m -146.88 147.19 30.56 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.097 1.359 . . . . 0.0 108.522 -174.465 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -77.11 138.03 39.28 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 175.778 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -112.17 164.71 12.88 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.385 1.874 . . . . 0.0 111.436 169.181 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -65.9 14.16 0.3 Allowed Glycine 0 N--CA 1.48 1.627 0 N-CA-C 117.271 1.669 . . . . 0.0 117.271 -168.952 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.92 -0.77 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.95 2.1 . . . . 0.0 113.849 178.907 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -168.79 167.08 11.3 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 126.561 1.945 . . . . 0.0 108.949 -168.225 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 35.2 m -93.74 159.34 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 119.818 1.19 . . . . 0.0 110.605 168.246 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 5.2 ptt180 -121.9 171.4 8.95 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 122.363 1.078 . . . . 0.0 112.508 178.154 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -119.94 112.62 19.41 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 105.469 -2.049 . . . . 0.0 105.469 165.227 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.575 ' HA ' HG12 ' B' ' 34' ' ' VAL . . . -110.14 167.58 10.07 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 124.599 1.16 . . . . 0.0 110.147 174.458 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.593 HD11 ' HA ' ' B' ' 31' ' ' LEU . 0.0 OUTLIER -85.82 150.9 24.23 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 169.678 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.21 -50.47 69.31 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -168.411 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -153.34 160.35 42.66 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 123.275 1.512 . . . . 0.0 112.921 -178.822 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -35.34 -40.5 0.15 Allowed 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 129.657 3.183 . . . . 0.0 111.671 165.521 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -42.75 -68.22 0.21 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.469 2.308 . . . . 0.0 112.397 169.184 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 2.3 pp -79.04 -22.98 44.61 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -172.418 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.22 -44.51 91.69 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 122.892 0.477 . . . . 0.0 110.606 166.937 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 28.6 ttp85 -64.44 -51.61 62.23 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 126.132 1.773 . . . . 0.0 112.6 178.835 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.31 -41.61 80.23 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.983 0.81 . . . . 0.0 112.691 -179.857 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.426 HD22 HG23 ' B' ' 28' ' ' VAL . 0.3 OUTLIER -70.6 -41.53 72.17 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 118.79 -0.624 . . . . 0.0 111.038 176.263 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.87 -44.65 95.8 Favored Glycine 0 CA--C 1.533 1.189 0 C-N-CA 125.42 1.486 . . . . 0.0 114.389 179.571 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -76.93 -2.3 33.0 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.82 1.248 . . . . 0.0 113.129 172.982 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 44.7 tp 70.65 112.09 0.05 Allowed 'General case' 0 C--N 1.341 0.224 0 C-N-CA 129.679 3.192 . . . . 0.0 111.992 168.409 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 2.4 t -69.97 26.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 C-N-CA 127.198 2.199 . . . . 0.0 113.232 -176.167 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 89.02 -14.24 0.35 Allowed 'General case' 0 N--CA 1.468 0.47 0 O-C-N 119.623 -1.923 . . . . 0.0 113.226 119.046 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 11.5 p -63.95 39.69 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 130.306 3.443 . . . . 0.0 113.633 169.321 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 63.41 24.53 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 127.244 2.218 . . . . 0.0 112.823 -175.742 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 3.6 tt 98.49 112.48 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 129.928 3.291 . . . . 0.0 107.947 -173.443 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.49 78.53 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.866 0.866 . . . . 0.0 111.057 168.139 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 10.3 m -42.8 155.62 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 130.336 3.455 . . . . 0.0 116.764 -177.64 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . 0.423 ' CG ' HH11 ' B' ' 25' ' ' ARG . 19.4 m-20 -85.9 68.44 10.34 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.07 1.348 . . . . 0.0 110.647 167.873 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 174.68 126.29 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 128.706 2.803 . . . . 0.0 111.396 168.936 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -72.72 40.36 0.09 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 130.156 3.382 . . . . 0.0 113.72 178.218 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -36.37 132.85 0.62 Allowed Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 127.165 2.186 . . . . 0.0 111.545 -178.933 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -67.04 155.94 68.56 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 124.074 3.183 . . . . 0.0 115.675 -166.327 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.86 145.85 53.35 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 126.059 1.744 . . . . 0.0 111.797 177.675 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 48.2 t -95.46 -68.79 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.651 1.18 . . . . 0.0 112.55 -175.636 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -85.57 -7.86 58.62 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 116.813 2.153 . . . . 0.0 116.813 -168.137 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -131.89 139.78 48.87 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.454 1.102 . . . . 0.0 109.53 -178.135 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? . . . . . 0 N--CA 1.468 0.445 0 C-N-CA 123.523 0.729 . . . . 0.0 112.176 -169.697 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 pp -51.66 -39.2 57.76 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.786 1.634 . . . . 0.0 115.201 -170.427 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.84 -58.14 6.98 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 118.755 0.707 . . . . 0.0 111.724 175.639 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -62.28 -30.37 71.09 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 121.415 -0.803 . . . . 0.0 111.993 179.222 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.532 HD21 HD21 ' A' ' 63' ' ' LEU . 3.0 tm? -61.71 -43.41 98.91 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.798 1.639 . . . . 0.0 111.381 170.019 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -59.75 -29.25 66.93 Favored Glycine 0 N--CA 1.474 1.21 0 CA-C-N 119.548 1.067 . . . . 0.0 113.184 175.264 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.19 -27.37 64.45 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.085 0.954 . . . . 0.0 112.116 173.333 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.01 -26.13 62.1 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 120.104 1.32 . . . . 0.0 111.643 172.753 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.4 mp -83.21 -28.61 29.14 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.005 0.522 . . . . 0.0 111.389 172.71 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.7 -10.61 57.34 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 117.021 2.23 . . . . 0.0 117.021 -179.278 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.67 156.83 21.76 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 128.048 2.539 . . . . 0.0 114.098 -173.602 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.53 ' HG2' ' H ' ' A' ' 22' ' ' THR . 58.3 Cg_endo -53.65 -76.65 0.02 OUTLIER 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 124.532 3.488 . . . . 0.0 111.345 169.554 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.53 ' H ' ' HG2' ' A' ' 21' ' ' PRO . 57.9 m -87.37 -28.01 22.45 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 116.145 -1.883 . . . . 0.0 112.36 -172.528 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.3 mtt85 -64.15 -39.55 94.25 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 122.666 2.484 . . . . 0.0 111.589 172.668 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 15.2 t -57.66 -40.57 79.63 Favored 'General case' 0 CA--C 1.552 1.019 0 CA-C-N 121.466 1.939 . . . . 0.0 111.944 170.618 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -60.91 -55.82 28.49 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 121.129 -0.982 . . . . 0.0 112.081 173.688 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.4 mm -52.84 -42.82 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.96 1.704 . . . . 0.0 110.767 176.265 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 49.5 mt -68.21 -43.15 78.65 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.822 0.849 . . . . 0.0 112.869 178.714 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.2 p -68.37 -26.43 33.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 119.977 1.262 . . . . 0.0 111.806 177.471 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.66 1.67 9.73 Favored 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 127.242 2.217 . . . . 0.0 115.023 170.444 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.454 HD11 HG13 ' A' ' 64' ' ' VAL . 95.2 mt -99.23 -25.36 14.53 Favored 'General case' 0 N--CA 1.479 0.982 0 O-C-N 120.413 -1.429 . . . . 0.0 114.768 173.439 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 6.4 mt -59.4 -24.02 63.09 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.629 -1.169 . . . . 0.0 111.873 171.638 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 45.7 p-10 -132.25 -28.16 1.73 Allowed 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 116.036 1.865 . . . . 0.0 116.036 -175.179 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.86 -69.35 1.41 Allowed Glycine 0 C--N 1.343 0.945 0 CA-C-N 119.436 1.017 . . . . 0.0 113.221 -168.874 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 33.4 m 33.42 23.57 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 129.746 3.218 . . . . 0.0 119.14 174.88 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 69.2 m -86.08 -76.47 0.34 Allowed 'General case' 0 C--N 1.331 -0.204 0 O-C-N 121.01 -1.056 . . . . 0.0 109.764 177.608 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 26.9 m-85 -137.04 157.1 75.24 Favored Pre-proline 0 N--CA 1.479 0.977 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -168.606 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -56.47 127.29 25.33 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.17 2.58 . . . . 0.0 110.535 173.327 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.05 -2.74 59.86 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-O 118.218 -1.324 . . . . 0.0 115.443 -178.292 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.79 -25.76 68.39 Favored 'General case' 0 N--CA 1.484 1.225 0 CA-C-N 120.46 2.13 . . . . 0.0 112.689 178.325 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.1 -12.27 3.31 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.507 1.123 . . . . 0.0 111.519 178.117 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.36 -38.56 91.62 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.988 1.315 . . . . 0.0 113.381 173.335 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.79 -37.98 70.33 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.586 0.63 . . . . 0.0 111.091 173.391 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -67.86 -47.73 68.09 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.209 1.004 . . . . 0.0 113.213 -178.987 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.2 mt -86.09 -11.92 51.46 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.539 1.136 . . . . 0.0 113.102 -178.659 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.31 -2.62 13.9 Favored Glycine 0 CA--C 1.537 1.444 0 C-N-CA 124.129 0.871 . . . . 0.0 113.728 -169.58 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.0 mt -81.9 153.52 26.29 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.618 1.167 . . . . 0.0 110.942 -176.712 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 50' ' ' ASN . 4.3 t -61.23 142.38 56.84 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 121.362 -0.836 . . . . 0.0 110.62 171.499 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.9 ptp180 -56.78 -23.79 45.82 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 118.685 -0.674 . . . . 0.0 112.667 178.366 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.0 m -66.04 -48.03 72.41 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.27 1.028 . . . . 0.0 113.258 170.862 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.407 ' H ' HG23 ' A' ' 47' ' ' THR . 43.6 t-20 -65.71 -41.21 92.58 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.041 1.336 . . . . 0.0 110.672 176.868 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 19.4 t -55.28 -49.9 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 123.654 0.781 . . . . 0.0 111.025 168.977 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 27.2 p -66.43 -36.15 82.1 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 120.31 1.414 . . . . 0.0 114.51 175.496 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -64.4 -45.28 88.3 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.31 1.444 . . . . 0.0 110.643 179.227 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -72.72 -35.35 67.55 Favored 'General case' 0 CA--C 1.558 1.281 0 CA-C-O 117.264 -1.35 . . . . 0.0 113.111 171.282 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.3 mt -63.11 -33.0 74.51 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 121.777 2.08 . . . . 0.0 113.719 173.259 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.3 m -55.42 -52.28 64.11 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.194 0.906 . . . . 0.0 113.405 -169.838 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 50.9 t -63.38 -40.29 96.86 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 122.933 0.493 . . . . 0.0 111.201 172.545 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.8 tp -58.86 -28.26 65.93 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.765 2.026 . . . . 0.0 112.908 -172.348 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 26.9 mtm180 -71.48 -38.9 71.18 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.9 0.88 . . . . 0.0 112.359 171.29 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -78.74 -36.12 29.98 Favored Glycine 0 N--CA 1.468 0.781 0 C-N-CA 125.883 1.706 . . . . 0.0 111.635 -176.721 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 36.3 m -61.86 -12.79 19.37 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 128.149 2.58 . . . . 0.0 112.865 167.28 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 81.87 -10.02 53.97 Favored Glycine 0 C--N 1.342 0.904 0 C-N-CA 126.957 2.218 . . . . 0.0 113.404 -179.033 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.532 HD21 HD21 ' A' ' 14' ' ' LEU . 85.0 mt -63.73 -33.03 74.73 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 127.496 2.318 . . . . 0.0 113.936 -169.902 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.454 HG13 HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -113.22 133.3 59.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 125.599 1.56 . . . . 0.0 109.101 166.833 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.8 t -121.79 133.06 69.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 124.971 1.308 . . . . 0.0 109.574 172.324 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.03 142.56 50.91 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 114.746 -1.115 . . . . 0.0 111.979 170.121 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.1 m -162.92 158.96 23.09 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.098 1.759 . . . . 0.0 106.944 -174.303 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -91.46 145.61 24.48 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.73 1.15 . . . . 0.0 113.206 178.302 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -111.39 -166.79 1.11 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.284 1.834 . . . . 0.0 109.85 168.79 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -72.02 -8.1 68.32 Favored Glycine 0 CA--C 1.537 1.417 0 O-C-N 120.498 -1.376 . . . . 0.0 116.457 -169.39 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.03 -31.28 0.77 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.326 1.85 . . . . 0.0 113.091 177.667 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.25 -175.79 4.97 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.942 1.246 . . . . 0.0 112.929 -172.642 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 8.1 p -79.81 146.96 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 123.842 0.857 . . . . 0.0 110.792 168.858 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.4 ptt180 -128.79 162.7 26.83 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 127.657 2.383 . . . . 0.0 111.091 -179.202 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -110.59 120.42 42.35 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.409 1.084 . . . . 0.0 108.919 168.262 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -121.46 168.62 11.49 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.881 1.272 . . . . 0.0 110.461 174.985 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 17.6 mt -58.64 155.44 12.54 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 172.642 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -48.04 -40.7 23.69 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.155 1.782 . . . . 0.0 114.342 -178.457 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -174.52 169.42 3.69 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.578 1.951 . . . . 0.0 110.982 -174.387 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 88.0 p -46.57 -34.75 5.18 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 127.372 2.269 . . . . 0.0 113.605 169.271 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 62.1 m-70 -54.23 -53.47 53.16 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 125.525 1.53 . . . . 0.0 112.221 176.203 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 28.2 mt -73.15 -37.1 66.73 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 118.219 -0.895 . . . . 0.0 110.61 -179.968 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.2 -50.76 64.03 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 118.913 0.779 . . . . 0.0 111.495 179.089 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -75.64 -32.23 60.15 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.49 1.041 . . . . 0.0 113.611 -179.274 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.18 -44.72 83.2 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.764 1.166 . . . . 0.0 112.576 176.298 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.01 -38.43 75.93 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.931 0.892 . . . . 0.0 110.694 174.63 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.16 -35.43 91.96 Favored Glycine 0 CA--C 1.529 0.907 0 O-C-N 121.418 -0.801 . . . . 0.0 112.225 176.884 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -83.15 9.57 10.21 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.865 1.266 . . . . 0.0 114.093 170.148 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.7 tp 66.52 -18.48 0.11 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 130.785 3.634 . . . . 0.0 117.525 164.041 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.27 34.3 m 118.71 20.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.138 1 C-N-CA 134.938 5.295 . . . . 0.0 112.152 178.219 . . . . . . . . 3 2 . 1 . 026 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.441 ' HB3' ' CG ' ' B' ' 81' ' ' HIS . 25.4 mm-40 79.63 -33.43 0.14 Allowed 'General case' 0 CA--C 1.539 0.524 0 O-C-N 120.176 -1.578 . . . . 0.0 114.127 162.945 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.8 p -57.34 16.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 C-N-CA 129.835 3.254 . . . . 0.0 117.572 -175.206 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.4 t 69.54 27.37 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 C-N-CA 125.218 1.407 . . . . 0.0 111.446 169.036 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.6 tp 80.13 96.94 0.06 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 129.53 3.132 . . . . 0.0 111.855 -173.805 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -87.69 114.76 24.61 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 120.887 -1.133 . . . . 0.0 109.045 170.021 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.3 m -141.82 142.99 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 127.528 2.331 . . . . 0.0 108.891 170.397 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.79 127.45 32.27 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.729 1.612 . . . . 0.0 109.688 170.818 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 2.7 m -179.88 -57.96 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 126.867 2.067 . . . . 0.0 109.138 -168.824 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.1 t0 176.19 56.44 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 131.235 3.814 . . . . 0.0 108.065 175.322 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -111.12 -163.2 0.05 OUTLIER Pre-proline 0 CA--C 1.555 1.139 0 C-N-CA 127.912 2.485 . . . . 0.0 110.543 -168.282 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -73.56 -159.57 0.08 OUTLIER 'Trans proline' 0 CA--C 1.55 1.282 0 CA-C-N 122.664 1.987 . . . . 0.0 112.928 177.021 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . 0.449 0.5 OUTLIER 48.9 36.57 8.48 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 130.84 3.656 . . . . 0.0 117.402 -169.451 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.409 HG12 ' H ' ' A' ' 103' ' ' VAL . 1.4 p -57.2 -40.13 71.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 C-N-CA 126.997 2.119 . . . . 0.0 112.87 166.148 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.74 166.11 21.61 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.026 0.93 . . . . 0.0 112.103 -173.546 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -72.47 142.34 48.59 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 115.22 1.563 . . . . 0.0 115.22 -169.189 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.589 0 C-N-CA 127.406 2.282 . . . . 0.0 114.355 -172.016 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.603 0 CA-C-O 121.345 0.593 . . . . 0.0 111.429 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 pp -48.19 -36.46 13.69 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 126.589 1.956 . . . . 0.0 114.708 -177.612 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.23 -43.27 95.47 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.61 0.641 . . . . 0.0 111.506 177.299 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 25.6 ttp85 -64.95 -20.26 66.38 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.471 -1.393 . . . . 0.0 112.532 174.885 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.2 -38.22 85.79 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 120.802 1.637 . . . . 0.0 111.078 169.016 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -60.82 -25.52 63.92 Favored Glycine 0 CA--C 1.533 1.178 0 O-C-N 121.005 -1.059 . . . . 0.0 112.989 174.534 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 29.0 ttt-85 -69.35 -44.66 71.14 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 118.871 1.336 . . . . 0.0 110.364 170.817 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.54 -22.05 66.16 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 118.268 -0.873 . . . . 0.0 112.549 -177.014 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mp -91.34 -19.46 22.91 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 119.231 0.923 . . . . 0.0 113.308 168.384 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.0 -24.29 38.07 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 174.274 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -55.53 136.63 70.35 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 125.686 1.594 . . . . 0.0 109.597 178.849 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -49.26 -81.34 0.02 OUTLIER 'Trans proline' 0 CA--C 1.535 0.532 1 C-N-CA 126.611 4.874 . . . . 0.0 112.712 -167.695 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 13.4 m -62.86 -27.75 69.55 Favored 'General case' 0 C--O 1.221 -0.415 0 C-N-CA 125.226 1.41 . . . . 0.0 111.415 -179.855 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -67.84 -43.5 79.38 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 120.495 1.498 . . . . 0.0 111.244 178.903 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 2.7 t -58.6 -14.1 7.38 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.51 1.05 . . . . 0.0 113.069 168.531 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -93.28 -55.33 3.35 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 120.265 -1.522 . . . . 0.0 112.053 171.641 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.2 mt -38.87 -56.56 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 125.223 1.409 . . . . 0.0 110.464 170.899 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.52 ' HA ' HD12 ' B' ' 30' ' ' LEU . 96.9 mt -62.92 -30.56 71.65 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -170.545 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.6 p -88.12 -10.71 10.77 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 124.546 1.139 . . . . 0.0 112.337 178.012 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.71 -6.42 25.07 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 128.28 2.632 . . . . 0.0 112.907 176.503 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.545 HD11 ' CG1' ' B' ' 64' ' ' VAL . 52.7 mt -77.72 -54.27 6.56 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 119.639 -1.913 . . . . 0.0 110.177 168.84 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -35.31 -48.32 0.46 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 131.614 3.966 . . . . 0.0 114.303 179.551 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -102.8 -21.5 14.03 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.959 2.104 . . . . 0.0 113.224 -179.317 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -83.99 -70.1 1.36 Allowed Glycine 0 C--N 1.336 0.542 0 C-N-CA 125.826 1.679 . . . . 0.0 110.562 -170.726 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 11.0 m 32.46 26.81 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 N-CA-C 117.551 2.426 . . . . 0.0 117.551 -170.9 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 54.1 m -81.36 -89.56 0.07 Allowed 'General case' 0 C--O 1.221 -0.427 0 O-C-N 120.846 -1.159 . . . . 0.0 111.634 -178.661 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . 0.455 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 27.6 m-85 -135.16 156.52 78.12 Favored Pre-proline 0 N--CA 1.472 0.653 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -169.166 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -57.24 125.4 18.76 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.266 1.978 . . . . 0.0 109.359 171.554 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.14 -6.83 80.45 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 117.313 -1.826 . . . . 0.0 114.935 -174.091 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . 0.455 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 2.5 pp0? -59.36 -38.16 79.73 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 120.764 2.282 . . . . 0.0 111.235 172.273 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 15.0 mt -53.71 -23.05 10.42 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.224 1.41 . . . . 0.0 112.454 179.384 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.88 -28.15 69.3 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 176.966 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.03 -55.26 5.77 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.774 0.83 . . . . 0.0 110.6 171.312 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -49.67 -40.42 39.82 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 177.426 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.4 mt -95.6 -15.3 22.87 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.03 0.932 . . . . 0.0 113.245 -175.999 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.95 -5.13 4.93 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 124.542 1.068 . . . . 0.0 114.188 -170.123 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 87.8 mt -89.58 136.08 33.24 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 125.279 1.431 . . . . 0.0 109.678 -177.903 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.0 t -61.23 150.54 34.28 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.294 -0.879 . . . . 0.0 112.316 -173.631 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -57.5 -32.01 66.59 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -169.863 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 3.7 m -64.29 -52.34 59.02 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.017 0.927 . . . . 0.0 112.551 173.822 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -64.24 -40.92 97.01 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.8 1.24 . . . . 0.0 111.827 179.127 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 78.6 t -61.34 -44.7 98.94 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 O-C-N 121.505 -0.747 . . . . 0.0 111.143 169.504 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 81.1 p -64.04 -31.51 72.73 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.0 1.273 . . . . 0.0 113.913 176.88 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -57.27 -40.64 78.12 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 122.345 1.069 . . . . 0.0 110.854 174.316 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -73.85 -34.67 64.6 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 116.925 -1.512 . . . . 0.0 114.121 170.135 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 90.7 mt -61.24 -32.83 72.63 Favored 'General case' 0 N--CA 1.483 1.175 0 CA-C-N 121.793 2.088 . . . . 0.0 113.443 173.274 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 70.4 m -52.53 -44.82 66.01 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -174.159 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.1 t -75.73 -36.67 59.87 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.548 0.613 . . . . 0.0 110.788 175.733 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 10.1 tp -62.51 -28.33 69.76 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 127.16 2.184 . . . . 0.0 113.737 -168.148 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 28.2 mtm105 -71.92 -40.72 68.58 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.007 0.523 . . . . 0.0 110.602 171.815 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.82 -39.95 85.32 Favored Glycine 0 C--O 1.222 -0.654 0 CA-C-O 118.439 -1.2 . . . . 0.0 111.147 178.5 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 96.6 m -58.31 -12.91 4.18 Favored 'General case' 0 CA--C 1.565 1.556 0 C-N-CA 127.255 2.222 . . . . 0.0 112.323 168.541 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 82.29 -9.82 56.55 Favored Glycine 0 C--N 1.344 1.02 0 C-N-CA 127.033 2.254 . . . . 0.0 113.412 -179.834 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 19.8 mt -71.08 -31.52 67.92 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.196 1.398 . . . . 0.0 114.643 -167.862 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.545 ' CG1' HD11 ' B' ' 30' ' ' LEU . 0.1 OUTLIER -109.62 139.65 31.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.688 1.595 . . . . 0.0 111.125 169.874 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 71.6 t -132.66 133.7 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 C-N-CA 125.764 1.626 . . . . 0.0 109.241 -176.272 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.72 135.34 35.5 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.482 0.713 . . . . 0.0 110.126 168.965 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 2.1 m -162.49 163.5 27.47 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.764 1.625 . . . . 0.0 107.046 -171.31 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -91.73 151.77 20.48 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 120.89 -1.131 . . . . 0.0 113.673 178.518 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -119.22 -171.56 2.14 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.513 1.925 . . . . 0.0 108.834 166.396 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -69.99 -10.28 64.72 Favored Glycine 0 CA--C 1.536 1.378 0 N-CA-C 116.932 1.533 . . . . 0.0 116.932 -168.69 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 24.6 mtm180 -138.27 -21.94 1.04 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 126.153 1.781 . . . . 0.0 113.571 -177.4 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -154.83 -175.39 5.4 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.665 1.575 . . . . 0.0 112.755 -179.478 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 9.2 p -83.34 146.61 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.312 1.045 . . . . 0.0 110.453 169.073 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 -134.72 162.48 32.22 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 126.436 1.894 . . . . 0.0 111.566 -170.962 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -106.59 127.0 52.98 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 165.723 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -128.62 172.11 11.51 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.385 1.874 . . . . 0.0 109.924 176.218 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 29.4 mt -76.03 158.96 31.3 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.116 0.566 . . . . 0.0 112.399 177.912 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -46.2 -34.92 4.68 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.712 2.005 . . . . 0.0 116.071 177.955 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 11.6 t70 171.59 158.63 0.09 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 128.922 2.889 . . . . 0.0 110.453 -169.988 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 91.9 p -40.98 -36.14 0.62 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 128.749 2.82 . . . . 0.0 113.501 168.57 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . 0.441 ' CG ' ' HB3' ' A' ' 91' ' ' GLN . 5.2 m-70 -49.47 -53.05 25.18 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 125.674 1.59 . . . . 0.0 113.039 173.854 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 14.2 mt -74.22 -40.11 62.66 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 119.075 0.852 . . . . 0.0 110.43 -179.395 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.01 -45.76 75.14 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.088 0.555 . . . . 0.0 110.99 179.376 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -77.01 -35.6 56.94 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 117.049 -1.453 . . . . 0.0 114.193 176.088 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -69.31 -33.45 73.18 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 121.143 1.792 . . . . 0.0 112.822 178.778 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.44 -44.5 51.46 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.587 0.755 . . . . 0.0 110.683 169.868 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.96 -32.67 73.58 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 123.972 0.796 . . . . 0.0 113.178 -176.022 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -71.68 -8.79 56.34 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.289 1.436 . . . . 0.0 112.548 169.421 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 4.8 tp 66.95 11.01 8.1 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 128.453 2.701 . . . . 0.0 115.338 167.994 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER 75.28 -9.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 C-N-CA 129.973 3.309 . . . . 0.0 111.907 168.093 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . 0.486 ' C ' ' H ' ' B' ' 93' ' ' VAL 0.482 5.2 pt20 73.93 12.46 4.31 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 115.306 1.595 . . . . 0.0 115.306 141.726 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.511 HG13 ' HB2' ' B' ' 95' ' ' ALA . 4.9 p -68.38 42.68 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 130.112 3.365 . . . . 0.0 109.368 163.141 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . 0.486 ' H ' ' C ' ' B' ' 91' ' ' GLN . 1.5 t 59.22 45.57 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 C-N-CA 127.741 2.416 . . . . 0.0 111.633 178.296 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 32.6 tp 60.26 60.37 2.07 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 122.096 0.951 . . . . 0.0 110.242 -179.92 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.511 ' HB2' HG13 ' B' ' 92' ' ' VAL . . . -54.91 114.68 1.82 Allowed 'General case' 0 CA--C 1.548 0.877 0 O-C-N 121.156 -0.965 . . . . 0.0 110.658 179.682 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 27.4 m -144.32 144.35 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 126.464 1.906 . . . . 0.0 111.43 177.066 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -74.34 108.66 7.27 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.686 1.195 . . . . 0.0 110.348 179.418 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 22.0 m -166.1 -78.34 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.495 1.918 . . . . 0.0 107.132 -169.61 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -156.76 105.87 2.23 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 129.41 3.084 . . . . 0.0 103.832 166.783 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -158.99 -164.4 0.09 OUTLIER Pre-proline 0 CA--C 1.559 1.323 0 C-N-CA 125.626 1.571 . . . . 0.0 108.999 -165.34 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -63.16 -156.53 0.02 OUTLIER 'Trans proline' 0 CA--C 1.555 1.562 0 C-N-CA 124.087 3.191 . . . . 0.0 115.658 173.061 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . 0.4 0.5 OUTLIER 35.19 57.2 0.81 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 128.983 2.913 . . . . 0.0 115.369 -170.094 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.41 HG12 ' H ' ' B' ' 103' ' ' VAL . 0.2 OUTLIER -73.16 -39.52 56.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 C-N-CA 128.854 2.861 . . . . 0.0 114.464 168.443 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.74 -146.02 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -165.856 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . 0.459 ' CD ' ' H ' ' B' ' 106' ' ' ARG . 0.4 OUTLIER -66.24 154.73 39.09 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.82 -0.55 . . . . 0.0 109.831 169.415 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . 0.459 ' H ' ' CD ' ' B' ' 105' ' ' GLU . 0.7 OUTLIER . . . . . 0 CA--C 1.55 0.961 0 C-N-CA 130.593 3.557 . . . . 0.0 113.869 -169.137 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.959 0 CA-C-O 119.755 -0.164 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -61.59 -32.18 72.28 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 173.408 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.47 -54.23 35.77 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.879 0.871 . . . . 0.0 110.532 178.591 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -34.57 76.78 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.335 0.97 . . . . 0.0 112.586 176.631 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.474 ' HG ' HG11 ' B' ' 92' ' ' VAL . 3.2 tm? -68.77 -56.5 7.84 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.306 0.957 . . . . 0.0 111.066 -179.179 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.86 -29.84 75.91 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-O 119.128 -0.818 . . . . 0.0 111.141 -179.783 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -65.36 -48.4 73.08 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 118.344 1.072 . . . . 0.0 110.649 169.878 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.1 -24.97 67.44 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 119.869 1.213 . . . . 0.0 112.977 -179.647 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 mp -94.14 -4.34 49.39 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 171.477 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -99.68 -15.37 18.55 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 126.489 1.916 . . . . 0.0 114.192 168.511 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.406 ' CG ' HH21 ' A' ' 23' ' ' ARG . 0.7 OUTLIER -62.66 152.18 82.17 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 127.257 2.223 . . . . 0.0 112.671 174.221 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.35 -101.1 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 0.978 1 C-N-CA 127.533 5.489 . . . . 0.0 112.317 -169.681 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -44.92 -35.43 2.84 Favored 'General case' 0 C--O 1.22 -0.494 0 C-N-CA 126.516 1.926 . . . . 0.0 111.346 168.807 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.499 ' HG2' HD13 ' A' ' 58' ' ' LEU . 11.9 ttm-85 -64.41 -50.54 67.22 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 120.277 1.399 . . . . 0.0 113.952 -179.462 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.23 -42.51 99.37 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 120.069 1.304 . . . . 0.0 110.063 174.384 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 18.6 mmt-85 -54.48 -44.05 72.3 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.763 1.023 . . . . 0.0 113.763 174.679 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 4.5 mm -50.22 -54.15 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.236 0.614 . . . . 0.0 109.792 170.772 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 86.7 mt -59.91 -48.11 83.05 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.472 -0.775 . . . . 0.0 112.173 -177.239 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.7 m -65.55 -36.05 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 CA-C-N 118.776 0.716 . . . . 0.0 111.092 -176.716 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.02 -26.7 33.58 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.513 0.561 . . . . 0.0 112.513 -178.773 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.418 ' O ' HG13 ' A' ' 34' ' ' VAL . 19.9 tp -68.79 -37.27 79.17 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 117.182 -1.389 . . . . 0.0 112.051 174.323 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.39 -50.83 12.0 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.182 2.193 . . . . 0.0 112.893 -173.135 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -104.05 8.72 36.6 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 126.454 1.902 . . . . 0.0 112.118 178.695 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -92.98 -73.85 1.25 Allowed Glycine 0 C--N 1.341 0.86 0 C-N-CA 127.365 2.412 . . . . 0.0 111.504 172.256 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.574 HG12 ' HA ' ' A' ' 76' ' ' ALA . 23.7 m 24.54 49.54 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 C-N-CA 128.399 2.68 . . . . 0.0 115.918 -172.792 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 80.3 m -96.61 -66.94 0.87 Allowed 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 125.523 1.529 . . . . 0.0 112.661 177.304 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -146.0 159.02 47.7 Favored Pre-proline 0 N--CA 1.486 1.364 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -168.382 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -55.45 126.27 21.92 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 123.214 2.609 . . . . 0.0 111.061 173.528 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.56 8.35 62.91 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 117.918 -1.49 . . . . 0.0 115.046 179.966 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.07 -24.74 26.71 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 120.353 2.076 . . . . 0.0 112.883 177.085 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.3 mt -63.2 -15.87 58.32 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 125.894 1.677 . . . . 0.0 111.643 -176.662 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.27 -29.75 70.04 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 170.308 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.0 -49.04 16.31 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.489 0.586 . . . . 0.0 110.711 169.959 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -59.05 -36.49 75.13 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -179.023 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 17.5 mt -101.45 -14.12 17.66 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.279 1.432 . . . . 0.0 112.468 -175.839 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.4 -1.83 12.19 Favored Glycine 0 CA--C 1.536 1.359 0 CA-C-N 119.416 1.007 . . . . 0.0 114.497 -171.981 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -85.54 150.97 24.29 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.879 1.272 . . . . 0.0 110.738 178.21 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.4 p -64.58 159.38 21.93 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.637 -1.289 . . . . 0.0 111.87 -177.506 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 23.7 ttm180 -53.24 -34.43 57.11 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.27 0.628 . . . . 0.0 111.385 175.186 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.2 m -66.28 -55.47 15.91 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.01 0.823 . . . . 0.0 111.378 172.988 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -57.73 -33.53 68.55 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 118.944 0.793 . . . . 0.0 112.902 179.323 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.8 t -72.26 -49.46 42.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.905 1.282 . . . . 0.0 112.329 172.54 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 39.5 m -64.52 -30.4 71.43 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.987 0.812 . . . . 0.0 112.297 -178.107 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -50.95 -35.57 34.14 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.252 1.421 . . . . 0.0 113.529 170.529 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -90.06 -29.45 18.36 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 117.534 -1.222 . . . . 0.0 113.997 174.214 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 66.8 mt -66.58 -27.77 67.98 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.142 1.337 . . . . 0.0 112.388 176.047 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.1 t -50.5 -51.2 49.58 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.168 0.587 . . . . 0.0 111.887 173.505 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 15.6 t -68.85 -45.72 70.33 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.79 1.236 . . . . 0.0 111.511 170.415 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.499 HD13 ' HG2' ' A' ' 23' ' ' ARG . 6.7 tp -62.53 -32.64 73.62 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 -169.021 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 25.5 mtp-105 -75.8 -37.69 58.92 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.758 0.708 . . . . 0.0 112.535 168.945 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.5 -45.56 84.35 Favored Glycine 0 N--CA 1.469 0.873 0 C-N-CA 124.024 0.821 . . . . 0.0 112.646 -178.484 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.8 m -66.53 -5.59 11.88 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 126.472 1.909 . . . . 0.0 112.336 168.151 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.54 -7.57 57.41 Favored Glycine 0 C--N 1.338 0.675 0 C-N-CA 125.712 1.625 . . . . 0.0 115.315 175.989 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 37.5 mt -65.56 -25.67 67.53 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.934 1.294 . . . . 0.0 113.168 -169.128 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.6 m -119.63 139.29 47.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 125.14 1.376 . . . . 0.0 112.448 167.249 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 24.6 t -130.08 145.73 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 127.046 2.138 . . . . 0.0 109.681 -177.214 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.61 146.85 28.06 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 175.68 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.4 165.42 28.55 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.42 1.488 . . . . 0.0 110.188 172.544 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -89.55 138.04 31.81 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 118.393 -0.813 . . . . 0.0 109.496 165.259 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -95.76 -32.8 12.54 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.273 0.942 . . . . 0.0 112.166 167.277 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 146.77 -32.95 1.42 Allowed Glycine 0 N--CA 1.477 1.37 0 C-N-CA 125.873 1.702 . . . . 0.0 114.549 169.43 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 49.5 ttm-85 -89.17 -34.13 16.8 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 128.075 2.55 . . . . 0.0 111.652 170.523 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.54 179.86 8.78 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 128.084 2.553 . . . . 0.0 109.797 -172.582 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 15.9 m -85.98 161.43 2.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.456 166.723 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.0 ptt180 -138.38 156.17 47.85 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.044 1.737 . . . . 0.0 109.411 -178.619 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -90.88 148.68 22.31 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 106.389 -1.708 . . . . 0.0 106.389 164.395 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.574 ' HA ' HG12 ' A' ' 34' ' ' VAL . . . -148.49 164.73 33.29 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 123.682 0.793 . . . . 0.0 109.154 172.816 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.0 tp -58.87 156.81 10.72 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 122.632 0.373 . . . . 0.0 111.859 169.92 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.73 -30.23 31.34 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -175.023 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 18.3 t0 174.98 167.36 0.28 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 129.976 3.311 . . . . 0.0 109.426 179.608 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 20.2 m -51.37 -22.94 3.25 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.283 1.833 . . . . 0.0 113.182 169.166 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -56.43 -58.39 8.21 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.343 1.057 . . . . 0.0 111.748 170.776 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 22.7 mt -65.35 -32.71 74.5 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 120.408 1.458 . . . . 0.0 110.841 176.034 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -61.12 -29.05 69.54 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.862 0.755 . . . . 0.0 111.073 -177.046 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -70.46 -53.91 14.44 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.731 1.212 . . . . 0.0 112.532 171.281 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.38 -40.01 96.08 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 120.622 1.555 . . . . 0.0 112.582 -178.858 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.34 -40.52 97.52 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.899 2.08 . . . . 0.0 113.165 169.89 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.85 -45.01 5.56 Favored Glycine 0 N--CA 1.476 1.343 0 C-N-CA 127.236 2.35 . . . . 0.0 114.701 -168.943 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 41.5 tp10 -62.3 -25.6 67.95 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 118.144 0.972 . . . . 0.0 108.617 165.204 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 20.6 tp 73.4 170.25 0.31 Allowed 'General case' 0 C--N 1.344 0.349 0 C-N-CA 130.162 3.385 . . . . 0.0 109.422 175.261 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 13.1 m -58.27 -5.39 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 O-C-N 120.24 -1.538 . . . . 0.0 113.573 168.125 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.452 ' C ' ' H ' ' A' ' 93' ' ' VAL . 19.7 mm-40 76.81 -24.87 0.21 Allowed 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 127.038 2.135 . . . . 0.0 111.844 165.409 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 2.3 p -62.89 29.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 128.595 2.758 . . . . 0.0 114.844 172.216 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.452 ' H ' ' C ' ' A' ' 91' ' ' GLN . 2.4 t 79.36 -22.08 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 130.217 3.407 . . . . 0.0 112.935 168.401 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 52.6 tp 132.16 99.8 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.771 1 C-N-CA 132.928 4.491 . . . . 0.0 107.674 -176.503 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.05 139.02 58.16 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 174.792 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 35.1 t -72.52 146.2 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 C-N-CA 124.658 1.183 . . . . 0.0 113.713 -169.024 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -77.21 51.24 0.82 Allowed 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 126.07 1.748 . . . . 0.0 113.291 173.203 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.6 p -122.19 151.45 40.99 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 125.748 1.619 . . . . 0.0 113.434 -176.025 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -88.35 115.17 25.66 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 165.791 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 53.0 mm-40 -140.43 140.14 22.19 Favored Pre-proline 0 CA--C 1.536 0.429 0 C-N-CA 124.121 0.968 . . . . 0.0 109.738 171.114 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -72.55 145.47 42.18 Favored 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 123.728 2.952 . . . . 0.0 113.77 -168.288 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 14.3 t -70.66 70.22 0.45 Allowed 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.376 1.47 . . . . 0.0 111.308 171.08 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 3.3 p -146.8 21.35 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -175.38 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . 70.14 -0.24 2.87 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 169.714 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.552 ' CD ' ' H ' ' A' ' 106' ' ' ARG . 0.0 OUTLIER -153.99 -171.61 3.94 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 127.545 2.338 . . . . 0.0 110.167 174.418 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.552 ' H ' ' CD ' ' A' ' 105' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.772 0 C-N-CA 129.817 3.247 . . . . 0.0 109.235 -168.85 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.827 0 CA-C-O 119.396 -0.335 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -66.32 -41.25 89.92 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 119.758 -1.839 . . . . 0.0 113.504 -170.377 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.61 -23.36 66.8 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 119.645 1.111 . . . . 0.0 113.285 178.841 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . 0.472 HH21 ' CB ' ' B' ' 61' ' ' CYS . 3.4 tpt85 -82.25 -58.3 3.01 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.879 1.671 . . . . 0.0 110.759 169.004 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -64.75 -50.86 65.2 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 128.226 2.61 . . . . 0.0 112.655 -173.141 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -62.9 -39.08 97.59 Favored Glycine 0 CA--C 1.526 0.721 0 O-C-N 121.216 -0.927 . . . . 0.0 111.512 177.384 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.406 ' HA ' ' HB3' ' B' ' 19' ' ' ALA . 65.5 ttt180 -65.57 -34.54 78.47 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.64 0.776 . . . . 0.0 111.812 174.426 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.15 -24.97 65.16 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.473 1.033 . . . . 0.0 112.651 173.43 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.0 mp -101.7 -9.27 21.03 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.862 0.865 . . . . 0.0 113.088 174.571 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.406 ' HB3' ' HA ' ' B' ' 16' ' ' ARG . . . -85.19 -19.86 31.08 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.756 1.623 . . . . 0.0 113.242 167.233 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -54.08 151.17 13.24 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 127.381 2.272 . . . . 0.0 113.571 173.055 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -66.92 -100.84 0.0 OUTLIER 'Trans proline' 0 CA--C 1.547 1.161 1 C-N-CA 127.194 5.262 . . . . 0.0 112.663 -171.91 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -47.46 -28.01 1.97 Allowed 'General case' 0 C--N 1.342 0.241 0 C-N-CA 126.467 1.907 . . . . 0.0 112.936 169.973 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.671 HH21 ' CB ' ' B' ' 57' ' ' CYS . 0.2 OUTLIER -68.93 -47.93 64.5 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 119.65 1.113 . . . . 0.0 113.66 177.85 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 43.3 t -60.41 -42.18 95.43 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.866 1.212 . . . . 0.0 110.728 172.757 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 19.3 mmt-85 -58.03 -43.14 86.59 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 174.437 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 1.1 mt -47.37 -57.7 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 CA-C-N 118.782 0.719 . . . . 0.0 109.185 169.155 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.758 HD22 HD21 ' B' ' 77' ' ' LEU . 63.6 mt -62.22 -44.72 95.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 117.365 -1.303 . . . . 0.0 112.608 -171.167 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 2.7 m -61.49 -33.3 56.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 CA-C-N 120.391 1.451 . . . . 0.0 111.698 176.34 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.01 -17.22 47.57 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 123.929 0.891 . . . . 0.0 113.37 177.617 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 tp -72.55 -42.12 65.02 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 117.366 -1.302 . . . . 0.0 111.446 169.115 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.03 -51.09 25.55 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.829 2.052 . . . . 0.0 112.475 -173.229 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -99.51 10.79 40.73 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.546 1.938 . . . . 0.0 112.581 -178.338 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -119.07 -80.44 0.68 Allowed Glycine 0 C--N 1.34 0.796 0 C-N-CA 126.46 1.981 . . . . 0.0 112.821 -173.388 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 9.1 m 35.58 37.68 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 126.559 1.944 . . . . 0.0 115.169 -169.995 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -82.33 -71.94 0.46 Allowed 'General case' 0 C--O 1.223 -0.327 0 O-C-N 120.842 -1.161 . . . . 0.0 112.357 -171.756 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -136.01 -176.18 0.55 Allowed Pre-proline 0 CA--C 1.553 1.096 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 -168.547 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -79.51 95.92 1.05 Allowed 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 121.734 1.623 . . . . 0.0 108.964 -174.386 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 80.54 29.59 43.4 Favored Glycine 0 CA--C 1.532 1.114 0 CA-C-O 119.177 -0.79 . . . . 0.0 113.92 -177.648 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -60.73 -22.47 64.03 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.317 1.559 . . . . 0.0 112.0 169.889 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 8.1 mt -48.34 -20.87 0.44 Allowed 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 127.368 2.267 . . . . 0.0 113.455 171.018 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.28 -28.89 70.03 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.961 0.801 . . . . 0.0 112.055 176.958 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.01 -50.74 12.45 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.324 0.65 . . . . 0.0 110.55 168.904 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -56.91 -37.5 71.53 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -177.248 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 21.6 mt -97.58 -13.74 21.43 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.334 1.453 . . . . 0.0 112.28 -177.497 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.19 -6.58 4.0 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.691 1.139 . . . . 0.0 114.532 -171.349 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -84.12 147.65 27.23 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.91 1.355 . . . . 0.0 110.042 -179.532 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 1.7 p -59.93 155.29 16.9 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 121.677 -0.639 . . . . 0.0 111.311 -177.881 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -53.15 -35.77 60.11 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.099 178.054 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 11.6 m -64.26 -58.63 5.98 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.017 0.927 . . . . 0.0 111.514 172.139 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -55.16 -36.36 65.75 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.444 1.02 . . . . 0.0 113.262 -178.255 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 59.5 t -76.53 -43.4 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.465 0.706 . . . . 0.0 112.346 174.467 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 70.5 m -62.37 -30.67 71.36 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 119.763 1.165 . . . . 0.0 112.882 178.972 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -56.11 -28.97 59.88 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.879 1.271 . . . . 0.0 113.201 171.603 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 -90.46 -30.5 17.29 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-O 117.507 -1.235 . . . . 0.0 114.036 169.613 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 91.1 mt -64.79 -38.3 90.51 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 120.656 1.571 . . . . 0.0 113.035 177.808 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 1.2 m -60.3 -29.8 69.07 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 179.831 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . 0.671 ' CB ' HH21 ' B' ' 23' ' ' ARG . 40.0 t -75.86 -41.05 53.42 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.318 0.963 . . . . 0.0 110.682 169.017 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.453 HD13 ' HG2' ' B' ' 23' ' ' ARG . 5.5 tp -57.79 -38.68 75.93 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 125.54 1.536 . . . . 0.0 112.597 -174.819 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 58.5 mtm-85 -73.03 -35.33 66.74 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 118.47 0.577 . . . . 0.0 112.098 174.458 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.82 -44.16 7.9 Favored Glycine 0 N--CA 1.468 0.774 0 C-N-CA 124.188 0.899 . . . . 0.0 112.855 -170.287 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . 0.472 ' CB ' HH21 ' B' ' 13' ' ' ARG . 94.4 m -74.18 16.21 0.26 Allowed 'General case' 0 CA--C 1.57 1.73 0 C-N-CA 125.837 1.655 . . . . 0.0 112.183 169.538 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 69.36 28.13 72.88 Favored Glycine 0 C--N 1.343 0.938 0 C-N-CA 127.38 2.419 . . . . 0.0 117.383 167.783 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.519 ' O ' HD23 ' B' ' 77' ' ' LEU . 56.1 mt -92.96 -32.64 14.47 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.183 0.992 . . . . 0.0 113.272 -177.782 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -134.56 138.57 49.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 C-N-CA 125.469 1.508 . . . . 0.0 113.598 -175.72 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 97.1 t -126.15 136.19 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 126.956 2.102 . . . . 0.0 108.83 179.856 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -77.64 141.13 39.61 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.782 0.833 . . . . 0.0 112.141 177.346 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -141.85 154.74 45.37 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.9 0.88 . . . . 0.0 108.828 171.817 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -73.83 132.62 42.75 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 167.715 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.53 -31.84 42.15 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.475 0.71 . . . . 0.0 110.887 166.86 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 145.61 -35.78 1.39 Allowed Glycine 0 CA--C 1.533 1.168 0 C-N-CA 126.51 2.005 . . . . 0.0 113.506 173.92 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 56.4 ttm-85 -96.06 -36.08 11.14 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 127.146 2.179 . . . . 0.0 111.886 169.921 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.38 -171.09 3.71 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.484 1.513 . . . . 0.0 110.768 -178.736 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 17.6 m -100.62 146.0 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.569 1.148 . . . . 0.0 111.106 176.459 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 9.0 ptt180 -116.39 172.26 7.31 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 126.537 1.935 . . . . 0.0 109.764 177.732 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -111.5 110.68 21.22 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 167.898 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -108.43 143.84 36.83 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.502 0.592 . . . . 0.0 109.49 176.06 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.758 HD21 HD22 ' B' ' 27' ' ' LEU . 8.5 mt -52.97 144.17 15.53 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 122.952 0.501 . . . . 0.0 110.864 169.385 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.28 -30.24 70.35 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 113.747 1.018 . . . . 0.0 113.747 -168.136 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -158.03 155.64 29.69 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 122.737 1.256 . . . . 0.0 111.622 167.387 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -39.95 -32.23 0.15 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 129.751 3.221 . . . . 0.0 113.264 167.185 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -52.95 -51.57 60.96 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.608 1.563 . . . . 0.0 112.844 169.532 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 11.8 mt -69.0 -44.35 72.98 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 119.225 0.921 . . . . 0.0 110.049 -178.881 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.59 -33.56 55.28 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.252 1.021 . . . . 0.0 112.617 173.52 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -69.61 -54.09 15.67 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.7 1.2 . . . . 0.0 113.479 173.28 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.31 -38.4 91.01 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 120.249 1.386 . . . . 0.0 112.672 178.619 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 60.1 tp -60.86 -41.52 96.08 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.099 1.76 . . . . 0.0 112.872 169.222 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.36 -44.91 6.37 Favored Glycine 0 N--CA 1.474 1.18 0 C-N-CA 127.167 2.318 . . . . 0.0 115.198 -169.062 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -63.15 -27.07 69.12 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 118.297 1.048 . . . . 0.0 109.156 166.641 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 30.6 tp 77.18 163.05 0.23 Allowed 'General case' 0 C--N 1.345 0.38 0 C-N-CA 129.971 3.308 . . . . 0.0 109.487 173.313 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . 0.489 HG23 HG12 ' B' ' 92' ' ' VAL . 14.9 m -54.21 -5.77 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 O-C-N 120.203 -1.561 . . . . 0.0 114.564 168.05 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 72.13 -20.32 0.26 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.739 2.015 . . . . 0.0 114.218 164.491 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.489 HG12 HG23 ' B' ' 90' ' ' VAL . 9.2 p -65.66 38.98 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 131.045 3.738 . . . . 0.0 114.275 -177.931 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 1.1 t 70.97 17.42 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 C-N-CA 126.387 1.875 . . . . 0.0 111.897 175.127 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 56.8 tp 73.95 108.17 0.07 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 129.596 3.158 . . . . 0.0 109.371 -168.507 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -69.69 136.15 50.71 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 175.79 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 22.9 t -89.53 147.45 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 125.725 1.61 . . . . 0.0 113.004 -168.47 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -77.32 33.85 0.16 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 127.24 2.216 . . . . 0.0 114.611 174.144 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 4.5 p -87.1 150.35 24.06 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 125.362 1.465 . . . . 0.0 110.128 169.347 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -111.74 126.5 55.13 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 167.728 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 54.3 mm-40 -158.89 153.33 20.41 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 127.482 2.313 . . . . 0.0 108.338 -172.762 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -69.39 140.46 44.11 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 122.512 2.142 . . . . 0.0 111.589 178.379 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 44.6 t -67.13 25.13 0.02 OUTLIER 'General case' 0 CA--C 1.572 1.802 0 C-N-CA 128.468 2.707 . . . . 0.0 113.858 177.904 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 4.3 p -97.51 24.69 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 129.058 2.943 . . . . 0.0 114.499 -167.447 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . 80.03 -31.02 0.13 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 127.284 2.234 . . . . 0.0 115.058 169.795 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -134.37 155.87 49.51 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.869 1.268 . . . . 0.0 112.32 176.588 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . 0.282 22.9 ttt180 . . . . . 0 N--CA 1.477 0.92 1 C-N-CA 134.154 4.981 . . . . 0.0 109.511 168.885 . . . . . . . . 2 1 . 1 . 027 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.7 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 pp -62.95 -38.53 91.41 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.451 1.023 . . . . 0.0 112.81 -169.356 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.49 -26.31 67.83 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 174.221 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.6 mmt-85 -79.33 -43.09 24.24 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.33 -0.843 . . . . 0.0 110.911 168.967 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -56.18 -48.12 76.96 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.904 1.682 . . . . 0.0 112.622 -177.07 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -72.61 -26.59 71.23 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-O 119.539 -0.589 . . . . 0.0 112.56 -177.02 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.5 tmm_? -70.75 -45.44 64.82 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 118.322 1.061 . . . . 0.0 108.688 166.8 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.01 -22.55 66.97 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.019 1.328 . . . . 0.0 113.988 -176.964 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.7 mp -99.9 -3.45 32.4 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.894 1.225 . . . . 0.0 113.125 168.949 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -86.76 1.38 52.41 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.555 1.142 . . . . 0.0 113.165 167.926 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.82 160.78 71.65 Favored Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 127.177 2.191 . . . . 0.0 114.145 -172.003 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -72.4 -121.68 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.125 1 C-N-CA 126.061 4.508 . . . . 0.0 110.139 173.079 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.9 m -56.97 -21.07 27.51 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.014 1.326 . . . . 0.0 113.405 179.946 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.04 -39.64 79.08 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 120.6 1.546 . . . . 0.0 112.254 173.547 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 5.7 t -71.28 -28.08 63.88 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.661 -1.274 . . . . 0.0 111.483 169.623 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.9 tpp180 -61.68 -40.25 94.31 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 120.742 -1.224 . . . . 0.0 111.769 170.766 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.496 HG23 HD13 ' A' ' 40' ' ' LEU . 1.9 mm -57.17 -43.49 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 124.873 1.269 . . . . 0.0 112.43 171.585 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 71.6 mt -60.11 -47.0 87.72 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 119.129 -0.462 . . . . 0.0 111.74 174.769 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.4 p -76.55 -26.59 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -171.869 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.84 -21.52 37.54 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 173.334 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.3 tp -77.63 -29.43 51.76 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 120.947 1.703 . . . . 0.0 112.117 170.602 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.42 -49.68 17.77 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.84 2.056 . . . . 0.0 112.51 170.129 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -101.31 29.84 4.53 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 128.538 2.735 . . . . 0.0 110.55 174.703 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -128.02 -84.45 0.45 Allowed Glycine 0 CA--C 1.527 0.791 0 C-N-CA 125.6 1.571 . . . . 0.0 113.256 -177.542 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 26.9 m 31.77 31.4 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 118.347 2.721 . . . . 0.0 118.347 -171.172 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 96.3 m -83.3 -87.33 0.1 Allowed 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 125.316 1.446 . . . . 0.0 110.861 175.821 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -136.37 153.23 76.18 Favored Pre-proline 0 N--CA 1.472 0.63 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -169.569 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -56.53 135.02 68.05 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.991 1.794 . . . . 0.0 109.096 171.882 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.72 -5.89 67.87 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 117.874 -1.515 . . . . 0.0 114.854 -174.961 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.88 -28.89 64.6 Favored 'General case' 0 C--N 1.348 0.539 0 CA-C-N 120.499 2.149 . . . . 0.0 112.38 177.284 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.496 HD13 HG23 ' A' ' 26' ' ' ILE . 4.0 mt -69.09 -16.1 63.6 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 124.262 1.025 . . . . 0.0 111.952 -175.762 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.58 -47.54 66.51 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 119.772 1.169 . . . . 0.0 110.36 174.315 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.48 -39.97 85.26 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.849 -0.532 . . . . 0.0 111.789 172.587 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -71.78 -27.85 63.22 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -175.796 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 37.6 mt -95.96 -22.79 17.19 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.316 1.046 . . . . 0.0 112.16 173.749 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.54 9.81 86.72 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.319 0.961 . . . . 0.0 112.003 -167.97 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 80.3 mt -108.26 167.57 9.93 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.954 1.302 . . . . 0.0 112.445 -169.358 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.7 p -69.15 143.26 54.14 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.526 0.679 . . . . 0.0 112.537 -167.882 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -56.71 -31.49 64.56 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.44 1.096 . . . . 0.0 111.157 172.024 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 12.4 m -66.0 -54.43 26.24 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.14 0.976 . . . . 0.0 111.445 171.096 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -70.43 -35.46 73.41 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.464 1.029 . . . . 0.0 112.239 -175.531 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.405 HG22 HD11 ' A' ' 26' ' ' ILE . 6.3 t -61.78 -34.69 63.61 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 O-C-N 119.57 -1.956 . . . . 0.0 111.865 169.779 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 56.0 m -67.53 -41.93 83.57 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 120.134 1.334 . . . . 0.0 112.523 172.753 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -50.7 -45.98 58.63 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.66 0.784 . . . . 0.0 110.735 171.973 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -68.93 -33.9 74.5 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 -179.189 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 23.8 mt -88.89 -7.32 56.31 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.807 1.243 . . . . 0.0 113.988 -178.172 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 1.7 t -67.05 -51.18 57.82 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 120.194 1.361 . . . . 0.0 110.886 177.217 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 5.2 t -73.8 -39.84 63.83 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 122.893 0.477 . . . . 0.0 111.76 179.767 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.3 tp -55.25 -38.19 68.21 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.778 2.031 . . . . 0.0 113.556 -174.036 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.7 mtm180 -78.51 -23.11 46.49 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.46 1.104 . . . . 0.0 112.178 -179.741 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -80.49 -55.51 3.41 Favored Glycine 0 C--N 1.342 0.908 0 C-N-CA 125.861 1.696 . . . . 0.0 110.78 172.766 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 66.6 m -51.08 -16.12 0.42 Allowed 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 127.413 2.285 . . . . 0.0 113.164 173.184 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.4 ' O ' ' HB2' ' A' ' 78' ' ' ALA . . . 79.35 -3.24 67.92 Favored Glycine 0 C--N 1.338 0.677 0 C-N-CA 125.91 1.719 . . . . 0.0 113.716 179.468 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 34.5 mt -57.17 -26.57 60.83 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 118.495 1.148 . . . . 0.0 112.323 -179.044 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 6.1 m -133.21 156.88 42.49 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.102 0 C-N-CA 126.488 1.915 . . . . 0.0 111.384 169.204 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.5 m -148.92 151.5 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 126.043 1.737 . . . . 0.0 111.349 -171.907 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -88.4 140.27 29.63 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.355 1.462 . . . . 0.0 112.416 176.94 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 90.2 m -160.84 158.83 29.04 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.774 1.63 . . . . 0.0 107.777 -179.892 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -84.97 138.15 32.66 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 121.57 1.986 . . . . 0.0 112.011 169.6 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.0 -10.2 57.26 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 169.866 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 131.29 -22.5 4.43 Favored Glycine 0 N--CA 1.474 1.205 0 C-N-CA 125.96 1.743 . . . . 0.0 114.751 174.697 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.94 5.71 0.3 Allowed 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.056 2.142 . . . . 0.0 113.886 -179.909 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -152.67 157.64 41.23 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 128.62 2.768 . . . . 0.0 108.043 168.641 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 5.6 p -79.78 145.85 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 168.642 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 28.9 ptt85 -124.7 148.2 48.16 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 125.535 1.534 . . . . 0.0 109.837 -177.494 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -100.42 135.08 42.41 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 105.443 -2.058 . . . . 0.0 105.443 164.902 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -145.87 158.3 43.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 118.19 -0.909 . . . . 0.0 111.541 -176.003 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 tp -56.53 154.86 8.0 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.064 0.945 . . . . 0.0 112.688 176.342 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 62' ' ' GLY . . . -59.14 -11.08 3.27 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 117.83 2.53 . . . . 0.0 117.83 -175.898 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.0 t70 152.1 161.62 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 131.165 3.786 . . . . 0.0 109.549 -177.371 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -41.33 -22.51 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 129.372 3.069 . . . . 0.0 112.099 163.579 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.49 -64.12 0.96 Allowed 'General case' 0 C--N 1.349 0.563 0 C-N-CA 126.621 1.968 . . . . 0.0 111.485 175.21 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 25.3 mt -56.27 -43.77 79.09 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.701 1.137 . . . . 0.0 108.741 173.928 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -53.53 -44.65 69.35 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.512 1.125 . . . . 0.0 112.148 -172.884 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -79.67 -15.09 58.22 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 115.706 1.743 . . . . 0.0 115.706 -175.887 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -92.78 -48.45 6.56 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.695 1.134 . . . . 0.0 110.956 170.278 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.5 tp -49.62 -45.83 48.62 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.641 1.976 . . . . 0.0 110.824 169.679 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.81 -19.33 79.31 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 126.796 2.141 . . . . 0.0 116.433 -170.925 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -101.54 -0.88 34.21 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 118.928 1.364 . . . . 0.0 113.047 170.208 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.6 tp 93.7 23.57 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 129.19 2.996 . . . . 0.0 113.68 169.219 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.285 3.9 t 71.34 37.98 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 125.47 1.508 . . . . 0.0 110.04 169.436 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 86.61 -21.98 0.18 Allowed 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.309 -0.869 . . . . 0.0 112.329 130.021 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.9 p -72.66 39.25 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 129.428 3.091 . . . . 0.0 112.566 171.94 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.6 m 52.44 10.61 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.246 0 C-N-CA 128.627 2.771 . . . . 0.0 116.425 -179.903 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.8 tt 100.35 101.37 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 130.857 3.663 . . . . 0.0 108.829 -169.719 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -103.1 155.66 18.24 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.258 0.623 . . . . 0.0 111.035 170.255 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 31.3 m -98.24 150.25 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -171.681 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 59.7 p30 -99.57 -4.07 31.92 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.999 1.481 . . . . 0.0 114.999 -179.713 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -75.71 40.0 0.18 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 127.708 2.403 . . . . 0.0 115.701 -167.015 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 45.8 t0 62.88 69.56 0.59 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 126.812 2.045 . . . . 0.0 110.081 170.66 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.97 164.57 33.23 Favored Pre-proline 0 CA--C 1.549 0.925 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.531 -169.879 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -83.21 172.75 10.41 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 124.292 3.328 . . . . 0.0 111.819 177.663 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 31.0 p -62.0 -52.8 62.54 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 123.073 1.416 . . . . 0.0 107.26 165.532 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 2.6 p 171.47 -50.25 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.421 1 C-N-CA 133.032 4.533 . . . . 0.0 109.922 167.116 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.19 -29.0 64.63 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -169.916 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -81.01 140.13 35.35 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.146 0.978 . . . . 0.0 110.653 173.978 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 39.3 ttt85 . . . . . 0 N--CA 1.472 0.636 0 O-C-N 121.523 -0.736 . . . . 0.0 112.233 170.657 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.485 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 pp -60.23 -34.82 74.22 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 119.63 1.105 . . . . 0.0 113.433 -167.514 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.67 -27.85 68.97 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 118.624 0.647 . . . . 0.0 112.49 175.548 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 1.3 mmt-85 -77.16 -26.36 52.92 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 116.854 -1.546 . . . . 0.0 113.413 176.979 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -56.71 -63.97 1.03 Allowed 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.785 1.175 . . . . 0.0 109.5 170.928 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.27 -37.71 95.31 Favored Glycine 0 N--CA 1.471 0.972 0 CA-C-N 118.22 0.464 . . . . 0.0 112.704 -172.764 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -46.58 88.98 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.698 0.799 . . . . 0.0 111.292 173.799 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -72.55 -14.72 61.7 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 118.239 -0.886 . . . . 0.0 112.893 -179.625 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 10.6 mp -93.39 -24.21 18.15 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.169 0.895 . . . . 0.0 112.607 170.624 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.18 -16.64 57.71 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.894 1.678 . . . . 0.0 113.776 169.443 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -59.36 130.64 87.5 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 126.423 1.889 . . . . 0.0 109.511 176.643 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -48.92 -72.3 0.05 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.554 1 C-N-CA 125.869 4.379 . . . . 0.0 111.918 -168.59 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 70.8 m -91.56 -15.43 28.69 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 117.914 -1.041 . . . . 0.0 112.082 -173.739 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 48.4 mtt180 -66.1 -33.97 76.99 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 121.415 1.916 . . . . 0.0 110.779 167.997 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 42.4 t -56.75 -46.03 81.64 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 120.024 1.284 . . . . 0.0 111.15 167.309 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -60.88 -46.71 89.55 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.56 0.744 . . . . 0.0 111.866 176.539 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.6 mm -57.85 -49.93 79.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 124.953 1.301 . . . . 0.0 112.06 174.706 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 85.8 mt -62.11 -45.34 93.89 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.092 0.957 . . . . 0.0 111.496 -178.767 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 5.7 p -74.81 -32.5 28.37 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 CA-C-N 118.868 0.758 . . . . 0.0 112.979 -179.501 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.95 -28.83 64.77 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.494 -0.754 . . . . 0.0 111.875 173.857 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 11.7 tp -65.3 -36.27 83.54 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-N 119.973 1.26 . . . . 0.0 113.507 175.509 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.96 -40.57 30.93 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.999 2.52 . . . . 0.0 113.077 171.414 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -98.24 9.14 43.68 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 127.023 2.129 . . . . 0.0 112.307 179.499 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -126.0 -82.61 0.46 Allowed Glycine 0 CA--C 1.527 0.815 0 C-N-CA 124.746 1.165 . . . . 0.0 115.147 -169.725 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 34.6 m 36.93 32.13 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 C-N-CA 127.884 2.474 . . . . 0.0 116.707 -168.57 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 68.2 m -79.75 -90.65 0.05 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.662 0.785 . . . . 0.0 111.019 179.716 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -136.72 154.65 76.64 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -169.174 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -55.89 125.69 19.94 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.316 2.011 . . . . 0.0 109.696 175.55 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 90.03 -7.27 81.96 Favored Glycine 0 CA--C 1.533 1.178 0 CA-C-O 117.6 -1.667 . . . . 0.0 115.348 -174.409 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -27.05 63.17 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.666 2.233 . . . . 0.0 112.137 178.938 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 2.1 mp -71.35 -18.88 62.36 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-O 117.913 -1.042 . . . . 0.0 113.075 -177.653 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.09 -40.9 97.24 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.88 1.218 . . . . 0.0 111.206 172.443 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.04 -44.13 66.43 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.652 -0.655 . . . . 0.0 111.714 170.122 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.96 -29.23 70.65 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -177.714 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 45.9 mt -103.76 -14.06 16.21 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.336 1.454 . . . . 0.0 113.824 179.18 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.98 -0.51 45.59 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 119.004 0.82 . . . . 0.0 113.797 -169.153 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 43.3 mt -92.37 157.96 16.33 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.757 1.279 . . . . 0.0 111.653 -171.38 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 13.3 p -62.25 147.43 48.02 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.134 0.492 . . . . 0.0 110.91 -174.594 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 ptp180 -57.94 -33.6 68.98 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 122.148 -0.345 . . . . 0.0 111.834 175.883 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 15.9 m -65.68 -49.29 69.11 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.649 0.779 . . . . 0.0 111.532 171.345 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -66.07 -43.03 88.57 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 118.897 0.771 . . . . 0.0 111.246 -178.612 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 4.2 t -59.88 -32.04 48.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 O-C-N 119.303 -2.123 . . . . 0.0 112.55 170.371 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 54.8 m -67.66 -39.93 84.5 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.922 1.237 . . . . 0.0 113.204 172.468 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -50.15 -46.79 54.3 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.976 0.911 . . . . 0.0 110.715 171.215 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -67.18 -45.42 77.0 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 118.523 -0.751 . . . . 0.0 112.162 -179.311 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 32.2 mt -73.49 -22.55 60.11 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.963 1.098 . . . . 0.0 113.963 -177.828 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -56.49 -53.11 61.27 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.137 1.335 . . . . 0.0 113.685 -176.758 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 2.3 t -70.64 -40.17 73.24 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 118.654 0.661 . . . . 0.0 110.727 177.507 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 2.0 tp -56.23 -38.39 70.99 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 127.796 2.439 . . . . 0.0 114.743 -173.32 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 46.9 mtm105 -78.76 -16.05 57.68 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.276 1.03 . . . . 0.0 112.757 177.43 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -85.4 -54.39 2.84 Favored Glycine 0 C--N 1.341 0.847 0 C-N-CA 125.82 1.676 . . . . 0.0 111.025 169.715 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 99.4 m -50.94 -16.26 0.41 Allowed 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 127.549 2.34 . . . . 0.0 113.296 175.162 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 78.11 -4.18 59.19 Favored Glycine 0 C--N 1.338 0.684 0 C-N-CA 125.99 1.757 . . . . 0.0 113.526 -178.394 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 68.3 mt -56.11 -28.65 58.65 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.633 1.217 . . . . 0.0 112.286 178.707 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 8.1 m -132.22 155.64 41.68 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.131 0 C-N-CA 126.025 1.73 . . . . 0.0 111.451 169.642 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 1.7 m -147.63 151.63 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 125.73 1.612 . . . . 0.0 111.443 -170.213 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -94.13 140.25 29.98 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.442 1.497 . . . . 0.0 111.544 178.006 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.432 HG22 ' N ' ' B' ' 68' ' ' TYR . 47.7 m -163.15 171.97 15.54 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.547 1.539 . . . . 0.0 108.375 -174.442 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.432 ' N ' HG22 ' B' ' 67' ' ' THR . 6.5 m-85 -88.15 145.04 26.13 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 121.04 1.746 . . . . 0.0 111.878 167.807 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.19 -44.71 13.68 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.461 -0.774 . . . . 0.0 111.328 170.533 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -176.25 -25.55 0.03 OUTLIER Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.553 1.549 . . . . 0.0 114.266 171.368 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.76 -29.73 0.78 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.042 1.737 . . . . 0.0 112.751 176.952 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -117.38 166.55 12.18 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.326 2.25 . . . . 0.0 110.255 176.982 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 8.7 p -79.78 147.93 6.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.641 172.255 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 14.0 ptt85 -130.65 160.93 32.77 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 127.983 2.513 . . . . 0.0 109.646 -177.306 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 21.2 m-30 -104.59 146.56 28.73 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 161.924 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -148.72 157.97 43.82 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 124.376 1.07 . . . . 0.0 110.299 178.807 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 58.3 mt -62.56 155.28 26.34 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.604 0.638 . . . . 0.0 111.529 172.279 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -50.49 -21.5 1.52 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 128.155 2.582 . . . . 0.0 117.3 -176.128 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 8.3 t70 167.4 168.2 0.03 OUTLIER 'General case' 0 C--O 1.24 0.558 0 C-N-CA 130.669 3.588 . . . . 0.0 108.282 177.167 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -42.02 -20.25 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 127.782 2.433 . . . . 0.0 111.778 162.087 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -63.18 1.3 Allowed 'General case' 0 C--N 1.346 0.415 0 C-N-CA 127.885 2.474 . . . . 0.0 111.742 175.5 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 34.1 mt -65.1 -35.86 82.46 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 119.384 0.993 . . . . 0.0 109.683 176.25 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.65 -41.72 82.05 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 177.238 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -81.76 -21.59 37.73 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -176.678 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -85.84 -44.31 12.55 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.024 0.829 . . . . 0.0 111.567 171.204 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.74 -39.93 88.13 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 122.762 0.425 . . . . 0.0 111.042 175.564 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.15 -18.96 58.75 Favored Glycine 0 CA--C 1.53 0.994 0 C-N-CA 125.686 1.612 . . . . 0.0 115.638 -176.698 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.6 -2.23 25.38 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 169.877 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 17.6 tp 106.17 2.26 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 130.596 3.559 . . . . 0.0 114.476 167.542 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . 0.306 2.9 t 80.58 40.6 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 125.939 1.696 . . . . 0.0 110.068 -177.871 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 86.81 -26.41 0.09 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.367 -0.833 . . . . 0.0 113.049 127.046 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 13.7 p -68.58 31.1 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.918 1 C-N-CA 131.787 4.035 . . . . 0.0 113.595 175.955 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 31.1 m 47.08 25.62 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 127.334 2.254 . . . . 0.0 115.84 -177.107 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 tt 97.74 98.78 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 130.502 3.521 . . . . 0.0 110.506 -179.348 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -102.25 144.13 31.15 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.872 -0.517 . . . . 0.0 110.691 169.567 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 33.4 m -90.6 156.65 3.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 C-N-CA 124.272 1.029 . . . . 0.0 113.375 -173.327 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -102.19 -8.14 21.59 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 178.005 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.77 44.07 0.16 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 128.169 2.588 . . . . 0.0 116.333 -166.142 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 43.8 t0 56.46 64.87 1.56 Allowed 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 127.465 2.306 . . . . 0.0 110.048 168.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.9 167.91 16.77 Favored Pre-proline 0 CA--C 1.556 1.207 0 CA-C-N 114.502 -1.226 . . . . 0.0 110.388 -177.814 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -80.42 173.84 11.94 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 123.685 2.924 . . . . 0.0 112.118 -179.198 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 30.0 p -58.93 -50.11 75.29 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 166.501 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 4.8 p 168.37 -47.29 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.384 1 C-N-CA 132.498 4.319 . . . . 0.0 109.9 167.629 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.26 -34.61 68.36 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.82 1.248 . . . . 0.0 113.675 -170.185 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -76.26 150.43 37.0 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.588 1.155 . . . . 0.0 110.563 174.238 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 43.4 ttt85 . . . . . 0 N--CA 1.472 0.648 0 O-C-N 121.261 -0.9 . . . . 0.0 112.568 173.425 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.247 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 pp -57.8 -37.27 73.44 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.859 0.754 . . . . 0.0 111.588 179.345 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.29 -11.2 60.61 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.167 0.987 . . . . 0.0 113.27 -179.176 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.0 mmp_? -108.5 -25.62 10.84 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.731 -1.231 . . . . 0.0 113.354 171.215 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -53.82 -45.78 70.95 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.408 1.083 . . . . 0.0 109.464 169.267 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -65.03 -36.6 93.24 Favored Glycine 0 CA--C 1.535 1.287 0 CA-C-O 119.349 -0.695 . . . . 0.0 113.365 175.148 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -45.65 92.09 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 118.975 1.388 . . . . 0.0 110.311 177.602 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.46 98.09 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.565 1.146 . . . . 0.0 111.94 176.756 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.6 mt -78.61 -15.11 58.91 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 117.918 -1.039 . . . . 0.0 113.271 177.612 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -85.86 -26.8 25.46 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 169.74 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -47.83 143.37 6.24 Favored Pre-proline 0 CA--C 1.543 0.689 0 C-N-CA 126.069 1.747 . . . . 0.0 113.571 -173.865 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -61.15 -74.62 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.607 1 C-N-CA 125.604 4.202 . . . . 0.0 111.956 -169.762 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 46.7 m -59.1 -37.94 78.35 Favored 'General case' 0 C--O 1.224 -0.26 0 O-C-N 121.834 -0.541 . . . . 0.0 110.429 172.092 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.55 -32.38 68.04 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 116.093 1.886 . . . . 0.0 116.093 -169.019 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.7 t -64.88 -46.89 79.89 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 121.369 1.895 . . . . 0.0 108.273 167.28 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 32.9 ttm-85 -62.55 -15.83 52.87 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.157 1.383 . . . . 0.0 114.661 175.28 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 3.3 mt -71.71 -55.93 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 CA-C-N 121.46 1.937 . . . . 0.0 108.886 167.571 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.02 -33.24 70.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 117.889 -1.053 . . . . 0.0 113.685 -172.269 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.4 m -60.48 -27.25 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 CA-C-N 119.658 1.117 . . . . 0.0 112.072 173.974 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -104.17 8.05 36.24 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.616 1.966 . . . . 0.0 112.398 -179.038 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.465 HD22 ' HA ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -104.94 -22.12 13.19 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.016 1.726 . . . . 0.0 113.061 172.013 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.14 -59.14 5.75 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.411 1.885 . . . . 0.0 107.007 166.298 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -96.77 35.52 1.52 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 128.213 2.605 . . . . 0.0 112.202 173.716 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -110.61 -98.89 2.51 Favored Glycine 0 N--CA 1.472 1.049 0 O-C-N 120.889 -1.132 . . . . 0.0 113.721 -172.152 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.4 m 43.35 14.67 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 N-CA-C 120.268 3.433 . . . . 0.0 120.268 173.07 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 72.6 m -80.7 -89.88 0.06 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.347 0.976 . . . . 0.0 111.058 175.699 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.461 ' H ' ' HG2' ' A' ' 39' ' ' GLN . 0.5 OUTLIER -133.02 158.14 76.6 Favored Pre-proline 0 CA--C 1.55 0.977 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -168.077 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -59.57 131.22 39.15 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.438 2.759 . . . . 0.0 110.717 177.867 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 71.09 -2.47 18.6 Favored Glycine 0 CA--C 1.534 1.241 0 CA-C-O 117.783 -1.565 . . . . 0.0 115.079 -179.072 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.461 ' HG2' ' H ' ' A' ' 36' ' ' TYR . 2.6 pp0? -60.21 -30.32 69.3 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 120.468 2.134 . . . . 0.0 111.71 -178.637 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 mt -46.87 -26.95 1.08 Allowed 'General case' 0 C--O 1.219 -0.535 0 C-N-CA 126.141 1.777 . . . . 0.0 112.992 174.555 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.74 -39.71 71.53 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 175.096 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.68 -42.77 57.83 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.139 0.881 . . . . 0.0 111.467 172.361 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -31.2 70.38 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 125.689 1.596 . . . . 0.0 113.698 -178.502 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 25.7 mt -103.18 -13.98 16.56 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.814 2.046 . . . . 0.0 113.521 178.854 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.33 3.92 67.35 Favored Glycine 0 CA--C 1.538 1.512 0 C-N-CA 125.164 1.364 . . . . 0.0 114.569 -171.084 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 77.5 mt -93.04 169.06 10.71 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.758 1.223 . . . . 0.0 112.142 -171.258 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.491 HG23 ' H ' ' A' ' 50' ' ' ASN . 1.3 t -70.65 141.72 51.65 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 120.915 -1.116 . . . . 0.0 110.857 169.339 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.1 ptt180 -62.78 -11.67 19.3 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.06 0.944 . . . . 0.0 112.949 169.695 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 41.0 t -71.0 -58.44 3.57 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.555 1.142 . . . . 0.0 111.157 167.811 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.491 ' H ' HG23 ' A' ' 47' ' ' THR . 41.6 t-20 -55.08 -49.33 71.93 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.851 1.66 . . . . 0.0 110.811 173.394 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 5.0 t -60.08 -44.59 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-O 117.91 -1.043 . . . . 0.0 112.302 175.326 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 60.0 m -69.76 -35.66 75.12 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 121.335 1.88 . . . . 0.0 113.705 -179.686 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -50.54 -46.58 57.54 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.536 0.734 . . . . 0.0 110.887 172.14 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -82.2 -13.04 57.71 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 175.82 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 92.3 mt -78.78 -26.72 44.46 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 122.117 2.235 . . . . 0.0 110.906 168.637 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.0 m -45.51 -55.93 5.65 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.662 1.119 . . . . 0.0 113.08 172.917 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 1.7 t -93.2 4.64 53.66 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 179.388 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.7 tp -83.72 -40.68 18.56 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.871 -1.143 . . . . 0.0 108.657 167.159 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.2 mtm105 -76.86 -28.76 55.56 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.618 1.567 . . . . 0.0 110.585 173.552 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.71 -64.25 3.55 Favored Glycine 0 C--N 1.345 1.05 0 C-N-CA 125.431 1.491 . . . . 0.0 110.909 174.744 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 49.5 m -65.89 5.72 0.45 Allowed 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 125.7 1.6 . . . . 0.0 114.6 176.202 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.62 -2.4 31.59 Favored Glycine 0 N--CA 1.471 0.974 0 C-N-CA 126.03 1.776 . . . . 0.0 114.973 176.031 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 72.1 mt -59.85 -25.67 65.22 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.718 1.259 . . . . 0.0 113.51 -175.689 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 1.7 m -123.83 140.77 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.755 1.622 . . . . 0.0 111.815 169.002 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 51.6 t -118.61 138.64 48.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 127.18 2.192 . . . . 0.0 110.025 -175.988 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -76.49 143.05 40.7 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.605 1.162 . . . . 0.0 111.254 172.574 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.8 m -164.72 150.04 9.89 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 120.256 -1.528 . . . . 0.0 109.644 -176.788 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -84.16 126.34 33.02 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.166 1.348 . . . . 0.0 110.061 165.557 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . 0.282 0.0 OUTLIER -74.34 -41.47 61.03 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.477 0.581 . . . . 0.0 111.844 174.817 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 162.08 -30.36 0.3 Allowed Glycine 0 CA--C 1.531 1.073 0 C-N-CA 125.476 1.512 . . . . 0.0 114.116 169.724 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -112.58 -17.82 12.53 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 127.055 2.142 . . . . 0.0 112.61 172.116 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -151.21 164.27 36.95 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.81 2.444 . . . . 0.0 110.415 -171.913 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 4.2 p -82.55 152.89 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 123.559 0.743 . . . . 0.0 110.51 168.833 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.2 ptt180 -136.96 162.34 33.54 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 126.316 1.846 . . . . 0.0 111.3 -172.755 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -116.68 123.46 47.3 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.142 0.977 . . . . 0.0 108.466 166.463 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -125.3 149.11 48.38 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 117.011 -1.471 . . . . 0.0 110.989 -178.531 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.7 mp -61.0 151.28 31.03 Favored 'General case' 0 C--N 1.348 0.508 0 C-N-CA 118.697 -1.201 . . . . 0.0 108.562 170.291 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.04 -28.78 69.31 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 114.534 -1.212 . . . . 0.0 113.924 -168.912 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -171.7 161.66 6.09 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.644 2.378 . . . . 0.0 111.169 169.604 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.1 m -34.99 -32.73 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 131.024 3.729 . . . . 0.0 113.434 165.505 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -59.8 -56.0 27.3 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.895 1.678 . . . . 0.0 111.078 175.471 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -39.49 89.99 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 120.462 1.483 . . . . 0.0 110.977 176.827 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.7 -37.49 73.58 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-O 119.023 -0.513 . . . . 0.0 112.299 176.779 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -67.17 -45.79 75.96 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 119.433 1.015 . . . . 0.0 113.173 176.929 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.82 -42.94 80.74 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.44 1.018 . . . . 0.0 110.423 -177.229 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -61.83 -28.64 69.63 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 170.854 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -63.6 -30.18 76.86 Favored Glycine 0 CA--C 1.538 1.528 0 O-C-N 121.0 -1.062 . . . . 0.0 113.917 169.585 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -101.43 22.62 12.3 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 119.089 1.445 . . . . 0.0 111.698 166.551 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 19.4 tp 63.9 -40.88 0.23 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 131.005 3.722 . . . . 0.0 114.254 -171.694 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -170.8 -61.84 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 128.975 2.91 . . . . 0.0 108.481 -172.431 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 174.06 -35.06 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 126.347 1.859 . . . . 0.0 111.126 -173.371 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.1 p -73.48 26.33 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -171.39 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 62.87 25.27 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 125.107 1.363 . . . . 0.0 111.985 172.811 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.5 mp 90.95 95.44 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 131.573 3.949 . . . . 0.0 112.457 175.573 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.93 152.93 44.77 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 166.278 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.407 HG12 ' H ' ' A' ' 98' ' ' THR . 3.4 t -79.33 139.29 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.612 1.565 . . . . 0.0 112.504 -167.718 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -71.29 4.2 3.07 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 125.48 1.512 . . . . 0.0 114.514 174.55 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.407 ' H ' HG12 ' A' ' 96' ' ' VAL . 26.0 p -72.14 111.62 7.52 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 120.88 -1.138 . . . . 0.0 108.218 168.872 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -76.16 113.11 13.33 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 174.35 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -129.97 154.61 81.22 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-O 117.606 -1.188 . . . . 0.0 107.817 179.773 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -67.37 -18.93 49.99 Favored 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.505 2.137 . . . . 0.0 114.19 179.365 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . 0.394 1.8 t 136.06 -165.63 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.773 1 C-N-CA 134.117 4.967 . . . . 0.0 112.373 167.221 . . . . . . . . 3 2 . 1 . 029 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 42.0 t -110.62 -47.36 6.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 111.586 -2.552 . . . . 0.0 110.707 -165.156 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -134.31 32.28 3.41 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.139 1.376 . . . . 0.0 111.382 166.481 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -141.94 173.71 11.26 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 125.226 1.41 . . . . 0.0 108.478 169.245 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.4 ptt180 . . . . . 0 CA--C 1.528 0.097 0 C-N-CA 123.868 0.867 . . . . 0.0 112.02 -179.816 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.519 0 CA-C-O 119.342 -0.361 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 pp -59.76 -40.78 89.32 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 119.586 1.085 . . . . 0.0 113.009 -175.326 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.97 -14.29 62.64 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.213 1.005 . . . . 0.0 112.975 175.905 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 15.7 mmp_? -93.14 -33.56 13.99 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 120.764 -1.21 . . . . 0.0 112.22 169.473 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -57.3 -55.44 34.79 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 119.527 1.058 . . . . 0.0 109.317 169.725 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -64.56 -33.83 88.27 Favored Glycine 0 CA--C 1.53 0.996 0 CA-C-N 118.715 0.689 . . . . 0.0 112.311 -178.447 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -46.99 87.53 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 118.347 1.074 . . . . 0.0 110.207 171.33 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.67 -15.83 63.17 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.42 1.488 . . . . 0.0 113.506 -178.177 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 8.3 mp -102.71 -12.73 17.44 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.972 0.909 . . . . 0.0 112.586 169.272 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.45 -7.93 59.65 Favored 'General case' 0 CA--C 1.554 1.134 0 N-CA-C 116.985 2.217 . . . . 0.0 116.985 174.573 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -73.0 161.72 78.04 Favored Pre-proline 0 CA--C 1.543 0.707 0 N-CA-C 116.025 1.861 . . . . 0.0 116.025 -168.822 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -58.82 -70.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.868 1 C-N-CA 125.455 4.103 . . . . 0.0 111.518 168.465 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 24.6 m -75.68 -43.03 49.47 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 117.902 -1.047 . . . . 0.0 111.939 -179.506 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.426 ' HD2' HD13 ' B' ' 58' ' ' LEU . 0.3 OUTLIER -64.29 -40.27 95.61 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 121.006 1.73 . . . . 0.0 115.211 -169.643 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 14.6 t -60.85 -45.06 96.0 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 120.153 1.342 . . . . 0.0 110.351 170.867 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 33.0 ttm-85 -62.49 -23.67 67.05 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.464 1.106 . . . . 0.0 113.556 175.364 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . . . . . . . . . 2.7 mt -67.99 -57.13 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 120.156 1.344 . . . . 0.0 107.837 166.928 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 61.8 mt -55.6 -41.83 73.99 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 117.715 -1.136 . . . . 0.0 112.743 -174.367 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.1 m -61.35 -30.72 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-N 119.896 1.225 . . . . 0.0 112.65 176.652 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -95.62 -3.81 45.6 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.302 1.441 . . . . 0.0 112.525 -176.291 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.418 HD22 ' HA ' ' B' ' 30' ' ' LEU . 0.1 OUTLIER -90.67 -23.01 20.88 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 175.945 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.14 -61.21 2.37 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 128.806 2.842 . . . . 0.0 110.167 170.574 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -91.66 7.83 39.71 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 126.593 1.957 . . . . 0.0 113.078 175.655 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.87 -85.9 1.17 Allowed Glycine 0 N--CA 1.47 0.909 0 C-N-CA 125.02 1.295 . . . . 0.0 114.179 -168.376 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 20.9 m 39.14 15.83 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 N-CA-C 120.95 3.685 . . . . 0.0 120.95 179.793 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 69.6 m -79.39 -91.45 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.465 1.03 . . . . 0.0 111.791 -178.12 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . 0.513 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 1.8 m-85 -137.88 161.56 59.27 Favored Pre-proline 0 CA--C 1.555 1.161 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -168.216 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -55.61 132.41 51.95 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 123.285 2.657 . . . . 0.0 110.396 174.943 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.05 -6.57 26.92 Favored Glycine 0 CA--C 1.532 1.134 0 CA-C-O 117.686 -1.619 . . . . 0.0 114.827 -179.341 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . 0.513 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 2.6 pp0? -56.67 -36.14 69.23 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.686 1.743 . . . . 0.0 111.292 -179.689 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 8.7 mt -50.17 -32.84 17.24 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 125.103 1.361 . . . . 0.0 112.235 176.42 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.8 -53.16 58.85 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.496 0.589 . . . . 0.0 111.334 -177.751 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.5 -39.07 88.5 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.078 0.551 . . . . 0.0 112.083 175.797 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -63.23 -27.23 69.21 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.835 1.654 . . . . 0.0 113.708 179.175 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 18.0 mt -99.15 -21.48 16.12 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 126.144 1.778 . . . . 0.0 112.818 175.385 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.7 10.84 83.73 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 124.957 1.265 . . . . 0.0 113.737 -170.411 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 69.6 mt -105.87 168.87 8.83 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.381 1.473 . . . . 0.0 112.53 -170.727 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.53 HG23 ' H ' ' B' ' 50' ' ' ASN . 3.3 t -71.96 138.34 47.97 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 120.798 -1.188 . . . . 0.0 111.748 170.276 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . . . . . . . . . 23.2 ptt180 -59.72 -17.39 34.35 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.165 1.386 . . . . 0.0 112.587 169.628 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 39.2 t -66.79 -58.13 5.66 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 119.91 1.232 . . . . 0.0 112.142 168.882 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . 0.53 ' H ' HG23 ' B' ' 47' ' ' THR . 35.0 t-20 -56.84 -51.71 67.95 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.501 1.521 . . . . 0.0 110.548 173.285 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 94.0 t -62.01 -37.65 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-O 118.305 -0.855 . . . . 0.0 112.02 -178.647 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 24.5 m -74.91 -35.49 62.22 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 120.89 1.677 . . . . 0.0 113.857 175.648 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -50.88 -45.28 59.95 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.127 0.876 . . . . 0.0 111.64 170.628 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -75.64 -19.82 58.92 Favored 'General case' 0 CA--C 1.551 1.013 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 174.673 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 28.5 mt -80.02 -20.68 44.79 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.501 1.5 . . . . 0.0 113.192 171.586 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 43.4 m -44.09 -55.86 4.44 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 120.161 1.346 . . . . 0.0 112.323 172.416 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 1.8 t -93.44 -10.79 33.88 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 179.28 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.426 HD13 ' HD2' ' B' ' 23' ' ' ARG . 6.4 tp -69.34 -34.62 74.9 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.446 -1.408 . . . . 0.0 109.621 168.645 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.4 ' HG2' HG23 ' B' ' 64' ' ' VAL . 74.7 mtm180 -80.77 -22.26 40.3 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.798 1.239 . . . . 0.0 112.683 169.72 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -69.79 -65.44 2.56 Favored Glycine 0 N--CA 1.472 1.092 0 C-N-CA 125.21 1.386 . . . . 0.0 111.571 175.7 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 56.3 m -67.23 5.12 0.77 Allowed 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 125.796 1.639 . . . . 0.0 114.338 175.23 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 75.07 6.53 79.64 Favored Glycine 0 C--N 1.343 0.961 0 O-C-N 120.85 -1.157 . . . . 0.0 114.188 172.57 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.404 HD12 HD12 ' B' ' 58' ' ' LEU . 98.4 mt -62.12 -31.41 71.86 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.748 1.219 . . . . 0.0 112.929 179.605 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.4 HG23 ' HG2' ' B' ' 59' ' ' ARG . 1.6 m -125.18 136.02 62.19 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 126.214 1.805 . . . . 0.0 112.333 170.99 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 47.3 t -119.11 137.98 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 127.357 2.263 . . . . 0.0 111.35 -171.242 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -80.22 142.75 34.36 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.831 1.252 . . . . 0.0 112.613 173.463 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.9 m -167.4 142.49 3.93 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 117.034 -1.46 . . . . 0.0 111.768 -173.993 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -74.72 121.03 21.07 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 121.31 1.868 . . . . 0.0 109.276 165.658 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . 0.305 0.0 OUTLIER -68.24 -55.72 11.22 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 118.234 -0.888 . . . . 0.0 109.858 175.185 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -173.55 -32.7 0.03 OUTLIER Glycine 0 CA--C 1.535 1.287 0 C-N-CA 125.769 1.652 . . . . 0.0 113.984 169.171 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 29.2 tpt180 -114.0 -19.45 11.41 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.601 2.36 . . . . 0.0 113.413 176.729 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -149.55 164.9 33.8 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 128.468 2.707 . . . . 0.0 109.926 -170.821 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . . . . . . . . . 4.2 p -79.32 147.15 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 121.22 -0.925 . . . . 0.0 109.845 168.672 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 12.8 ptt180 -128.68 160.96 30.83 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 127.043 2.137 . . . . 0.0 110.674 -176.18 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -111.39 121.4 45.13 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 106.873 -1.529 . . . . 0.0 106.873 167.069 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -123.42 154.65 38.75 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 117.156 -1.402 . . . . 0.0 111.243 174.741 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 mp -66.87 152.8 44.94 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 117.771 -1.572 . . . . 0.0 106.886 166.602 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.8 -24.05 67.56 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -170.401 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -173.66 161.34 3.91 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.931 1.692 . . . . 0.0 112.157 171.197 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -36.92 -34.55 0.08 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 130.504 3.521 . . . . 0.0 113.523 166.251 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 22.1 t60 -62.82 -52.44 63.14 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.707 1.203 . . . . 0.0 110.425 177.854 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.35 -41.65 93.64 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 120.471 1.487 . . . . 0.0 111.076 175.206 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -57.26 -35.04 69.25 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 178.104 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 3.2 ptm85 -74.21 -39.1 63.36 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 177.566 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.15 -44.41 84.22 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.452 1.024 . . . . 0.0 110.058 176.144 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -54.33 -42.27 70.01 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.248 0.619 . . . . 0.0 111.597 169.76 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -60.83 -19.84 56.3 Favored Glycine 0 CA--C 1.541 1.683 0 C-N-CA 124.858 1.218 . . . . 0.0 115.184 177.037 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . 0.253 9.7 pt-20 -121.14 25.49 9.53 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.343 1.571 . . . . 0.0 112.626 165.961 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 58.0 tp 66.54 -49.3 0.45 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 131.229 3.812 . . . . 0.0 113.058 -173.363 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 33.5 t -153.48 -51.76 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 C-N-CA 128.649 2.78 . . . . 0.0 107.87 169.502 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 175.54 -22.06 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.992 1.317 . . . . 0.0 114.452 -160.619 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 8.4 p -74.49 26.64 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 O-C-N 120.247 -1.533 . . . . 0.0 113.508 -178.283 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER 61.18 28.05 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.919 0 C-N-CA 124.346 1.058 . . . . 0.0 111.319 176.137 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 5.8 mp 75.13 111.35 0.07 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 130.247 3.419 . . . . 0.0 113.435 -171.902 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -76.31 169.47 18.16 Favored 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 163.307 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 16.0 t -82.24 141.1 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 O-C-N 120.832 -1.167 . . . . 0.0 112.814 -168.793 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -75.18 61.11 1.11 Allowed 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.565 1.146 . . . . 0.0 112.254 167.968 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 18.1 p -127.0 135.85 51.42 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 125.952 1.701 . . . . 0.0 107.75 168.39 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -87.86 116.98 26.4 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 170.105 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -144.33 160.59 48.04 Favored Pre-proline 0 CA--C 1.544 0.736 0 C-N-CA 125.425 1.49 . . . . 0.0 108.514 -172.912 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -78.25 40.53 0.9 Allowed 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.91 3.74 . . . . 0.0 113.781 175.516 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 1.8 t 58.5 -146.23 0.53 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.625 1.97 . . . . 0.0 113.082 -178.145 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 21.9 t -122.8 -45.35 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.921 1.288 . . . . 0.0 112.729 -168.13 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -132.69 40.99 3.22 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.908 1.283 . . . . 0.0 111.053 168.981 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.95 -170.1 2.1 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 128.225 2.61 . . . . 0.0 107.472 171.572 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . 0.311 31.5 ptt180 . . . . . 0 N--CA 1.485 1.296 0 C-N-CA 128.135 2.574 . . . . 0.0 115.644 168.195 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.441 ' HB1' ' HB2' ' A' ' 13' ' ' ARG . . . . . . . . 0 CA--C 1.536 0.416 0 N-CA-C 113.045 0.758 . . . . 0.0 113.045 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.0 tp -56.41 -34.16 66.49 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 120.606 -1.309 . . . . 0.0 112.188 173.663 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -49.05 -39.09 26.14 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.17 1.788 . . . . 0.0 112.354 169.888 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.441 ' HB2' ' HB1' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -63.93 -14.76 56.16 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 126.109 1.764 . . . . 0.0 112.845 -176.862 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -72.01 -58.01 3.8 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.782 0.833 . . . . 0.0 108.954 167.006 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -57.65 -32.46 65.28 Favored Glycine 0 C--N 1.337 0.622 0 CA-C-O 118.681 -1.066 . . . . 0.0 112.263 -169.789 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.42 -22.26 65.54 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.044 1.422 . . . . 0.0 111.552 177.267 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -80.78 -17.14 51.87 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.324 -1.485 . . . . 0.0 113.699 172.325 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.7 mp -103.34 -18.14 14.98 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.527 0.731 . . . . 0.0 112.224 172.425 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' B' ' 12' ' ' ALA . . . -65.77 15.63 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 129.366 3.066 . . . . 0.0 116.355 177.071 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.97 145.38 30.39 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 126.554 1.942 . . . . 0.0 109.418 -177.168 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -62.48 -84.96 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.68 1 C-N-CA 126.059 4.506 . . . . 0.0 112.309 -169.298 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 85.8 m -44.45 -40.72 5.73 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 126.203 1.801 . . . . 0.0 111.282 170.857 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.8 ttp180 -74.6 -32.65 62.42 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 116.249 1.944 . . . . 0.0 116.249 -168.667 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 50.5 t -63.37 -39.79 95.49 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 120.377 1.444 . . . . 0.0 109.616 168.287 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 39.2 mtt180 -65.17 -40.1 93.83 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.429 1.092 . . . . 0.0 111.459 176.63 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 8.7 mt -47.6 -56.45 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-N 119.623 1.101 . . . . 0.0 110.981 167.541 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 74.6 mt -60.04 -44.65 94.51 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.263 -1.335 . . . . 0.0 112.695 -178.222 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -66.09 -31.38 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 CA-C-N 120.18 1.355 . . . . 0.0 113.251 174.456 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.78 7.34 21.01 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.789 2.035 . . . . 0.0 114.433 173.611 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.553 HD22 ' HA ' ' A' ' 76' ' ' ALA . 7.1 mt -101.44 -28.91 12.31 Favored 'General case' 0 N--CA 1.435 -1.177 0 C-N-CA 126.917 2.087 . . . . 0.0 113.054 167.374 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 7.1 mt -62.41 -42.14 99.21 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 124.435 1.085 . . . . 0.0 109.169 168.588 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -124.59 86.96 2.64 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.9 2.08 . . . . 0.0 110.91 169.91 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -171.34 -86.21 0.06 OUTLIER Glycine 0 N--CA 1.474 1.216 0 C-N-CA 127.263 2.363 . . . . 0.0 113.227 174.415 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 18.5 m 37.36 38.31 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 127.485 2.314 . . . . 0.0 116.79 -179.267 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.409 ' HB2' ' HG2' ' A' ' 39' ' ' GLN . 9.4 m -83.76 -79.53 0.2 Allowed 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 126.374 1.87 . . . . 0.0 110.568 -176.729 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -147.83 145.34 20.86 Favored Pre-proline 0 N--CA 1.475 0.784 0 C-N-CA 125.696 1.598 . . . . 0.0 110.209 -172.226 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.97 -10.34 22.55 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.023 2.482 . . . . 0.0 116.676 -169.138 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.65 -2.39 40.28 Favored Glycine 0 CA--C 1.539 1.562 0 CA-C-N 119.885 1.22 . . . . 0.0 114.871 169.219 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.43 HE22 ' CD2' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -60.46 -29.4 69.02 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.034 1.334 . . . . 0.0 113.292 -171.959 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 29.4 mt -49.97 -28.28 6.6 Favored 'General case' 0 C--O 1.218 -0.588 0 C-N-CA 125.878 1.671 . . . . 0.0 111.808 179.602 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -75.07 -32.95 61.61 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 113.138 0.792 . . . . 0.0 113.138 -173.616 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.89 -36.57 28.01 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.153 0.501 . . . . 0.0 110.697 169.037 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.43 ' CD2' HE22 ' A' ' 39' ' ' GLN . 11.3 t60 -73.39 -31.59 63.98 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 113.623 0.972 . . . . 0.0 113.623 -174.131 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.8 mt -96.09 -19.43 19.42 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.692 1.597 . . . . 0.0 112.676 172.66 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.07 -5.12 20.53 Favored Glycine 0 CA--C 1.536 1.386 0 CA-C-O 118.832 -0.982 . . . . 0.0 113.594 -168.471 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -73.71 133.71 43.4 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.608 1.563 . . . . 0.0 109.891 175.578 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.4 t -60.83 146.02 47.81 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.646 1.112 . . . . 0.0 111.511 -177.283 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.428 ' CD ' ' H ' ' A' ' 48' ' ' ARG . 0.0 OUTLIER -55.0 -29.72 57.94 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 -174.659 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.2 m -63.86 -48.76 75.45 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 119.059 0.845 . . . . 0.0 112.374 170.408 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -64.37 -46.27 84.13 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.901 1.68 . . . . 0.0 110.968 178.039 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 1.2 t -56.66 -44.57 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 124.17 0.988 . . . . 0.0 111.905 170.181 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 97.2 p -67.62 -38.38 83.83 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.725 1.148 . . . . 0.0 113.971 179.423 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -56.94 -52.19 66.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.748 1.219 . . . . 0.0 109.839 174.976 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -72.15 -27.59 62.69 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 120.825 -1.172 . . . . 0.0 113.983 177.464 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 34.6 mt -67.85 -33.13 74.17 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 121.473 1.942 . . . . 0.0 112.566 169.59 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.7 m -59.51 -34.59 72.8 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.404 0.682 . . . . 0.0 112.006 -177.939 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.462 ' SG ' ' HB2' ' B' ' 104' ' ' ALA . 34.1 t -75.87 -43.07 47.33 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.673 -0.642 . . . . 0.0 111.912 173.624 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.3 tp -71.32 -39.4 71.43 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.589 1.556 . . . . 0.0 112.848 -169.243 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -74.09 -7.86 54.05 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.605 1.162 . . . . 0.0 111.766 173.186 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -100.05 -40.39 3.08 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.749 1.642 . . . . 0.0 113.452 172.997 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 65.3 m -75.35 1.11 14.64 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.043 1.737 . . . . 0.0 112.688 170.661 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.24 2.92 80.78 Favored Glycine 0 N--CA 1.467 0.709 0 C-N-CA 127.42 2.438 . . . . 0.0 116.494 166.778 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 76.5 mt -71.43 -20.04 62.16 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.623 1.712 . . . . 0.0 113.893 -175.001 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.454 HG12 ' CD1' ' A' ' 30' ' ' LEU . 6.3 m -126.97 140.35 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.226 1.411 . . . . 0.0 113.791 -178.559 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.1 t -141.33 142.24 29.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.974 -170.821 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -90.14 148.02 23.24 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.357 1.463 . . . . 0.0 113.582 171.833 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -135.49 178.6 6.91 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.124 1.769 . . . . 0.0 106.964 167.923 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -96.11 128.79 43.34 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 166.368 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -19.43 60.06 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.25 1.02 . . . . 0.0 112.492 168.948 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 128.16 -40.95 1.65 Allowed Glycine 0 N--CA 1.471 1.002 0 C-N-CA 125.526 1.536 . . . . 0.0 112.381 172.85 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -91.94 -38.1 12.47 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.599 1.959 . . . . 0.0 110.733 171.819 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.23 -175.84 4.59 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.945 2.098 . . . . 0.0 110.693 177.793 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.6 151.42 5.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 C-N-CA 123.481 0.712 . . . . 0.0 109.838 168.013 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -120.91 -173.31 2.57 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 126.918 2.087 . . . . 0.0 108.861 167.234 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.521 ' CE2' HD21 ' A' ' 30' ' ' LEU . 0.8 OUTLIER -145.07 161.29 39.81 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.65 1.18 . . . . 0.0 108.122 -179.393 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.553 ' HA ' HD22 ' A' ' 30' ' ' LEU . . . -166.9 159.49 13.54 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 120.669 1.577 . . . . 0.0 112.887 -168.957 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -60.7 137.11 58.22 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 165.668 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.32 -23.38 66.73 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 114.785 1.402 . . . . 0.0 114.785 -173.8 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -159.23 161.72 36.09 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.267 1.027 . . . . 0.0 113.17 168.722 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 54.6 p -42.91 -35.33 1.17 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.572 1.949 . . . . 0.0 112.76 166.877 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.08 -48.81 77.68 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.581 1.552 . . . . 0.0 112.764 177.661 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 9.7 mt -69.65 -47.24 64.03 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.75 1.159 . . . . 0.0 109.003 179.226 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -55.03 -16.82 3.12 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.853 1.661 . . . . 0.0 114.552 172.437 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -79.23 -67.05 0.79 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.821 1.248 . . . . 0.0 109.996 176.373 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.72 -32.49 72.72 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 178.941 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 tp -68.17 -32.61 72.98 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.766 1.627 . . . . 0.0 111.441 169.662 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -86.17 -36.52 9.87 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 127.273 2.368 . . . . 0.0 115.632 -172.02 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.83 -9.76 58.86 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 119.75 1.775 . . . . 0.0 112.853 169.17 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.2 tt 67.87 142.31 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 127.002 2.121 . . . . 0.0 108.031 -170.906 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 33.9 m -69.71 19.41 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 O-C-N 120.328 -1.483 . . . . 0.0 114.091 -175.107 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 47.3 mm-40 77.08 -13.88 0.9 Allowed 'General case' 0 N--CA 1.447 -0.598 0 O-C-N 120.685 -1.26 . . . . 0.0 113.707 156.519 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 5.2 p -68.38 35.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 126.966 2.106 . . . . 0.0 115.605 -177.105 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.3 t 69.07 4.76 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 125.941 1.696 . . . . 0.0 112.529 173.055 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.8 mp 97.34 105.49 0.01 OUTLIER 'General case' 0 C--N 1.348 0.521 0 C-N-CA 131.302 3.841 . . . . 0.0 110.259 -170.447 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.76 66.05 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 126.962 2.105 . . . . 0.0 114.459 176.462 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 14.1 m -52.49 138.19 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 O-C-N 121.568 -0.707 . . . . 0.0 110.412 168.563 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -59.35 -30.99 68.79 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.396 0.678 . . . . 0.0 112.44 -168.449 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.1 m 70.61 151.46 0.1 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 128.315 2.646 . . . . 0.0 111.633 178.524 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -87.36 1.34 53.6 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.859 1.664 . . . . 0.0 114.151 175.261 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.2 146.91 35.77 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 115.073 1.509 . . . . 0.0 115.073 -166.998 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -94.48 17.96 0.86 Allowed 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 124.029 3.153 . . . . 0.0 114.438 -178.325 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 11.5 t -71.19 173.15 8.04 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 124.65 2.167 . . . . 0.0 113.893 -177.871 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 97.4 t -69.26 -22.39 25.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 C-N-CA 126.179 1.791 . . . . 0.0 111.288 -178.883 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -83.84 2.42 38.37 Favored 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 -178.888 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.4 pm0 -151.54 -148.07 0.25 Allowed 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 125.821 1.648 . . . . 0.0 112.923 -179.422 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 66.1 mtp180 . . . . . 0 N--CA 1.477 0.88 0 C-N-CA 131.241 3.816 . . . . 0.0 113.921 169.184 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.22 0 CA-C-O 122.192 0.996 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.458 HD22 ' H ' ' B' ' 11' ' ' LEU . 0.8 OUTLIER -60.44 -11.25 6.31 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.526 168.769 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 12' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' A' ' 19' ' ' ALA . . . -51.51 -45.88 63.03 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.009 0.924 . . . . 0.0 111.533 167.701 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -30.24 67.14 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.226 1.81 . . . . 0.0 111.934 175.442 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -81.39 -46.71 14.24 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.056 -1.027 . . . . 0.0 111.358 172.619 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.59 -32.3 68.82 Favored Glycine 0 C--O 1.219 -0.83 0 C-N-CA 124.493 1.044 . . . . 0.0 111.803 -178.165 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.6 -32.28 72.05 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.001 1.401 . . . . 0.0 111.171 173.739 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -80.63 -20.58 42.84 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 176.189 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.5 mp -101.78 -23.04 14.25 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 118.951 0.796 . . . . 0.0 112.761 175.198 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -83.64 37.76 0.6 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.372 1.469 . . . . 0.0 114.877 178.132 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.94 142.39 24.53 Favored Pre-proline 0 CA--C 1.55 0.947 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 168.181 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -59.0 -85.38 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.785 1 C-N-CA 125.793 4.329 . . . . 0.0 112.676 -167.482 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 58.9 m -49.58 -33.93 16.38 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 126.357 1.863 . . . . 0.0 112.507 170.09 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 23' ' ' ARG . . . . . 0.509 ' HG2' HD13 ' B' ' 58' ' ' LEU . 18.2 ttp180 -72.08 -38.87 69.33 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -170.824 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 37.1 t -56.93 -39.95 75.46 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.249 0.931 . . . . 0.0 110.369 168.709 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 16.1 mtt-85 -64.59 -38.92 92.65 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-O 118.485 -0.769 . . . . 0.0 113.061 175.161 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 26' ' ' ILE . . . . . 0.416 HG13 ' HA ' ' B' ' 23' ' ' ARG . 3.0 mt -52.09 -49.61 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 CA-C-N 120.069 1.304 . . . . 0.0 111.835 169.426 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 92.6 mt -65.4 -47.12 77.4 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.939 -178.242 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.24 -33.85 65.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 118.911 0.778 . . . . 0.0 112.562 178.099 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.1 -9.25 59.07 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.84 1.256 . . . . 0.0 113.419 174.265 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.557 HD21 ' CD2' ' B' ' 75' ' ' TYR . 5.6 mt -82.9 -37.96 23.52 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 117.361 -1.304 . . . . 0.0 112.353 167.079 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 1.2 mt -55.82 -46.22 78.14 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 125.195 1.56 . . . . 0.0 110.754 175.498 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -107.03 46.41 0.93 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 129.037 2.935 . . . . 0.0 110.453 177.762 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -150.9 -84.29 0.05 OUTLIER Glycine 0 N--CA 1.47 0.952 0 N-CA-C 116.996 1.559 . . . . 0.0 116.996 -176.261 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 34.9 m 49.57 -12.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 C-N-CA 129.175 2.99 . . . . 0.0 118.849 -168.348 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 51.9 m -37.01 -82.23 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 127.016 2.126 . . . . 0.0 116.368 -167.368 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 36' ' ' TYR . . . . . 0.459 ' H ' ' HG2' ' B' ' 39' ' ' GLN . 7.3 m-85 -149.64 143.88 17.23 Favored Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 126.364 1.865 . . . . 0.0 109.809 -174.656 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -65.7 -7.18 15.69 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 124.07 3.18 . . . . 0.0 116.88 -168.686 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.9 -14.3 21.42 Favored Glycine 0 CA--C 1.536 1.366 0 CA-C-N 120.078 1.308 . . . . 0.0 115.161 171.053 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . 0.459 ' HG2' ' H ' ' B' ' 36' ' ' TYR . 0.9 OUTLIER -69.92 -19.85 63.38 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 115.146 1.535 . . . . 0.0 115.146 -169.072 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 20.7 mt -44.51 -32.28 1.36 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.019 1.328 . . . . 0.0 112.333 175.928 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.16 -40.41 77.2 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -178.078 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.72 -43.38 37.68 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.141 0.496 . . . . 0.0 110.92 174.747 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 43' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -64.78 -24.09 67.45 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.79 1.236 . . . . 0.0 113.792 -177.011 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 20.4 mt -109.39 -18.12 13.63 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.224 1.809 . . . . 0.0 113.799 179.043 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.48 -9.59 54.35 Favored Glycine 0 CA--C 1.536 1.346 0 CA-C-O 118.383 -1.232 . . . . 0.0 114.487 -169.941 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -70.04 131.94 45.11 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 126.889 2.076 . . . . 0.0 111.786 177.541 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 6.1 t -59.81 140.49 56.53 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 119.985 -1.697 . . . . 0.0 109.242 168.935 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 48' ' ' ARG . . . . . 0.44 ' HD3' ' H ' ' B' ' 48' ' ' ARG . 0.0 OUTLIER -59.58 -21.0 59.7 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -174.497 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 5.7 m -64.44 -48.55 74.9 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.946 1.248 . . . . 0.0 111.272 169.488 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -70.46 -38.9 74.53 Favored 'General case' 0 CA--C 1.546 0.821 0 O-C-N 121.538 -0.726 . . . . 0.0 111.23 176.248 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -62.15 -35.87 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 O-C-N 120.877 -1.139 . . . . 0.0 111.978 172.352 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 96.2 p -67.91 -30.22 69.49 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 120.038 1.29 . . . . 0.0 114.404 175.661 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 55.5 t-20 -60.3 -59.87 4.72 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.678 0.791 . . . . 0.0 110.589 178.94 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 54' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -67.94 -19.37 64.97 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 176.511 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 40.0 mt -73.78 -29.24 62.08 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 121.377 1.899 . . . . 0.0 112.493 169.493 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 56' ' ' SER . . . . . . . . . . . . . 45.4 m -61.88 -29.18 70.02 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.429 0.559 . . . . 0.0 111.807 175.942 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 57' ' ' CYS . . . . . . . . . . . . . 11.4 t -80.37 -50.72 9.76 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 118.881 0.764 . . . . 0.0 111.388 169.163 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.509 HD13 ' HG2' ' B' ' 23' ' ' ARG . 6.7 tp -58.12 -41.05 82.8 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.099 0.96 . . . . 0.0 113.016 -172.642 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.498 ' HG2' HG23 ' B' ' 64' ' ' VAL . 82.8 mtt180 -82.34 -6.42 59.25 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.545 1.538 . . . . 0.0 113.167 179.353 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -97.74 -43.96 2.78 Favored Glycine 0 N--CA 1.472 1.04 0 C-N-CA 124.758 1.171 . . . . 0.0 111.666 172.086 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . . 80.8 m -75.87 9.03 2.6 Favored 'General case' 0 CA--C 1.557 1.212 0 C-N-CA 127.463 2.305 . . . . 0.0 113.849 177.329 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.19 11.34 81.9 Favored Glycine 0 N--CA 1.471 1.022 0 C-N-CA 128.242 2.829 . . . . 0.0 117.216 167.493 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 95.5 mt -80.82 -21.88 40.47 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 118.799 1.3 . . . . 0.0 114.105 -173.846 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.498 HG23 ' HG2' ' B' ' 59' ' ' ARG . 5.2 m -137.63 149.51 25.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 125.303 1.441 . . . . 0.0 113.915 -174.601 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 77.3 t -145.01 147.17 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -176.996 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.72 147.98 28.96 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 127.737 2.415 . . . . 0.0 112.065 169.8 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -136.78 170.61 15.8 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.379 1.872 . . . . 0.0 107.395 175.658 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 68' ' ' TYR . . . . . 0.416 ' HA ' ' HA ' ' B' ' 73' ' ' VAL . 0.4 OUTLIER -81.41 133.0 35.35 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 162.929 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.52 -9.1 58.64 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 119.279 0.945 . . . . 0.0 112.842 167.985 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . 126.29 -15.55 6.81 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 126.224 1.869 . . . . 0.0 113.754 173.452 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.48 -40.57 0.51 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.042 2.137 . . . . 0.0 110.616 -172.887 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 72' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -127.64 177.45 6.78 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 128.468 2.707 . . . . 0.0 108.063 167.738 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 73' ' ' VAL . . . . . 0.416 ' HA ' ' HA ' ' B' ' 68' ' ' TYR . 2.3 m -86.48 143.55 11.2 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 123.152 0.581 . . . . 0.0 109.609 165.731 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 12.3 ptt180 -106.17 -176.44 3.08 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 127.127 2.171 . . . . 0.0 108.64 172.202 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.557 ' CD2' HD21 ' B' ' 30' ' ' LEU 0.254 0.2 OUTLIER -143.76 171.54 14.07 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 124.709 1.204 . . . . 0.0 109.696 171.618 . . . . . . . . 4 4 . 1 . 030 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.513 ' HA ' HD22 ' B' ' 30' ' ' LEU . . . -174.27 159.36 3.12 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.622 1.569 . . . . 0.0 111.687 -169.38 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -60.51 142.22 55.54 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 164.864 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.43 -23.26 65.7 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -174.841 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -157.56 159.36 37.04 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 168.366 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 56.6 p -44.25 -34.93 2.06 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 113.683 -1.598 . . . . 0.0 112.002 165.295 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -60.93 -45.65 93.85 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.582 1.553 . . . . 0.0 111.915 -179.489 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 9.0 mt -69.06 -45.64 69.88 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.447 1.021 . . . . 0.0 109.53 174.684 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.63 -20.73 50.22 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.965 1.306 . . . . 0.0 113.797 178.008 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 tpm_? -75.11 -66.52 0.75 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.591 1.556 . . . . 0.0 110.404 177.518 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.33 -36.26 79.65 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.022 0.828 . . . . 0.0 113.208 178.632 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 49.8 tp -61.89 -38.07 86.97 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.724 1.21 . . . . 0.0 111.13 169.494 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 87' ' ' GLY . . . . . . . . . . . . . . . -78.97 -42.69 11.98 Favored Glycine 0 C--N 1.341 0.815 0 C-N-CA 127.509 2.481 . . . . 0.0 114.968 -171.754 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.22 -12.02 60.98 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.142 1.471 . . . . 0.0 112.484 168.843 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 89' ' ' LEU . . . . . 0.416 HD23 ' H ' ' B' ' 91' ' ' GLN . 9.7 tt 72.22 142.41 0.06 Allowed 'General case' 0 C--N 1.342 0.279 0 C-N-CA 127.554 2.341 . . . . 0.0 108.849 175.539 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 33.7 m -60.4 12.99 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 116.819 2.155 . . . . 0.0 116.819 -173.489 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 91' ' ' GLN . . . . . 0.416 ' H ' HD23 ' B' ' 89' ' ' LEU . 26.0 mm-40 78.43 -18.79 0.48 Allowed 'General case' 0 CA--C 1.535 0.367 0 O-C-N 120.347 -1.47 . . . . 0.0 114.281 155.865 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 2.8 p -66.8 32.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 126.795 2.038 . . . . 0.0 115.132 177.517 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER 61.77 10.95 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 C-N-CA 125.645 1.578 . . . . 0.0 113.509 -179.686 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 10.1 mp 86.04 115.67 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 131.35 3.86 . . . . 0.0 109.709 -168.58 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -72.05 146.18 47.77 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-O 121.475 0.655 . . . . 0.0 110.688 167.172 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 96' ' ' VAL . . . . . 0.401 ' C ' ' HB3' ' A' ' 10' ' ' ALA . 31.9 m -126.58 164.5 26.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 127.884 2.474 . . . . 0.0 109.138 -173.787 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 97' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -64.04 -29.4 70.55 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 122.96 0.504 . . . . 0.0 111.888 -171.084 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 86.1 153.77 0.07 Allowed 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 130.752 3.621 . . . . 0.0 112.718 169.302 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 -91.81 -12.33 34.06 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 126.051 1.741 . . . . 0.0 113.154 169.447 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -123.52 122.37 26.61 Favored Pre-proline 0 CA--C 1.542 0.654 0 CA-C-O 117.82 -1.086 . . . . 0.0 110.149 169.561 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -80.82 151.58 18.98 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 124.272 3.315 . . . . 0.0 111.584 169.071 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 102' ' ' CYS . . . . . . . . . . . . . 44.2 t -147.15 177.7 8.97 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 124.485 2.088 . . . . 0.0 112.168 -179.489 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 23.0 t -75.72 -20.37 15.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 C-N-CA 126.838 2.055 . . . . 0.0 110.223 175.936 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . 0.462 ' HB2' ' SG ' ' A' ' 57' ' ' CYS . . . -68.93 5.59 1.1 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.769 1.627 . . . . 0.0 114.207 168.189 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 105' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -165.84 -138.3 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.567 1.147 . . . . 0.0 113.472 -169.879 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 52.8 mtp180 . . . . . 0 CA--C 1.554 1.097 1 C-N-CA 133.919 4.887 . . . . 0.0 111.185 -175.302 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' B' B ' 107' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_